USER MOD reduce.3.24.130724 H: found=0, std=0, add=1070, rem=0, adj=48 USER MOD reduce.3.24.130724 removed 1069 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 12 SER OG : rot 178:sc= 0.966 USER MOD Set 1.2: A 139 THR OG1 : rot -97:sc= 1.02 USER MOD Set 2.1: A 25 ASN : amide:sc= -5.27! C(o=-6.4!,f=-7!) USER MOD Set 2.2: A 27 LYS NZ :NH3+ 167:sc= -1.08 (180deg=0.0784) USER MOD Set 2.3: A 42 SER OG : rot -140:sc= -0.0895 USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot 120:sc= -0.716 USER MOD Single : A 6 THR OG1 : rot 160:sc= -0.72 USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= -1.82 K(o=-1.8,f=-1.3) USER MOD Single : A 15 GLN : amide:sc= 0 K(o=0,f=-1.5) USER MOD Single : A 17 GLN : amide:sc= -0.64 X(o=-0.64,f=-0.21) USER MOD Single : A 18 MET CE :methyl 142:sc= -0.15 (180deg=-0.984) USER MOD Single : A 19 ASN : amide:sc= -6.25 K(o=-6.3,f=-4.4!) USER MOD Single : A 20 LYS NZ :NH3+ -147:sc= 1.11 (180deg=0.332) USER MOD Single : A 21 MET CE :methyl -157:sc= -0.251 (180deg=-1.32) 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= -0.0021 K(o=-0.0021,f=-0.53) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot -141:sc= -0.5 USER MOD Single : A 45 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.718 USER MOD Single : A 48 LYS NZ :NH3+ 173:sc= -0.572 (180deg=-0.665) 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 173:sc= 0.00105 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= 0.465 K(o=0.46,f=-2.9!) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 ASN : amide:sc= -2.08 K(o=-2.1,f=-6.6!) USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=-0.026) USER MOD Single : A 62 TYR OH : rot 180:sc= -0.497 USER MOD Single : A 63 TYR OH : rot -71:sc= 0.353 USER MOD Single : A 66 THR OG1 : rot 180:sc= -0.171 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= -0.979 X(o=-0.98,f=-1) USER MOD Single : A 78 SER OG : rot 180:sc= -0.0523 USER MOD Single : A 80 TYR OH : rot 180:sc= -0.744 USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ -130:sc= 0 (180deg=-0.444) USER MOD Single : A 91 GLN : amide:sc= -0.136 X(o=-0.14,f=-0.21) USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.296 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 180:sc= 0 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 HIS : no HD1:sc=-0.00838 X(o=-0.0084,f=-0.0084) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot -23:sc= 1.15 USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot -47:sc= 1.01 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 GLN : amide:sc= -0.879 K(o=-0.88,f=-1.9!) USER MOD Single : A 116 ASN : amide:sc= -0.741 K(o=-0.74,f=-3.1!) USER MOD Single : A 118 MET CE :methyl 128:sc= -0.13 (180deg=-0.995) USER MOD Single : A 120 ASN : amide:sc= -0.176 X(o=-0.18,f=0) USER MOD Single : A 126 SER OG : rot 20:sc= 1.12 USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= -1.03 K(o=-1,f=-0.34) USER MOD Single : A 130 SER OG : rot 34:sc= 0.339 USER MOD Single : A 134 SER OG : rot -63:sc= 1.28 USER MOD Single : A 146 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 115.589 -22.007 9.466 1.00 0.00 N ATOM 2 CA ALA A 1 116.132 -23.098 8.608 1.00 0.00 C ATOM 3 C ALA A 1 117.041 -22.498 7.541 1.00 0.00 C ATOM 4 O ALA A 1 118.252 -22.711 7.553 1.00 0.00 O ATOM 5 CB ALA A 1 114.972 -23.846 7.948 1.00 0.00 C ATOM 0 H1 ALA A 1 114.969 -22.414 10.195 1.00 0.00 H new ATOM 0 H2 ALA A 1 116.374 -21.501 9.923 1.00 0.00 H new ATOM 0 H3 ALA A 1 115.044 -21.343 8.880 1.00 0.00 H new ATOM 0 HA ALA A 1 116.708 -23.795 9.216 1.00 0.00 H new ATOM 0 HB1 ALA A 1 115.365 -24.645 7.319 1.00 0.00 H new ATOM 0 HB2 ALA A 1 114.329 -24.273 8.718 1.00 0.00 H new ATOM 0 HB3 ALA A 1 114.394 -23.154 7.336 1.00 0.00 H new ATOM 13 N THR A 2 116.446 -21.744 6.619 1.00 0.00 N ATOM 14 CA THR A 2 117.205 -21.110 5.543 1.00 0.00 C ATOM 15 C THR A 2 116.986 -19.601 5.561 1.00 0.00 C ATOM 16 O THR A 2 115.875 -19.130 5.806 1.00 0.00 O ATOM 17 CB THR A 2 116.764 -21.676 4.192 1.00 0.00 C ATOM 18 OG1 THR A 2 116.868 -23.092 4.217 1.00 0.00 O ATOM 19 CG2 THR A 2 117.658 -21.117 3.084 1.00 0.00 C ATOM 0 H THR A 2 115.443 -21.557 6.595 1.00 0.00 H new ATOM 0 HA THR A 2 118.265 -21.317 5.693 1.00 0.00 H new ATOM 0 HB THR A 2 115.730 -21.390 3.999 1.00 0.00 H new ATOM 0 HG1 THR A 2 116.584 -23.456 3.353 1.00 0.00 H new ATOM 0 HG21 THR A 2 117.342 -21.522 2.123 1.00 0.00 H new ATOM 0 HG22 THR A 2 117.577 -20.030 3.065 1.00 0.00 H new ATOM 0 HG23 THR A 2 118.693 -21.400 3.274 1.00 0.00 H new ATOM 27 N SER A 3 118.050 -18.846 5.298 1.00 0.00 N ATOM 28 CA SER A 3 117.968 -17.388 5.294 1.00 0.00 C ATOM 29 C SER A 3 118.448 -16.839 3.956 1.00 0.00 C ATOM 30 O SER A 3 119.348 -17.404 3.334 1.00 0.00 O ATOM 31 CB SER A 3 118.830 -16.815 6.420 1.00 0.00 C ATOM 32 OG SER A 3 118.382 -17.339 7.663 1.00 0.00 O ATOM 0 H SER A 3 118.976 -19.218 5.086 1.00 0.00 H new ATOM 0 HA SER A 3 116.929 -17.095 5.449 1.00 0.00 H new ATOM 0 HB2 SER A 3 119.877 -17.072 6.259 1.00 0.00 H new ATOM 0 HB3 SER A 3 118.766 -15.727 6.426 1.00 0.00 H new ATOM 0 HG SER A 3 118.932 -16.976 8.388 1.00 0.00 H new ATOM 38 N THR A 4 117.838 -15.741 3.516 1.00 0.00 N ATOM 39 CA THR A 4 118.219 -15.108 2.256 1.00 0.00 C ATOM 40 C THR A 4 118.435 -13.614 2.466 1.00 0.00 C ATOM 41 O THR A 4 117.617 -12.945 3.098 1.00 0.00 O ATOM 42 CB THR A 4 117.137 -15.324 1.193 1.00 0.00 C ATOM 43 OG1 THR A 4 115.949 -14.656 1.587 1.00 0.00 O ATOM 44 CG2 THR A 4 116.858 -16.820 1.026 1.00 0.00 C ATOM 0 H THR A 4 117.080 -15.272 4.012 1.00 0.00 H new ATOM 0 HA THR A 4 119.147 -15.564 1.911 1.00 0.00 H new ATOM 0 HB THR A 4 117.483 -14.921 0.241 1.00 0.00 H new ATOM 0 HG1 THR A 4 115.710 -13.987 0.912 1.00 0.00 H new ATOM 0 HG21 THR A 4 116.088 -16.964 0.268 1.00 0.00 H new ATOM 0 HG22 THR A 4 117.771 -17.328 0.716 1.00 0.00 H new ATOM 0 HG23 THR A 4 116.516 -17.234 1.974 1.00 0.00 H new ATOM 52 N VAL A 5 119.538 -13.093 1.935 1.00 0.00 N ATOM 53 CA VAL A 5 119.859 -11.677 2.088 1.00 0.00 C ATOM 54 C VAL A 5 119.961 -11.038 0.708 1.00 0.00 C ATOM 55 O VAL A 5 120.597 -11.591 -0.187 1.00 0.00 O ATOM 56 CB VAL A 5 121.175 -11.523 2.861 1.00 0.00 C ATOM 57 CG1 VAL A 5 122.321 -12.195 2.097 1.00 0.00 C ATOM 58 CG2 VAL A 5 121.494 -10.038 3.053 1.00 0.00 C ATOM 0 H VAL A 5 120.221 -13.627 1.398 1.00 0.00 H new ATOM 0 HA VAL A 5 119.073 -11.175 2.652 1.00 0.00 H new ATOM 0 HB VAL A 5 121.066 -12.001 3.834 1.00 0.00 H new ATOM 0 HG11 VAL A 5 123.249 -12.078 2.657 1.00 0.00 H new ATOM 0 HG12 VAL A 5 122.103 -13.256 1.973 1.00 0.00 H new ATOM 0 HG13 VAL A 5 122.427 -11.730 1.117 1.00 0.00 H new ATOM 0 HG21 VAL A 5 122.430 -9.935 3.603 1.00 0.00 H new ATOM 0 HG22 VAL A 5 121.590 -9.558 2.079 1.00 0.00 H new ATOM 0 HG23 VAL A 5 120.689 -9.563 3.614 1.00 0.00 H new ATOM 68 N THR A 6 119.314 -9.890 0.534 1.00 0.00 N ATOM 69 CA THR A 6 119.284 -9.239 -0.773 1.00 0.00 C ATOM 70 C THR A 6 119.520 -7.742 -0.634 1.00 0.00 C ATOM 71 O THR A 6 119.439 -7.182 0.459 1.00 0.00 O ATOM 72 CB THR A 6 117.933 -9.453 -1.475 1.00 0.00 C ATOM 73 OG1 THR A 6 116.948 -8.650 -0.843 1.00 0.00 O ATOM 74 CG2 THR A 6 117.492 -10.923 -1.426 1.00 0.00 C ATOM 0 H THR A 6 118.809 -9.396 1.270 1.00 0.00 H new ATOM 0 HA THR A 6 120.077 -9.689 -1.370 1.00 0.00 H new ATOM 0 HB THR A 6 118.048 -9.170 -2.521 1.00 0.00 H new ATOM 0 HG1 THR A 6 116.189 -8.525 -1.450 1.00 0.00 H new ATOM 0 HG21 THR A 6 116.533 -11.032 -1.933 1.00 0.00 H new ATOM 0 HG22 THR A 6 118.238 -11.543 -1.923 1.00 0.00 H new ATOM 0 HG23 THR A 6 117.392 -11.238 -0.387 1.00 0.00 H new ATOM 82 N GLY A 7 119.811 -7.106 -1.760 1.00 0.00 N ATOM 83 CA GLY A 7 119.889 -5.653 -1.816 1.00 0.00 C ATOM 84 C GLY A 7 119.557 -5.190 -3.225 1.00 0.00 C ATOM 85 O GLY A 7 119.800 -5.920 -4.186 1.00 0.00 O ATOM 0 H GLY A 7 119.997 -7.573 -2.647 1.00 0.00 H new ATOM 0 HA2 GLY A 7 119.194 -5.212 -1.102 1.00 0.00 H new ATOM 0 HA3 GLY A 7 120.888 -5.319 -1.536 1.00 0.00 H new ATOM 89 N GLY A 8 119.002 -3.988 -3.349 1.00 0.00 N ATOM 90 CA GLY A 8 118.645 -3.474 -4.665 1.00 0.00 C ATOM 91 C GLY A 8 118.538 -1.957 -4.670 1.00 0.00 C ATOM 92 O GLY A 8 118.529 -1.319 -3.617 1.00 0.00 O ATOM 0 H GLY A 8 118.793 -3.363 -2.570 1.00 0.00 H new ATOM 0 HA2 GLY A 8 119.393 -3.788 -5.393 1.00 0.00 H new ATOM 0 HA3 GLY A 8 117.695 -3.906 -4.978 1.00 0.00 H new ATOM 96 N TYR A 9 118.421 -1.402 -5.871 1.00 0.00 N ATOM 97 CA TYR A 9 118.323 0.042 -6.049 1.00 0.00 C ATOM 98 C TYR A 9 117.118 0.378 -6.923 1.00 0.00 C ATOM 99 O TYR A 9 116.761 -0.389 -7.820 1.00 0.00 O ATOM 100 CB TYR A 9 119.611 0.578 -6.681 1.00 0.00 C ATOM 101 CG TYR A 9 119.831 0.136 -8.111 1.00 0.00 C ATOM 102 CD1 TYR A 9 120.443 -1.094 -8.377 1.00 0.00 C ATOM 103 CD2 TYR A 9 119.422 0.957 -9.169 1.00 0.00 C ATOM 104 CE1 TYR A 9 120.647 -1.505 -9.699 1.00 0.00 C ATOM 105 CE2 TYR A 9 119.625 0.547 -10.492 1.00 0.00 C ATOM 106 CZ TYR A 9 120.238 -0.683 -10.758 1.00 0.00 C ATOM 107 OH TYR A 9 120.439 -1.087 -12.062 1.00 0.00 O ATOM 0 H TYR A 9 118.392 -1.934 -6.741 1.00 0.00 H new ATOM 0 HA TYR A 9 118.189 0.515 -5.076 1.00 0.00 H new ATOM 0 HB2 TYR A 9 119.592 1.667 -6.648 1.00 0.00 H new ATOM 0 HB3 TYR A 9 120.460 0.255 -6.078 1.00 0.00 H new ATOM 0 HD1 TYR A 9 120.758 -1.727 -7.561 1.00 0.00 H new ATOM 0 HD2 TYR A 9 118.950 1.907 -8.964 1.00 0.00 H new ATOM 0 HE1 TYR A 9 121.119 -2.455 -9.903 1.00 0.00 H new ATOM 0 HE2 TYR A 9 119.309 1.180 -11.308 1.00 0.00 H new ATOM 0 HH TYR A 9 120.097 -0.402 -12.673 1.00 0.00 H new ATOM 117 N ALA A 10 116.461 1.493 -6.615 1.00 0.00 N ATOM 118 CA ALA A 10 115.312 1.930 -7.400 1.00 0.00 C ATOM 119 C ALA A 10 115.336 3.442 -7.608 1.00 0.00 C ATOM 120 O ALA A 10 115.799 4.190 -6.747 1.00 0.00 O ATOM 121 CB ALA A 10 114.018 1.528 -6.691 1.00 0.00 C ATOM 0 H ALA A 10 116.702 2.105 -5.835 1.00 0.00 H new ATOM 0 HA ALA A 10 115.360 1.447 -8.376 1.00 0.00 H new ATOM 0 HB1 ALA A 10 113.163 1.857 -7.281 1.00 0.00 H new ATOM 0 HB2 ALA A 10 113.986 0.444 -6.578 1.00 0.00 H new ATOM 0 HB3 ALA A 10 113.981 1.996 -5.707 1.00 0.00 H new ATOM 127 N GLN A 11 114.831 3.873 -8.761 1.00 0.00 N ATOM 128 CA GLN A 11 114.673 5.294 -9.052 1.00 0.00 C ATOM 129 C GLN A 11 113.186 5.610 -9.187 1.00 0.00 C ATOM 130 O GLN A 11 112.436 4.823 -9.765 1.00 0.00 O ATOM 131 CB GLN A 11 115.402 5.646 -10.350 1.00 0.00 C ATOM 132 CG GLN A 11 115.383 7.163 -10.556 1.00 0.00 C ATOM 133 CD GLN A 11 116.161 7.555 -11.814 1.00 0.00 C ATOM 134 OE1 GLN A 11 116.821 6.721 -12.438 1.00 0.00 O ATOM 135 NE2 GLN A 11 116.126 8.791 -12.225 1.00 0.00 N ATOM 0 H GLN A 11 114.523 3.255 -9.512 1.00 0.00 H new ATOM 0 HA GLN A 11 115.101 5.884 -8.241 1.00 0.00 H new ATOM 0 HB2 GLN A 11 116.431 5.287 -10.310 1.00 0.00 H new ATOM 0 HB3 GLN A 11 114.924 5.148 -11.194 1.00 0.00 H new ATOM 0 HG2 GLN A 11 114.353 7.510 -10.638 1.00 0.00 H new ATOM 0 HG3 GLN A 11 115.817 7.657 -9.687 1.00 0.00 H new ATOM 0 HE21 GLN A 11 115.581 9.484 -11.712 1.00 0.00 H new ATOM 0 HE22 GLN A 11 116.643 9.066 -13.060 1.00 0.00 H new ATOM 144 N SER A 12 112.754 6.756 -8.660 1.00 0.00 N ATOM 145 CA SER A 12 111.327 7.067 -8.612 1.00 0.00 C ATOM 146 C SER A 12 111.016 8.349 -9.371 1.00 0.00 C ATOM 147 O SER A 12 111.754 9.330 -9.278 1.00 0.00 O ATOM 148 CB SER A 12 110.890 7.228 -7.156 1.00 0.00 C ATOM 149 OG SER A 12 111.233 6.053 -6.433 1.00 0.00 O ATOM 0 H SER A 12 113.362 7.474 -8.266 1.00 0.00 H new ATOM 0 HA SER A 12 110.784 6.247 -9.082 1.00 0.00 H new ATOM 0 HB2 SER A 12 111.375 8.097 -6.712 1.00 0.00 H new ATOM 0 HB3 SER A 12 109.815 7.401 -7.103 1.00 0.00 H new ATOM 0 HG SER A 12 110.985 6.164 -5.492 1.00 0.00 H new ATOM 155 N ASP A 13 109.903 8.329 -10.098 1.00 0.00 N ATOM 156 CA ASP A 13 109.431 9.506 -10.811 1.00 0.00 C ATOM 157 C ASP A 13 108.339 10.173 -9.988 1.00 0.00 C ATOM 158 O ASP A 13 107.367 9.521 -9.605 1.00 0.00 O ATOM 159 CB ASP A 13 108.878 9.110 -12.182 1.00 0.00 C ATOM 160 CG ASP A 13 108.478 10.357 -12.963 1.00 0.00 C ATOM 161 OD1 ASP A 13 109.347 10.947 -13.584 1.00 0.00 O ATOM 162 OD2 ASP A 13 107.309 10.702 -12.930 1.00 0.00 O ATOM 0 H ASP A 13 109.311 7.506 -10.208 1.00 0.00 H new ATOM 0 HA ASP A 13 110.260 10.198 -10.960 1.00 0.00 H new ATOM 0 HB2 ASP A 13 109.629 8.548 -12.738 1.00 0.00 H new ATOM 0 HB3 ASP A 13 108.015 8.455 -12.060 1.00 0.00 H new ATOM 167 N ALA A 14 108.513 11.458 -9.698 1.00 0.00 N ATOM 168 CA ALA A 14 107.578 12.175 -8.845 1.00 0.00 C ATOM 169 C ALA A 14 106.750 13.144 -9.675 1.00 0.00 C ATOM 170 O ALA A 14 107.243 14.173 -10.140 1.00 0.00 O ATOM 171 CB ALA A 14 108.346 12.943 -7.769 1.00 0.00 C ATOM 0 H ALA A 14 109.291 12.021 -10.041 1.00 0.00 H new ATOM 0 HA ALA A 14 106.910 11.457 -8.369 1.00 0.00 H new ATOM 0 HB1 ALA A 14 107.642 13.479 -7.132 1.00 0.00 H new ATOM 0 HB2 ALA A 14 108.923 12.243 -7.164 1.00 0.00 H new ATOM 0 HB3 ALA A 14 109.022 13.655 -8.243 1.00 0.00 H new ATOM 177 N GLN A 15 105.485 12.796 -9.851 1.00 0.00 N ATOM 178 CA GLN A 15 104.544 13.669 -10.540 1.00 0.00 C ATOM 179 C GLN A 15 103.964 14.672 -9.552 1.00 0.00 C ATOM 180 O GLN A 15 103.337 14.288 -8.562 1.00 0.00 O ATOM 181 CB GLN A 15 103.416 12.842 -11.160 1.00 0.00 C ATOM 182 CG GLN A 15 103.986 11.937 -12.255 1.00 0.00 C ATOM 183 CD GLN A 15 102.895 11.036 -12.831 1.00 0.00 C ATOM 184 OE1 GLN A 15 101.846 10.846 -12.213 1.00 0.00 O ATOM 185 NE2 GLN A 15 103.082 10.466 -13.990 1.00 0.00 N ATOM 0 H GLN A 15 105.085 11.916 -9.527 1.00 0.00 H new ATOM 0 HA GLN A 15 105.067 14.202 -11.334 1.00 0.00 H new ATOM 0 HB2 GLN A 15 102.929 12.240 -10.393 1.00 0.00 H new ATOM 0 HB3 GLN A 15 102.655 13.501 -11.578 1.00 0.00 H new ATOM 0 HG2 GLN A 15 104.419 12.546 -13.049 1.00 0.00 H new ATOM 0 HG3 GLN A 15 104.791 11.326 -11.847 1.00 0.00 H new ATOM 0 HE21 GLN A 15 103.950 10.623 -14.502 1.00 0.00 H new ATOM 0 HE22 GLN A 15 102.360 9.863 -14.384 1.00 0.00 H new ATOM 194 N GLY A 16 104.154 15.951 -9.859 1.00 0.00 N ATOM 195 CA GLY A 16 103.781 17.033 -8.949 1.00 0.00 C ATOM 196 C GLY A 16 104.977 17.578 -8.154 1.00 0.00 C ATOM 197 O GLY A 16 104.882 18.646 -7.550 1.00 0.00 O ATOM 0 H GLY A 16 104.567 16.267 -10.737 1.00 0.00 H new ATOM 0 HA2 GLY A 16 103.330 17.844 -9.521 1.00 0.00 H new ATOM 0 HA3 GLY A 16 103.022 16.673 -8.254 1.00 0.00 H new ATOM 201 N GLN A 17 106.101 16.853 -8.146 1.00 0.00 N ATOM 202 CA GLN A 17 107.327 17.328 -7.511 1.00 0.00 C ATOM 203 C GLN A 17 108.423 17.511 -8.557 1.00 0.00 C ATOM 204 O GLN A 17 108.239 17.167 -9.725 1.00 0.00 O ATOM 205 CB GLN A 17 107.790 16.336 -6.441 1.00 0.00 C ATOM 206 CG GLN A 17 106.683 16.119 -5.403 1.00 0.00 C ATOM 207 CD GLN A 17 106.311 17.435 -4.723 1.00 0.00 C ATOM 208 OE1 GLN A 17 107.186 18.164 -4.258 1.00 0.00 O ATOM 209 NE2 GLN A 17 105.055 17.783 -4.640 1.00 0.00 N ATOM 0 H GLN A 17 106.183 15.931 -8.575 1.00 0.00 H new ATOM 0 HA GLN A 17 107.123 18.288 -7.037 1.00 0.00 H new ATOM 0 HB2 GLN A 17 108.054 15.386 -6.906 1.00 0.00 H new ATOM 0 HB3 GLN A 17 108.689 16.712 -5.951 1.00 0.00 H new ATOM 0 HG2 GLN A 17 105.804 15.693 -5.886 1.00 0.00 H new ATOM 0 HG3 GLN A 17 107.016 15.399 -4.655 1.00 0.00 H new ATOM 0 HE21 GLN A 17 104.331 17.177 -5.026 1.00 0.00 H new ATOM 0 HE22 GLN A 17 104.798 18.661 -4.189 1.00 0.00 H new ATOM 218 N MET A 18 109.560 18.056 -8.137 1.00 0.00 N ATOM 219 CA MET A 18 110.662 18.302 -9.061 1.00 0.00 C ATOM 220 C MET A 18 111.663 17.148 -9.056 1.00 0.00 C ATOM 221 O MET A 18 111.782 16.425 -8.067 1.00 0.00 O ATOM 222 CB MET A 18 111.380 19.599 -8.682 1.00 0.00 C ATOM 223 CG MET A 18 110.417 20.778 -8.826 1.00 0.00 C ATOM 224 SD MET A 18 111.323 22.329 -8.599 1.00 0.00 S ATOM 225 CE MET A 18 112.215 22.304 -10.173 1.00 0.00 C ATOM 0 H MET A 18 109.742 18.334 -7.173 1.00 0.00 H new ATOM 0 HA MET A 18 110.243 18.389 -10.064 1.00 0.00 H new ATOM 0 HB2 MET A 18 111.746 19.538 -7.657 1.00 0.00 H new ATOM 0 HB3 MET A 18 112.250 19.746 -9.323 1.00 0.00 H new ATOM 0 HG2 MET A 18 109.947 20.760 -9.809 1.00 0.00 H new ATOM 0 HG3 MET A 18 109.617 20.700 -8.089 1.00 0.00 H new ATOM 0 HE1 MET A 18 112.278 23.317 -10.572 1.00 0.00 H new ATOM 0 HE2 MET A 18 113.220 21.913 -10.015 1.00 0.00 H new ATOM 0 HE3 MET A 18 111.685 21.668 -10.882 1.00 0.00 H new ATOM 235 N ASN A 19 112.358 16.998 -10.184 1.00 0.00 N ATOM 236 CA ASN A 19 113.413 15.998 -10.360 1.00 0.00 C ATOM 237 C ASN A 19 113.011 14.607 -9.866 1.00 0.00 C ATOM 238 O ASN A 19 111.865 14.367 -9.486 1.00 0.00 O ATOM 239 CB ASN A 19 114.708 16.459 -9.677 1.00 0.00 C ATOM 240 CG ASN A 19 114.494 16.673 -8.182 1.00 0.00 C ATOM 241 OD1 ASN A 19 114.569 17.802 -7.699 1.00 0.00 O ATOM 242 ND2 ASN A 19 114.237 15.648 -7.417 1.00 0.00 N ATOM 0 H ASN A 19 112.203 17.574 -11.011 1.00 0.00 H new ATOM 0 HA ASN A 19 113.582 15.909 -11.433 1.00 0.00 H new ATOM 0 HB2 ASN A 19 115.490 15.715 -9.833 1.00 0.00 H new ATOM 0 HB3 ASN A 19 115.054 17.386 -10.134 1.00 0.00 H new ATOM 0 HD21 ASN A 19 114.098 15.781 -6.415 1.00 0.00 H new ATOM 0 HD22 ASN A 19 114.175 14.713 -7.820 1.00 0.00 H new ATOM 249 N LYS A 20 113.963 13.678 -9.932 1.00 0.00 N ATOM 250 CA LYS A 20 113.720 12.288 -9.554 1.00 0.00 C ATOM 251 C LYS A 20 114.429 11.949 -8.246 1.00 0.00 C ATOM 252 O LYS A 20 115.340 12.661 -7.824 1.00 0.00 O ATOM 253 CB LYS A 20 114.218 11.358 -10.663 1.00 0.00 C ATOM 254 CG LYS A 20 113.407 11.601 -11.938 1.00 0.00 C ATOM 255 CD LYS A 20 113.839 10.607 -13.018 1.00 0.00 C ATOM 256 CE LYS A 20 113.115 10.921 -14.330 1.00 0.00 C ATOM 257 NZ LYS A 20 111.788 10.246 -14.338 1.00 0.00 N ATOM 0 H LYS A 20 114.915 13.865 -10.246 1.00 0.00 H new ATOM 0 HA LYS A 20 112.648 12.152 -9.413 1.00 0.00 H new ATOM 0 HB2 LYS A 20 115.276 11.536 -10.853 1.00 0.00 H new ATOM 0 HB3 LYS A 20 114.121 10.318 -10.351 1.00 0.00 H new ATOM 0 HG2 LYS A 20 112.343 11.489 -11.731 1.00 0.00 H new ATOM 0 HG3 LYS A 20 113.558 12.622 -12.288 1.00 0.00 H new ATOM 0 HD2 LYS A 20 114.918 10.661 -13.165 1.00 0.00 H new ATOM 0 HD3 LYS A 20 113.611 9.589 -12.701 1.00 0.00 H new ATOM 0 HE2 LYS A 20 112.988 11.998 -14.439 1.00 0.00 H new ATOM 0 HE3 LYS A 20 113.712 10.583 -15.177 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 111.546 9.968 -15.310 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 111.825 9.399 -13.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 111.064 10.898 -13.974 1.00 0.00 H new ATOM 271 N MET A 21 114.007 10.861 -7.604 1.00 0.00 N ATOM 272 CA MET A 21 114.572 10.471 -6.313 1.00 0.00 C ATOM 273 C MET A 21 115.245 9.108 -6.425 1.00 0.00 C ATOM 274 O MET A 21 114.938 8.341 -7.335 1.00 0.00 O ATOM 275 CB MET A 21 113.465 10.405 -5.258 1.00 0.00 C ATOM 276 CG MET A 21 112.881 11.803 -5.042 1.00 0.00 C ATOM 277 SD MET A 21 111.732 11.777 -3.642 1.00 0.00 S ATOM 278 CE MET A 21 110.564 10.567 -4.314 1.00 0.00 C ATOM 0 H MET A 21 113.280 10.237 -7.954 1.00 0.00 H new ATOM 0 HA MET A 21 115.312 11.214 -6.017 1.00 0.00 H new ATOM 0 HB2 MET A 21 112.682 9.718 -5.580 1.00 0.00 H new ATOM 0 HB3 MET A 21 113.864 10.017 -4.321 1.00 0.00 H new ATOM 0 HG2 MET A 21 113.683 12.517 -4.853 1.00 0.00 H new ATOM 0 HG3 MET A 21 112.364 12.135 -5.943 1.00 0.00 H new ATOM 0 HE1 MET A 21 109.594 10.692 -3.833 1.00 0.00 H new ATOM 0 HE2 MET A 21 110.459 10.721 -5.388 1.00 0.00 H new ATOM 0 HE3 MET A 21 110.935 9.560 -4.126 1.00 0.00 H new ATOM 288 N GLY A 22 116.148 8.803 -5.497 1.00 0.00 N ATOM 289 CA GLY A 22 116.859 7.526 -5.536 1.00 0.00 C ATOM 290 C GLY A 22 116.988 6.932 -4.140 1.00 0.00 C ATOM 291 O GLY A 22 117.197 7.663 -3.173 1.00 0.00 O ATOM 0 H GLY A 22 116.403 9.412 -4.719 1.00 0.00 H new ATOM 0 HA2 GLY A 22 116.328 6.829 -6.184 1.00 0.00 H new ATOM 0 HA3 GLY A 22 117.850 7.670 -5.967 1.00 0.00 H new ATOM 295 N GLY A 23 116.850 5.612 -4.035 1.00 0.00 N ATOM 296 CA GLY A 23 116.960 4.955 -2.736 1.00 0.00 C ATOM 297 C GLY A 23 117.398 3.500 -2.869 1.00 0.00 C ATOM 298 O GLY A 23 117.390 2.931 -3.960 1.00 0.00 O ATOM 0 H GLY A 23 116.665 4.986 -4.819 1.00 0.00 H new ATOM 0 HA2 GLY A 23 117.676 5.494 -2.116 1.00 0.00 H new ATOM 0 HA3 GLY A 23 115.999 4.999 -2.224 1.00 0.00 H new ATOM 302 N PHE A 24 117.760 2.906 -1.735 1.00 0.00 N ATOM 303 CA PHE A 24 118.202 1.514 -1.700 1.00 0.00 C ATOM 304 C PHE A 24 117.410 0.750 -0.645 1.00 0.00 C ATOM 305 O PHE A 24 116.903 1.352 0.301 1.00 0.00 O ATOM 306 CB PHE A 24 119.694 1.447 -1.370 1.00 0.00 C ATOM 307 CG PHE A 24 120.567 2.135 -2.394 1.00 0.00 C ATOM 308 CD1 PHE A 24 120.976 1.445 -3.542 1.00 0.00 C ATOM 309 CD2 PHE A 24 120.965 3.462 -2.196 1.00 0.00 C ATOM 310 CE1 PHE A 24 121.785 2.083 -4.490 1.00 0.00 C ATOM 311 CE2 PHE A 24 121.774 4.100 -3.145 1.00 0.00 C ATOM 312 CZ PHE A 24 122.183 3.410 -4.292 1.00 0.00 C ATOM 0 H PHE A 24 117.756 3.368 -0.826 1.00 0.00 H new ATOM 0 HA PHE A 24 118.032 1.063 -2.678 1.00 0.00 H new ATOM 0 HB2 PHE A 24 119.863 1.902 -0.394 1.00 0.00 H new ATOM 0 HB3 PHE A 24 119.994 0.402 -1.291 1.00 0.00 H new ATOM 0 HD1 PHE A 24 120.668 0.421 -3.696 1.00 0.00 H new ATOM 0 HD2 PHE A 24 120.648 3.994 -1.311 1.00 0.00 H new ATOM 0 HE1 PHE A 24 122.102 1.551 -5.375 1.00 0.00 H new ATOM 0 HE2 PHE A 24 122.082 5.124 -2.992 1.00 0.00 H new ATOM 0 HZ PHE A 24 122.806 3.902 -5.024 1.00 0.00 H new ATOM 322 N ASN A 25 117.298 -0.567 -0.808 1.00 0.00 N ATOM 323 CA ASN A 25 116.528 -1.371 0.139 1.00 0.00 C ATOM 324 C ASN A 25 117.161 -2.743 0.364 1.00 0.00 C ATOM 325 O ASN A 25 117.823 -3.281 -0.523 1.00 0.00 O ATOM 326 CB ASN A 25 115.086 -1.527 -0.357 1.00 0.00 C ATOM 327 CG ASN A 25 115.036 -2.348 -1.643 1.00 0.00 C ATOM 328 OD1 ASN A 25 116.036 -2.448 -2.356 1.00 0.00 O ATOM 329 ND2 ASN A 25 113.929 -2.951 -1.979 1.00 0.00 N ATOM 0 H ASN A 25 117.722 -1.093 -1.572 1.00 0.00 H new ATOM 0 HA ASN A 25 116.527 -0.849 1.096 1.00 0.00 H new ATOM 0 HB2 ASN A 25 114.484 -2.011 0.412 1.00 0.00 H new ATOM 0 HB3 ASN A 25 114.649 -0.544 -0.532 1.00 0.00 H new ATOM 0 HD21 ASN A 25 113.890 -3.507 -2.833 1.00 0.00 H new ATOM 0 HD22 ASN A 25 113.102 -2.867 -1.387 1.00 0.00 H new ATOM 336 N LEU A 26 116.960 -3.284 1.564 1.00 0.00 N ATOM 337 CA LEU A 26 117.426 -4.629 1.895 1.00 0.00 C ATOM 338 C LEU A 26 116.246 -5.472 2.368 1.00 0.00 C ATOM 339 O LEU A 26 115.381 -4.977 3.092 1.00 0.00 O ATOM 340 CB LEU A 26 118.489 -4.567 2.997 1.00 0.00 C ATOM 341 CG LEU A 26 119.641 -3.653 2.571 1.00 0.00 C ATOM 342 CD1 LEU A 26 120.647 -3.537 3.717 1.00 0.00 C ATOM 343 CD2 LEU A 26 120.345 -4.241 1.345 1.00 0.00 C ATOM 0 H LEU A 26 116.476 -2.809 2.326 1.00 0.00 H new ATOM 0 HA LEU A 26 117.867 -5.081 1.007 1.00 0.00 H new ATOM 0 HB2 LEU A 26 118.044 -4.197 3.921 1.00 0.00 H new ATOM 0 HB3 LEU A 26 118.867 -5.568 3.204 1.00 0.00 H new ATOM 0 HG LEU A 26 119.244 -2.668 2.324 1.00 0.00 H new ATOM 0 HD11 LEU A 26 121.468 -2.887 3.416 1.00 0.00 H new ATOM 0 HD12 LEU A 26 120.154 -3.116 4.593 1.00 0.00 H new ATOM 0 HD13 LEU A 26 121.037 -4.525 3.960 1.00 0.00 H new ATOM 0 HD21 LEU A 26 121.164 -3.586 1.047 1.00 0.00 H new ATOM 0 HD22 LEU A 26 120.740 -5.227 1.590 1.00 0.00 H new ATOM 0 HD23 LEU A 26 119.633 -4.329 0.524 1.00 0.00 H new ATOM 355 N LYS A 27 116.203 -6.742 1.968 1.00 0.00 N ATOM 356 CA LYS A 27 115.076 -7.608 2.325 1.00 0.00 C ATOM 357 C LYS A 27 115.538 -8.829 3.113 1.00 0.00 C ATOM 358 O LYS A 27 116.596 -9.399 2.844 1.00 0.00 O ATOM 359 CB LYS A 27 114.354 -8.075 1.060 1.00 0.00 C ATOM 360 CG LYS A 27 113.791 -6.865 0.312 1.00 0.00 C ATOM 361 CD LYS A 27 112.973 -7.340 -0.889 1.00 0.00 C ATOM 362 CE LYS A 27 112.515 -6.134 -1.710 1.00 0.00 C ATOM 363 NZ LYS A 27 113.592 -5.747 -2.666 1.00 0.00 N ATOM 0 H LYS A 27 116.924 -7.191 1.404 1.00 0.00 H new ATOM 0 HA LYS A 27 114.399 -7.026 2.950 1.00 0.00 H new ATOM 0 HB2 LYS A 27 115.043 -8.624 0.418 1.00 0.00 H new ATOM 0 HB3 LYS A 27 113.548 -8.760 1.322 1.00 0.00 H new ATOM 0 HG2 LYS A 27 113.166 -6.271 0.979 1.00 0.00 H new ATOM 0 HG3 LYS A 27 114.604 -6.220 -0.021 1.00 0.00 H new ATOM 0 HD2 LYS A 27 113.572 -8.007 -1.508 1.00 0.00 H new ATOM 0 HD3 LYS A 27 112.109 -7.911 -0.550 1.00 0.00 H new ATOM 0 HE2 LYS A 27 111.601 -6.376 -2.253 1.00 0.00 H new ATOM 0 HE3 LYS A 27 112.282 -5.298 -1.050 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 113.210 -5.081 -3.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 114.371 -5.294 -2.147 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 113.947 -6.596 -3.151 1.00 0.00 H new ATOM 377 N TYR A 28 114.725 -9.220 4.090 1.00 0.00 N ATOM 378 CA TYR A 28 114.982 -10.424 4.877 1.00 0.00 C ATOM 379 C TYR A 28 113.796 -11.377 4.757 1.00 0.00 C ATOM 380 O TYR A 28 112.647 -10.932 4.753 1.00 0.00 O ATOM 381 CB TYR A 28 115.198 -10.054 6.345 1.00 0.00 C ATOM 382 CG TYR A 28 116.354 -9.105 6.561 1.00 0.00 C ATOM 383 CD1 TYR A 28 117.664 -9.596 6.605 1.00 0.00 C ATOM 384 CD2 TYR A 28 116.114 -7.735 6.716 1.00 0.00 C ATOM 385 CE1 TYR A 28 118.735 -8.717 6.804 1.00 0.00 C ATOM 386 CE2 TYR A 28 117.185 -6.855 6.916 1.00 0.00 C ATOM 387 CZ TYR A 28 118.495 -7.346 6.959 1.00 0.00 C ATOM 388 OH TYR A 28 119.551 -6.479 7.156 1.00 0.00 O ATOM 0 H TYR A 28 113.878 -8.718 4.357 1.00 0.00 H new ATOM 0 HA TYR A 28 115.880 -10.912 4.498 1.00 0.00 H new ATOM 0 HB2 TYR A 28 114.287 -9.600 6.735 1.00 0.00 H new ATOM 0 HB3 TYR A 28 115.372 -10.964 6.919 1.00 0.00 H new ATOM 0 HD1 TYR A 28 117.849 -10.653 6.485 1.00 0.00 H new ATOM 0 HD2 TYR A 28 115.103 -7.356 6.681 1.00 0.00 H new ATOM 0 HE1 TYR A 28 119.746 -9.096 6.838 1.00 0.00 H new ATOM 0 HE2 TYR A 28 117.000 -5.798 7.037 1.00 0.00 H new ATOM 0 HH TYR A 28 119.211 -5.564 7.244 1.00 0.00 H new ATOM 398 N ARG A 29 114.077 -12.675 4.629 1.00 0.00 N ATOM 399 CA ARG A 29 113.018 -13.669 4.444 1.00 0.00 C ATOM 400 C ARG A 29 113.163 -14.835 5.418 1.00 0.00 C ATOM 401 O ARG A 29 114.271 -15.300 5.687 1.00 0.00 O ATOM 402 CB ARG A 29 113.049 -14.204 3.011 1.00 0.00 C ATOM 403 CG ARG A 29 112.796 -13.059 2.029 1.00 0.00 C ATOM 404 CD ARG A 29 112.734 -13.615 0.605 1.00 0.00 C ATOM 405 NE ARG A 29 112.704 -12.519 -0.368 1.00 0.00 N ATOM 406 CZ ARG A 29 113.158 -12.632 -1.626 1.00 0.00 C ATOM 407 NH1 ARG A 29 113.667 -13.749 -2.088 1.00 0.00 N ATOM 408 NH2 ARG A 29 113.089 -11.597 -2.417 1.00 0.00 N ATOM 0 H ARG A 29 115.021 -13.060 4.650 1.00 0.00 H new ATOM 0 HA ARG A 29 112.066 -13.175 4.639 1.00 0.00 H new ATOM 0 HB2 ARG A 29 114.015 -14.666 2.806 1.00 0.00 H new ATOM 0 HB3 ARG A 29 112.292 -14.978 2.885 1.00 0.00 H new ATOM 0 HG2 ARG A 29 111.862 -12.554 2.275 1.00 0.00 H new ATOM 0 HG3 ARG A 29 113.590 -12.316 2.107 1.00 0.00 H new ATOM 0 HD2 ARG A 29 113.598 -14.253 0.418 1.00 0.00 H new ATOM 0 HD3 ARG A 29 111.847 -14.238 0.489 1.00 0.00 H new ATOM 0 HE ARG A 29 112.317 -11.622 -0.073 1.00 0.00 H new ATOM 0 HH11 ARG A 29 113.728 -14.570 -1.485 1.00 0.00 H new ATOM 0 HH12 ARG A 29 114.002 -13.797 -3.050 1.00 0.00 H new ATOM 0 HH21 ARG A 29 112.695 -10.720 -2.076 1.00 0.00 H new ATOM 0 HH22 ARG A 29 113.429 -11.665 -3.376 1.00 0.00 H new ATOM 422 N TYR A 30 112.031 -15.304 5.941 1.00 0.00 N ATOM 423 CA TYR A 30 112.018 -16.444 6.855 1.00 0.00 C ATOM 424 C TYR A 30 111.121 -17.551 6.307 1.00 0.00 C ATOM 425 O TYR A 30 110.009 -17.288 5.848 1.00 0.00 O ATOM 426 CB TYR A 30 111.508 -16.004 8.228 1.00 0.00 C ATOM 427 CG TYR A 30 111.545 -17.101 9.265 1.00 0.00 C ATOM 428 CD1 TYR A 30 112.723 -17.349 9.981 1.00 0.00 C ATOM 429 CD2 TYR A 30 110.402 -17.871 9.512 1.00 0.00 C ATOM 430 CE1 TYR A 30 112.757 -18.364 10.943 1.00 0.00 C ATOM 431 CE2 TYR A 30 110.436 -18.887 10.474 1.00 0.00 C ATOM 432 CZ TYR A 30 111.614 -19.134 11.191 1.00 0.00 C ATOM 433 OH TYR A 30 111.647 -20.135 12.139 1.00 0.00 O ATOM 0 H TYR A 30 111.110 -14.911 5.747 1.00 0.00 H new ATOM 0 HA TYR A 30 113.034 -16.826 6.952 1.00 0.00 H new ATOM 0 HB2 TYR A 30 112.108 -15.164 8.578 1.00 0.00 H new ATOM 0 HB3 TYR A 30 110.484 -15.644 8.128 1.00 0.00 H new ATOM 0 HD1 TYR A 30 113.605 -16.756 9.790 1.00 0.00 H new ATOM 0 HD2 TYR A 30 109.494 -17.681 8.960 1.00 0.00 H new ATOM 0 HE1 TYR A 30 113.666 -18.554 11.495 1.00 0.00 H new ATOM 0 HE2 TYR A 30 109.554 -19.481 10.664 1.00 0.00 H new ATOM 0 HH TYR A 30 110.770 -20.570 12.186 1.00 0.00 H new ATOM 443 N GLU A 31 111.606 -18.791 6.355 1.00 0.00 N ATOM 444 CA GLU A 31 110.858 -19.926 5.815 1.00 0.00 C ATOM 445 C GLU A 31 110.714 -21.036 6.856 1.00 0.00 C ATOM 446 O GLU A 31 111.605 -21.249 7.677 1.00 0.00 O ATOM 447 CB GLU A 31 111.580 -20.473 4.582 1.00 0.00 C ATOM 448 CG GLU A 31 110.707 -21.532 3.895 1.00 0.00 C ATOM 449 CD GLU A 31 111.418 -22.174 2.699 1.00 0.00 C ATOM 450 OE1 GLU A 31 112.561 -21.834 2.428 1.00 0.00 O ATOM 451 OE2 GLU A 31 110.799 -23.010 2.062 1.00 0.00 O ATOM 0 H GLU A 31 112.510 -19.035 6.760 1.00 0.00 H new ATOM 0 HA GLU A 31 109.861 -19.581 5.541 1.00 0.00 H new ATOM 0 HB2 GLU A 31 111.798 -19.662 3.887 1.00 0.00 H new ATOM 0 HB3 GLU A 31 112.536 -20.909 4.873 1.00 0.00 H new ATOM 0 HG2 GLU A 31 110.440 -22.305 4.616 1.00 0.00 H new ATOM 0 HG3 GLU A 31 109.777 -21.073 3.560 1.00 0.00 H new ATOM 458 N GLU A 32 109.583 -21.737 6.815 1.00 0.00 N ATOM 459 CA GLU A 32 109.346 -22.850 7.730 1.00 0.00 C ATOM 460 C GLU A 32 109.677 -24.176 7.049 1.00 0.00 C ATOM 461 O GLU A 32 109.386 -24.369 5.869 1.00 0.00 O ATOM 462 CB GLU A 32 107.885 -22.852 8.186 1.00 0.00 C ATOM 463 CG GLU A 32 107.694 -23.901 9.288 1.00 0.00 C ATOM 464 CD GLU A 32 106.229 -24.009 9.728 1.00 0.00 C ATOM 465 OE1 GLU A 32 105.386 -23.311 9.184 1.00 0.00 O ATOM 466 OE2 GLU A 32 105.969 -24.802 10.619 1.00 0.00 O ATOM 0 H GLU A 32 108.821 -21.555 6.162 1.00 0.00 H new ATOM 0 HA GLU A 32 109.992 -22.729 8.600 1.00 0.00 H new ATOM 0 HB2 GLU A 32 107.607 -21.865 8.557 1.00 0.00 H new ATOM 0 HB3 GLU A 32 107.230 -23.072 7.343 1.00 0.00 H new ATOM 0 HG2 GLU A 32 108.038 -24.871 8.929 1.00 0.00 H new ATOM 0 HG3 GLU A 32 108.313 -23.642 10.147 1.00 0.00 H new ATOM 473 N ASP A 33 110.288 -25.087 7.803 1.00 0.00 N ATOM 474 CA ASP A 33 110.778 -26.337 7.231 1.00 0.00 C ATOM 475 C ASP A 33 109.652 -27.260 6.763 1.00 0.00 C ATOM 476 O ASP A 33 109.729 -27.821 5.669 1.00 0.00 O ATOM 477 CB ASP A 33 111.647 -27.070 8.259 1.00 0.00 C ATOM 478 CG ASP A 33 110.819 -27.481 9.475 1.00 0.00 C ATOM 479 OD1 ASP A 33 109.886 -26.769 9.804 1.00 0.00 O ATOM 480 OD2 ASP A 33 111.134 -28.504 10.060 1.00 0.00 O ATOM 0 H ASP A 33 110.454 -24.984 8.804 1.00 0.00 H new ATOM 0 HA ASP A 33 111.365 -26.075 6.351 1.00 0.00 H new ATOM 0 HB2 ASP A 33 112.092 -27.953 7.801 1.00 0.00 H new ATOM 0 HB3 ASP A 33 112.468 -26.426 8.573 1.00 0.00 H new ATOM 485 N ASN A 34 108.609 -27.420 7.578 1.00 0.00 N ATOM 486 CA ASN A 34 107.546 -28.379 7.254 1.00 0.00 C ATOM 487 C ASN A 34 106.280 -27.719 6.693 1.00 0.00 C ATOM 488 O ASN A 34 105.414 -28.411 6.158 1.00 0.00 O ATOM 489 CB ASN A 34 107.178 -29.168 8.512 1.00 0.00 C ATOM 490 CG ASN A 34 108.400 -29.914 9.036 1.00 0.00 C ATOM 491 OD1 ASN A 34 109.188 -30.444 8.252 1.00 0.00 O ATOM 492 ND2 ASN A 34 108.607 -29.987 10.322 1.00 0.00 N ATOM 0 H ASN A 34 108.476 -26.910 8.451 1.00 0.00 H new ATOM 0 HA ASN A 34 107.939 -29.032 6.475 1.00 0.00 H new ATOM 0 HB2 ASN A 34 106.799 -28.491 9.278 1.00 0.00 H new ATOM 0 HB3 ASN A 34 106.379 -29.875 8.287 1.00 0.00 H new ATOM 0 HD21 ASN A 34 109.423 -30.484 10.680 1.00 0.00 H new ATOM 0 HD22 ASN A 34 107.953 -29.547 10.970 1.00 0.00 H new ATOM 499 N SER A 35 106.163 -26.399 6.810 1.00 0.00 N ATOM 500 CA SER A 35 105.023 -25.687 6.243 1.00 0.00 C ATOM 501 C SER A 35 105.467 -24.294 5.784 1.00 0.00 C ATOM 502 O SER A 35 105.143 -23.294 6.432 1.00 0.00 O ATOM 503 CB SER A 35 103.900 -25.588 7.279 1.00 0.00 C ATOM 504 OG SER A 35 102.772 -24.958 6.686 1.00 0.00 O ATOM 0 H SER A 35 106.839 -25.804 7.289 1.00 0.00 H new ATOM 0 HA SER A 35 104.643 -26.234 5.380 1.00 0.00 H new ATOM 0 HB2 SER A 35 103.630 -26.582 7.637 1.00 0.00 H new ATOM 0 HB3 SER A 35 104.237 -25.018 8.145 1.00 0.00 H new ATOM 0 HG SER A 35 102.049 -24.894 7.345 1.00 0.00 H new ATOM 510 N PRO A 36 106.193 -24.195 4.689 1.00 0.00 N ATOM 511 CA PRO A 36 106.831 -22.900 4.306 1.00 0.00 C ATOM 512 C PRO A 36 105.818 -21.778 4.097 1.00 0.00 C ATOM 513 O PRO A 36 104.791 -21.956 3.443 1.00 0.00 O ATOM 514 CB PRO A 36 107.581 -23.207 3.001 1.00 0.00 C ATOM 515 CG PRO A 36 107.700 -24.692 2.942 1.00 0.00 C ATOM 516 CD PRO A 36 106.497 -25.247 3.699 1.00 0.00 C ATOM 0 HA PRO A 36 107.486 -22.540 5.099 1.00 0.00 H new ATOM 0 HB2 PRO A 36 107.037 -22.823 2.138 1.00 0.00 H new ATOM 0 HB3 PRO A 36 108.564 -22.735 2.994 1.00 0.00 H new ATOM 0 HG2 PRO A 36 107.705 -25.041 1.909 1.00 0.00 H new ATOM 0 HG3 PRO A 36 108.633 -25.026 3.396 1.00 0.00 H new ATOM 0 HD2 PRO A 36 105.653 -25.427 3.033 1.00 0.00 H new ATOM 0 HD3 PRO A 36 106.730 -26.196 4.182 1.00 0.00 H new ATOM 524 N LEU A 37 106.141 -20.622 4.664 1.00 0.00 N ATOM 525 CA LEU A 37 105.389 -19.395 4.439 1.00 0.00 C ATOM 526 C LEU A 37 106.361 -18.317 3.978 1.00 0.00 C ATOM 527 O LEU A 37 107.438 -18.187 4.568 1.00 0.00 O ATOM 528 CB LEU A 37 104.694 -18.948 5.728 1.00 0.00 C ATOM 529 CG LEU A 37 103.783 -20.066 6.242 1.00 0.00 C ATOM 530 CD1 LEU A 37 103.186 -19.655 7.590 1.00 0.00 C ATOM 531 CD2 LEU A 37 102.647 -20.304 5.244 1.00 0.00 C ATOM 0 H LEU A 37 106.935 -20.509 5.295 1.00 0.00 H new ATOM 0 HA LEU A 37 104.624 -19.567 3.682 1.00 0.00 H new ATOM 0 HB2 LEU A 37 105.438 -18.696 6.484 1.00 0.00 H new ATOM 0 HB3 LEU A 37 104.110 -18.047 5.543 1.00 0.00 H new ATOM 0 HG LEU A 37 104.365 -20.980 6.358 1.00 0.00 H new ATOM 0 HD11 LEU A 37 102.537 -20.450 7.958 1.00 0.00 H new ATOM 0 HD12 LEU A 37 103.989 -19.482 8.306 1.00 0.00 H new ATOM 0 HD13 LEU A 37 102.606 -18.740 7.467 1.00 0.00 H new ATOM 0 HD21 LEU A 37 102.000 -21.100 5.612 1.00 0.00 H new ATOM 0 HD22 LEU A 37 102.066 -19.389 5.129 1.00 0.00 H new ATOM 0 HD23 LEU A 37 103.065 -20.593 4.279 1.00 0.00 H new ATOM 543 N GLY A 38 106.004 -17.550 2.947 1.00 0.00 N ATOM 544 CA GLY A 38 106.937 -16.567 2.417 1.00 0.00 C ATOM 545 C GLY A 38 106.702 -15.226 3.091 1.00 0.00 C ATOM 546 O GLY A 38 105.624 -14.652 2.983 1.00 0.00 O ATOM 0 H GLY A 38 105.100 -17.590 2.476 1.00 0.00 H new ATOM 0 HA2 GLY A 38 107.962 -16.896 2.586 1.00 0.00 H new ATOM 0 HA3 GLY A 38 106.807 -16.471 1.339 1.00 0.00 H new ATOM 550 N VAL A 39 107.702 -14.742 3.816 1.00 0.00 N ATOM 551 CA VAL A 39 107.598 -13.440 4.467 1.00 0.00 C ATOM 552 C VAL A 39 108.727 -12.554 3.973 1.00 0.00 C ATOM 553 O VAL A 39 109.881 -12.971 3.941 1.00 0.00 O ATOM 554 CB VAL A 39 107.689 -13.597 5.990 1.00 0.00 C ATOM 555 CG1 VAL A 39 107.490 -12.237 6.662 1.00 0.00 C ATOM 556 CG2 VAL A 39 106.602 -14.559 6.476 1.00 0.00 C ATOM 0 H VAL A 39 108.587 -15.225 3.968 1.00 0.00 H new ATOM 0 HA VAL A 39 106.636 -12.988 4.223 1.00 0.00 H new ATOM 0 HB VAL A 39 108.671 -13.993 6.248 1.00 0.00 H new ATOM 0 HG11 VAL A 39 107.555 -12.353 7.744 1.00 0.00 H new ATOM 0 HG12 VAL A 39 108.263 -11.547 6.323 1.00 0.00 H new ATOM 0 HG13 VAL A 39 106.509 -11.841 6.398 1.00 0.00 H new ATOM 0 HG21 VAL A 39 106.670 -14.668 7.558 1.00 0.00 H new ATOM 0 HG22 VAL A 39 105.621 -14.163 6.212 1.00 0.00 H new ATOM 0 HG23 VAL A 39 106.740 -15.532 6.004 1.00 0.00 H new ATOM 566 N ILE A 40 108.387 -11.339 3.562 1.00 0.00 N ATOM 567 CA ILE A 40 109.399 -10.382 3.130 1.00 0.00 C ATOM 568 C ILE A 40 109.229 -9.087 3.907 1.00 0.00 C ATOM 569 O ILE A 40 108.113 -8.586 4.036 1.00 0.00 O ATOM 570 CB ILE A 40 109.268 -10.114 1.625 1.00 0.00 C ATOM 571 CG1 ILE A 40 109.385 -11.434 0.857 1.00 0.00 C ATOM 572 CG2 ILE A 40 110.381 -9.168 1.166 1.00 0.00 C ATOM 573 CD1 ILE A 40 109.090 -11.195 -0.625 1.00 0.00 C ATOM 0 H ILE A 40 107.428 -10.995 3.518 1.00 0.00 H new ATOM 0 HA ILE A 40 110.390 -10.794 3.323 1.00 0.00 H new ATOM 0 HB ILE A 40 108.298 -9.657 1.429 1.00 0.00 H new ATOM 0 HG12 ILE A 40 110.386 -11.848 0.976 1.00 0.00 H new ATOM 0 HG13 ILE A 40 108.687 -12.166 1.263 1.00 0.00 H new ATOM 0 HG21 ILE A 40 110.282 -8.982 0.097 1.00 0.00 H new ATOM 0 HG22 ILE A 40 110.303 -8.225 1.707 1.00 0.00 H new ATOM 0 HG23 ILE A 40 111.351 -9.623 1.367 1.00 0.00 H new ATOM 0 HD11 ILE A 40 109.174 -12.136 -1.169 1.00 0.00 H new ATOM 0 HD12 ILE A 40 108.080 -10.801 -0.736 1.00 0.00 H new ATOM 0 HD13 ILE A 40 109.806 -10.478 -1.027 1.00 0.00 H new ATOM 585 N GLY A 41 110.332 -8.588 4.457 1.00 0.00 N ATOM 586 CA GLY A 41 110.345 -7.269 5.080 1.00 0.00 C ATOM 587 C GLY A 41 111.470 -6.438 4.481 1.00 0.00 C ATOM 588 O GLY A 41 112.606 -6.904 4.399 1.00 0.00 O ATOM 0 H GLY A 41 111.227 -9.076 4.484 1.00 0.00 H new ATOM 0 HA2 GLY A 41 109.388 -6.772 4.924 1.00 0.00 H new ATOM 0 HA3 GLY A 41 110.483 -7.365 6.157 1.00 0.00 H new ATOM 592 N SER A 42 111.152 -5.218 4.054 1.00 0.00 N ATOM 593 CA SER A 42 112.128 -4.372 3.371 1.00 0.00 C ATOM 594 C SER A 42 112.213 -2.994 4.017 1.00 0.00 C ATOM 595 O SER A 42 111.193 -2.393 4.357 1.00 0.00 O ATOM 596 CB SER A 42 111.729 -4.213 1.904 1.00 0.00 C ATOM 597 OG SER A 42 112.826 -3.678 1.177 1.00 0.00 O ATOM 0 H SER A 42 110.231 -4.795 4.168 1.00 0.00 H new ATOM 0 HA SER A 42 113.104 -4.851 3.447 1.00 0.00 H new ATOM 0 HB2 SER A 42 111.437 -5.177 1.488 1.00 0.00 H new ATOM 0 HB3 SER A 42 110.865 -3.554 1.819 1.00 0.00 H new ATOM 0 HG SER A 42 112.499 -3.021 0.528 1.00 0.00 H new ATOM 603 N PHE A 43 113.436 -2.496 4.182 1.00 0.00 N ATOM 604 CA PHE A 43 113.645 -1.134 4.666 1.00 0.00 C ATOM 605 C PHE A 43 114.290 -0.309 3.560 1.00 0.00 C ATOM 606 O PHE A 43 115.365 -0.657 3.075 1.00 0.00 O ATOM 607 CB PHE A 43 114.553 -1.147 5.896 1.00 0.00 C ATOM 608 CG PHE A 43 113.966 -1.891 7.072 1.00 0.00 C ATOM 609 CD1 PHE A 43 113.177 -1.212 8.008 1.00 0.00 C ATOM 610 CD2 PHE A 43 114.211 -3.261 7.225 1.00 0.00 C ATOM 611 CE1 PHE A 43 112.633 -1.902 9.098 1.00 0.00 C ATOM 612 CE2 PHE A 43 113.667 -3.952 8.315 1.00 0.00 C ATOM 613 CZ PHE A 43 112.879 -3.273 9.251 1.00 0.00 C ATOM 0 H PHE A 43 114.294 -3.013 3.989 1.00 0.00 H new ATOM 0 HA PHE A 43 112.686 -0.696 4.943 1.00 0.00 H new ATOM 0 HB2 PHE A 43 115.507 -1.602 5.628 1.00 0.00 H new ATOM 0 HB3 PHE A 43 114.762 -0.120 6.194 1.00 0.00 H new ATOM 0 HD1 PHE A 43 112.988 -0.155 7.889 1.00 0.00 H new ATOM 0 HD2 PHE A 43 114.819 -3.785 6.503 1.00 0.00 H new ATOM 0 HE1 PHE A 43 112.024 -1.378 9.820 1.00 0.00 H new ATOM 0 HE2 PHE A 43 113.856 -5.009 8.433 1.00 0.00 H new ATOM 0 HZ PHE A 43 112.460 -3.806 10.092 1.00 0.00 H new ATOM 623 N THR A 44 113.646 0.789 3.168 1.00 0.00 N ATOM 624 CA THR A 44 114.139 1.589 2.048 1.00 0.00 C ATOM 625 C THR A 44 114.411 3.023 2.484 1.00 0.00 C ATOM 626 O THR A 44 113.626 3.611 3.227 1.00 0.00 O ATOM 627 CB THR A 44 113.104 1.589 0.921 1.00 0.00 C ATOM 628 OG1 THR A 44 112.768 0.249 0.591 1.00 0.00 O ATOM 629 CG2 THR A 44 113.683 2.288 -0.310 1.00 0.00 C ATOM 0 H THR A 44 112.793 1.142 3.602 1.00 0.00 H new ATOM 0 HA THR A 44 115.072 1.149 1.695 1.00 0.00 H new ATOM 0 HB THR A 44 112.210 2.120 1.249 1.00 0.00 H new ATOM 0 HG1 THR A 44 112.662 0.168 -0.380 1.00 0.00 H new ATOM 0 HG21 THR A 44 112.944 2.286 -1.111 1.00 0.00 H new ATOM 0 HG22 THR A 44 113.941 3.316 -0.057 1.00 0.00 H new ATOM 0 HG23 THR A 44 114.577 1.760 -0.641 1.00 0.00 H new ATOM 637 N TYR A 45 115.531 3.566 2.016 1.00 0.00 N ATOM 638 CA TYR A 45 115.879 4.956 2.283 1.00 0.00 C ATOM 639 C TYR A 45 116.097 5.684 0.963 1.00 0.00 C ATOM 640 O TYR A 45 116.828 5.197 0.100 1.00 0.00 O ATOM 641 CB TYR A 45 117.154 5.026 3.128 1.00 0.00 C ATOM 642 CG TYR A 45 117.026 4.339 4.466 1.00 0.00 C ATOM 643 CD1 TYR A 45 116.581 5.057 5.582 1.00 0.00 C ATOM 644 CD2 TYR A 45 117.353 2.983 4.590 1.00 0.00 C ATOM 645 CE1 TYR A 45 116.464 4.420 6.823 1.00 0.00 C ATOM 646 CE2 TYR A 45 117.235 2.346 5.831 1.00 0.00 C ATOM 647 CZ TYR A 45 116.790 3.064 6.948 1.00 0.00 C ATOM 648 OH TYR A 45 116.674 2.436 8.172 1.00 0.00 O ATOM 0 H TYR A 45 116.214 3.063 1.449 1.00 0.00 H new ATOM 0 HA TYR A 45 115.066 5.430 2.832 1.00 0.00 H new ATOM 0 HB2 TYR A 45 117.975 4.572 2.572 1.00 0.00 H new ATOM 0 HB3 TYR A 45 117.417 6.071 3.289 1.00 0.00 H new ATOM 0 HD1 TYR A 45 116.328 6.102 5.486 1.00 0.00 H new ATOM 0 HD2 TYR A 45 117.696 2.429 3.729 1.00 0.00 H new ATOM 0 HE1 TYR A 45 116.122 4.975 7.684 1.00 0.00 H new ATOM 0 HE2 TYR A 45 117.487 1.300 5.927 1.00 0.00 H new ATOM 0 HH TYR A 45 116.939 1.497 8.084 1.00 0.00 H new ATOM 658 N THR A 46 115.454 6.837 0.806 1.00 0.00 N ATOM 659 CA THR A 46 115.552 7.603 -0.432 1.00 0.00 C ATOM 660 C THR A 46 115.941 9.046 -0.135 1.00 0.00 C ATOM 661 O THR A 46 115.651 9.570 0.942 1.00 0.00 O ATOM 662 CB THR A 46 114.209 7.590 -1.173 1.00 0.00 C ATOM 663 OG1 THR A 46 113.220 8.207 -0.364 1.00 0.00 O ATOM 664 CG2 THR A 46 113.781 6.153 -1.493 1.00 0.00 C ATOM 0 H THR A 46 114.861 7.261 1.519 1.00 0.00 H new ATOM 0 HA THR A 46 116.318 7.142 -1.056 1.00 0.00 H new ATOM 0 HB THR A 46 114.321 8.137 -2.109 1.00 0.00 H new ATOM 0 HG1 THR A 46 112.361 8.201 -0.836 1.00 0.00 H new ATOM 0 HG21 THR A 46 112.826 6.166 -2.019 1.00 0.00 H new ATOM 0 HG22 THR A 46 114.535 5.680 -2.122 1.00 0.00 H new ATOM 0 HG23 THR A 46 113.677 5.589 -0.566 1.00 0.00 H new ATOM 672 N GLU A 47 116.578 9.683 -1.113 1.00 0.00 N ATOM 673 CA GLU A 47 116.996 11.072 -0.984 1.00 0.00 C ATOM 674 C GLU A 47 116.547 11.861 -2.207 1.00 0.00 C ATOM 675 O GLU A 47 116.473 11.315 -3.310 1.00 0.00 O ATOM 676 CB GLU A 47 118.519 11.147 -0.849 1.00 0.00 C ATOM 677 CG GLU A 47 118.940 12.583 -0.514 1.00 0.00 C ATOM 678 CD GLU A 47 120.464 12.734 -0.451 1.00 0.00 C ATOM 679 OE1 GLU A 47 121.173 11.767 -0.690 1.00 0.00 O ATOM 680 OE2 GLU A 47 120.907 13.834 -0.161 1.00 0.00 O ATOM 0 H GLU A 47 116.816 9.255 -2.008 1.00 0.00 H new ATOM 0 HA GLU A 47 116.538 11.501 -0.093 1.00 0.00 H new ATOM 0 HB2 GLU A 47 118.858 10.467 -0.067 1.00 0.00 H new ATOM 0 HB3 GLU A 47 118.992 10.827 -1.777 1.00 0.00 H new ATOM 0 HG2 GLU A 47 118.539 13.263 -1.265 1.00 0.00 H new ATOM 0 HG3 GLU A 47 118.507 12.874 0.443 1.00 0.00 H new ATOM 687 N LYS A 48 116.228 13.135 -1.997 1.00 0.00 N ATOM 688 CA LYS A 48 115.793 14.009 -3.083 1.00 0.00 C ATOM 689 C LYS A 48 116.679 15.249 -3.146 1.00 0.00 C ATOM 690 O LYS A 48 116.934 15.890 -2.127 1.00 0.00 O ATOM 691 CB LYS A 48 114.339 14.428 -2.857 1.00 0.00 C ATOM 692 CG LYS A 48 113.840 15.222 -4.066 1.00 0.00 C ATOM 693 CD LYS A 48 112.415 15.714 -3.803 1.00 0.00 C ATOM 694 CE LYS A 48 111.860 16.371 -5.069 1.00 0.00 C ATOM 695 NZ LYS A 48 110.778 17.325 -4.698 1.00 0.00 N ATOM 0 H LYS A 48 116.263 13.586 -1.083 1.00 0.00 H new ATOM 0 HA LYS A 48 115.872 13.468 -4.026 1.00 0.00 H new ATOM 0 HB2 LYS A 48 113.715 13.547 -2.705 1.00 0.00 H new ATOM 0 HB3 LYS A 48 114.261 15.033 -1.954 1.00 0.00 H new ATOM 0 HG2 LYS A 48 114.499 16.069 -4.255 1.00 0.00 H new ATOM 0 HG3 LYS A 48 113.861 14.597 -4.959 1.00 0.00 H new ATOM 0 HD2 LYS A 48 111.780 14.880 -3.505 1.00 0.00 H new ATOM 0 HD3 LYS A 48 112.411 16.427 -2.979 1.00 0.00 H new ATOM 0 HE2 LYS A 48 112.656 16.895 -5.599 1.00 0.00 H new ATOM 0 HE3 LYS A 48 111.473 15.610 -5.747 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 110.481 17.858 -5.540 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 109.966 16.798 -4.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 111.130 17.986 -3.976 1.00 0.00 H new ATOM 709 N SER A 49 117.145 15.584 -4.346 1.00 0.00 N ATOM 710 CA SER A 49 118.026 16.734 -4.528 1.00 0.00 C ATOM 711 C SER A 49 117.345 17.811 -5.365 1.00 0.00 C ATOM 712 O SER A 49 116.672 17.514 -6.352 1.00 0.00 O ATOM 713 CB SER A 49 119.315 16.292 -5.222 1.00 0.00 C ATOM 714 OG SER A 49 120.212 17.394 -5.286 1.00 0.00 O ATOM 0 H SER A 49 116.928 15.077 -5.204 1.00 0.00 H new ATOM 0 HA SER A 49 118.258 17.148 -3.547 1.00 0.00 H new ATOM 0 HB2 SER A 49 119.772 15.467 -4.676 1.00 0.00 H new ATOM 0 HB3 SER A 49 119.096 15.927 -6.225 1.00 0.00 H new ATOM 0 HG SER A 49 121.041 17.116 -5.729 1.00 0.00 H new ATOM 720 N ARG A 50 117.527 19.064 -4.959 1.00 0.00 N ATOM 721 CA ARG A 50 116.947 20.192 -5.682 1.00 0.00 C ATOM 722 C ARG A 50 117.984 21.297 -5.856 1.00 0.00 C ATOM 723 O ARG A 50 118.810 21.529 -4.973 1.00 0.00 O ATOM 724 CB ARG A 50 115.739 20.737 -4.918 1.00 0.00 C ATOM 725 CG ARG A 50 115.049 21.817 -5.756 1.00 0.00 C ATOM 726 CD ARG A 50 113.796 22.306 -5.027 1.00 0.00 C ATOM 727 NE ARG A 50 114.170 23.059 -3.827 1.00 0.00 N ATOM 728 CZ ARG A 50 113.277 23.632 -3.005 1.00 0.00 C ATOM 729 NH1 ARG A 50 111.985 23.563 -3.218 1.00 0.00 N ATOM 730 NH2 ARG A 50 113.709 24.282 -1.960 1.00 0.00 N ATOM 0 H ARG A 50 118.070 19.324 -4.136 1.00 0.00 H new ATOM 0 HA ARG A 50 116.626 19.848 -6.665 1.00 0.00 H new ATOM 0 HB2 ARG A 50 115.040 19.930 -4.699 1.00 0.00 H new ATOM 0 HB3 ARG A 50 116.057 21.152 -3.962 1.00 0.00 H new ATOM 0 HG2 ARG A 50 115.731 22.650 -5.928 1.00 0.00 H new ATOM 0 HG3 ARG A 50 114.781 21.417 -6.734 1.00 0.00 H new ATOM 0 HD2 ARG A 50 113.203 22.936 -5.690 1.00 0.00 H new ATOM 0 HD3 ARG A 50 113.171 21.456 -4.752 1.00 0.00 H new ATOM 0 HE ARG A 50 115.161 23.153 -3.605 1.00 0.00 H new ATOM 0 HH11 ARG A 50 111.628 23.061 -4.031 1.00 0.00 H new ATOM 0 HH12 ARG A 50 111.337 24.011 -2.571 1.00 0.00 H new ATOM 0 HH21 ARG A 50 114.711 24.348 -1.779 1.00 0.00 H new ATOM 0 HH22 ARG A 50 113.045 24.724 -1.324 1.00 0.00 H new ATOM 744 N THR A 51 117.936 21.978 -6.998 1.00 0.00 N ATOM 745 CA THR A 51 118.879 23.058 -7.282 1.00 0.00 C ATOM 746 C THR A 51 118.141 24.387 -7.411 1.00 0.00 C ATOM 747 O THR A 51 117.096 24.470 -8.056 1.00 0.00 O ATOM 748 CB THR A 51 119.631 22.763 -8.581 1.00 0.00 C ATOM 749 OG1 THR A 51 120.227 21.477 -8.498 1.00 0.00 O ATOM 750 CG2 THR A 51 120.718 23.817 -8.796 1.00 0.00 C ATOM 0 H THR A 51 117.258 21.803 -7.739 1.00 0.00 H new ATOM 0 HA THR A 51 119.589 23.126 -6.458 1.00 0.00 H new ATOM 0 HB THR A 51 118.934 22.789 -9.418 1.00 0.00 H new ATOM 0 HG1 THR A 51 120.708 21.285 -9.330 1.00 0.00 H new ATOM 0 HG21 THR A 51 121.252 23.605 -9.722 1.00 0.00 H new ATOM 0 HG22 THR A 51 120.260 24.804 -8.859 1.00 0.00 H new ATOM 0 HG23 THR A 51 121.417 23.794 -7.960 1.00 0.00 H new ATOM 758 N ALA A 52 118.695 25.427 -6.791 1.00 0.00 N ATOM 759 CA ALA A 52 118.090 26.755 -6.837 1.00 0.00 C ATOM 760 C ALA A 52 119.127 27.800 -7.234 1.00 0.00 C ATOM 761 O ALA A 52 120.327 27.604 -7.036 1.00 0.00 O ATOM 762 CB ALA A 52 117.506 27.109 -5.468 1.00 0.00 C ATOM 0 H ALA A 52 119.560 25.375 -6.252 1.00 0.00 H new ATOM 0 HA ALA A 52 117.294 26.747 -7.581 1.00 0.00 H new ATOM 0 HB1 ALA A 52 117.056 28.101 -5.510 1.00 0.00 H new ATOM 0 HB2 ALA A 52 116.745 26.377 -5.197 1.00 0.00 H new ATOM 0 HB3 ALA A 52 118.300 27.102 -4.721 1.00 0.00 H new ATOM 768 N SER A 53 118.659 28.910 -7.794 1.00 0.00 N ATOM 769 CA SER A 53 119.558 29.984 -8.204 1.00 0.00 C ATOM 770 C SER A 53 120.391 30.482 -7.023 1.00 0.00 C ATOM 771 O SER A 53 121.567 30.811 -7.182 1.00 0.00 O ATOM 772 CB SER A 53 118.749 31.146 -8.782 1.00 0.00 C ATOM 773 OG SER A 53 117.929 30.664 -9.837 1.00 0.00 O ATOM 0 H SER A 53 117.671 29.090 -7.974 1.00 0.00 H new ATOM 0 HA SER A 53 120.233 29.591 -8.964 1.00 0.00 H new ATOM 0 HB2 SER A 53 118.134 31.599 -8.005 1.00 0.00 H new ATOM 0 HB3 SER A 53 119.418 31.923 -9.151 1.00 0.00 H new ATOM 0 HG SER A 53 117.407 31.405 -10.210 1.00 0.00 H new ATOM 779 N SER A 54 119.780 30.535 -5.843 1.00 0.00 N ATOM 780 CA SER A 54 120.484 30.989 -4.647 1.00 0.00 C ATOM 781 C SER A 54 121.688 30.099 -4.330 1.00 0.00 C ATOM 782 O SER A 54 122.695 30.576 -3.807 1.00 0.00 O ATOM 783 CB SER A 54 119.529 30.993 -3.454 1.00 0.00 C ATOM 784 OG SER A 54 119.183 29.653 -3.129 1.00 0.00 O ATOM 0 H SER A 54 118.807 30.272 -5.689 1.00 0.00 H new ATOM 0 HA SER A 54 120.847 31.999 -4.838 1.00 0.00 H new ATOM 0 HB2 SER A 54 119.999 31.478 -2.598 1.00 0.00 H new ATOM 0 HB3 SER A 54 118.632 31.565 -3.692 1.00 0.00 H new ATOM 0 HG SER A 54 118.664 29.642 -2.298 1.00 0.00 H new ATOM 790 N GLY A 55 121.584 28.810 -4.644 1.00 0.00 N ATOM 791 CA GLY A 55 122.680 27.878 -4.385 1.00 0.00 C ATOM 792 C GLY A 55 122.661 27.320 -2.957 1.00 0.00 C ATOM 793 O GLY A 55 123.687 26.851 -2.465 1.00 0.00 O ATOM 0 H GLY A 55 120.760 28.389 -5.074 1.00 0.00 H new ATOM 0 HA2 GLY A 55 122.623 27.052 -5.094 1.00 0.00 H new ATOM 0 HA3 GLY A 55 123.630 28.384 -4.560 1.00 0.00 H new ATOM 797 N ASP A 56 121.507 27.368 -2.292 1.00 0.00 N ATOM 798 CA ASP A 56 121.395 26.844 -0.935 1.00 0.00 C ATOM 799 C ASP A 56 121.179 25.334 -0.957 1.00 0.00 C ATOM 800 O ASP A 56 120.927 24.750 -2.010 1.00 0.00 O ATOM 801 CB ASP A 56 120.236 27.529 -0.202 1.00 0.00 C ATOM 802 CG ASP A 56 118.906 27.326 -0.932 1.00 0.00 C ATOM 803 OD1 ASP A 56 118.815 26.439 -1.767 1.00 0.00 O ATOM 804 OD2 ASP A 56 117.985 28.072 -0.640 1.00 0.00 O ATOM 0 H ASP A 56 120.644 27.761 -2.668 1.00 0.00 H new ATOM 0 HA ASP A 56 122.325 27.052 -0.407 1.00 0.00 H new ATOM 0 HB2 ASP A 56 120.160 27.132 0.810 1.00 0.00 H new ATOM 0 HB3 ASP A 56 120.442 28.595 -0.111 1.00 0.00 H new ATOM 809 N TYR A 57 121.281 24.706 0.212 1.00 0.00 N ATOM 810 CA TYR A 57 121.094 23.261 0.320 1.00 0.00 C ATOM 811 C TYR A 57 119.912 22.939 1.229 1.00 0.00 C ATOM 812 O TYR A 57 119.795 23.482 2.328 1.00 0.00 O ATOM 813 CB TYR A 57 122.359 22.616 0.886 1.00 0.00 C ATOM 814 CG TYR A 57 123.589 22.863 0.043 1.00 0.00 C ATOM 815 CD1 TYR A 57 123.829 22.077 -1.090 1.00 0.00 C ATOM 816 CD2 TYR A 57 124.488 23.876 0.396 1.00 0.00 C ATOM 817 CE1 TYR A 57 124.969 22.306 -1.871 1.00 0.00 C ATOM 818 CE2 TYR A 57 125.627 24.104 -0.384 1.00 0.00 C ATOM 819 CZ TYR A 57 125.869 23.320 -1.518 1.00 0.00 C ATOM 820 OH TYR A 57 126.991 23.544 -2.287 1.00 0.00 O ATOM 0 H TYR A 57 121.491 25.172 1.094 1.00 0.00 H new ATOM 0 HA TYR A 57 120.892 22.864 -0.675 1.00 0.00 H new ATOM 0 HB2 TYR A 57 122.534 22.999 1.891 1.00 0.00 H new ATOM 0 HB3 TYR A 57 122.200 21.541 0.977 1.00 0.00 H new ATOM 0 HD1 TYR A 57 123.136 21.295 -1.362 1.00 0.00 H new ATOM 0 HD2 TYR A 57 124.302 24.482 1.271 1.00 0.00 H new ATOM 0 HE1 TYR A 57 125.154 21.700 -2.746 1.00 0.00 H new ATOM 0 HE2 TYR A 57 126.320 24.886 -0.111 1.00 0.00 H new ATOM 0 HH TYR A 57 127.508 24.283 -1.904 1.00 0.00 H new ATOM 830 N ASN A 58 119.038 22.051 0.763 1.00 0.00 N ATOM 831 CA ASN A 58 117.883 21.627 1.549 1.00 0.00 C ATOM 832 C ASN A 58 117.996 20.146 1.896 1.00 0.00 C ATOM 833 O ASN A 58 118.245 19.315 1.024 1.00 0.00 O ATOM 834 CB ASN A 58 116.597 21.869 0.755 1.00 0.00 C ATOM 835 CG ASN A 58 116.462 23.349 0.416 1.00 0.00 C ATOM 836 OD1 ASN A 58 116.159 23.701 -0.724 1.00 0.00 O ATOM 837 ND2 ASN A 58 116.669 24.243 1.344 1.00 0.00 N ATOM 0 H ASN A 58 119.108 21.611 -0.155 1.00 0.00 H new ATOM 0 HA ASN A 58 117.855 22.208 2.471 1.00 0.00 H new ATOM 0 HB2 ASN A 58 116.609 21.278 -0.161 1.00 0.00 H new ATOM 0 HB3 ASN A 58 115.735 21.541 1.335 1.00 0.00 H new ATOM 0 HD21 ASN A 58 116.580 25.235 1.125 1.00 0.00 H new ATOM 0 HD22 ASN A 58 116.920 23.949 2.288 1.00 0.00 H new ATOM 844 N LYS A 59 117.812 19.822 3.172 1.00 0.00 N ATOM 845 CA LYS A 59 117.908 18.437 3.614 1.00 0.00 C ATOM 846 C LYS A 59 116.549 17.749 3.525 1.00 0.00 C ATOM 847 O LYS A 59 115.601 18.133 4.211 1.00 0.00 O ATOM 848 CB LYS A 59 118.417 18.383 5.056 1.00 0.00 C ATOM 849 CG LYS A 59 118.663 16.929 5.461 1.00 0.00 C ATOM 850 CD LYS A 59 119.269 16.884 6.864 1.00 0.00 C ATOM 851 CE LYS A 59 118.230 17.350 7.887 1.00 0.00 C ATOM 852 NZ LYS A 59 118.708 17.030 9.261 1.00 0.00 N ATOM 0 H LYS A 59 117.598 20.492 3.910 1.00 0.00 H new ATOM 0 HA LYS A 59 118.609 17.915 2.962 1.00 0.00 H new ATOM 0 HB2 LYS A 59 119.339 18.957 5.148 1.00 0.00 H new ATOM 0 HB3 LYS A 59 117.689 18.839 5.726 1.00 0.00 H new ATOM 0 HG2 LYS A 59 117.727 16.372 5.440 1.00 0.00 H new ATOM 0 HG3 LYS A 59 119.335 16.451 4.748 1.00 0.00 H new ATOM 0 HD2 LYS A 59 119.595 15.871 7.098 1.00 0.00 H new ATOM 0 HD3 LYS A 59 120.152 17.522 6.911 1.00 0.00 H new ATOM 0 HE2 LYS A 59 118.063 18.423 7.789 1.00 0.00 H new ATOM 0 HE3 LYS A 59 117.274 16.860 7.700 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 118.002 17.346 9.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 118.846 16.003 9.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 119.610 17.517 9.437 1.00 0.00 H new ATOM 866 N ASN A 60 116.463 16.730 2.676 1.00 0.00 N ATOM 867 CA ASN A 60 115.227 15.968 2.517 1.00 0.00 C ATOM 868 C ASN A 60 115.507 14.477 2.671 1.00 0.00 C ATOM 869 O ASN A 60 116.403 13.940 2.019 1.00 0.00 O ATOM 870 CB ASN A 60 114.626 16.233 1.134 1.00 0.00 C ATOM 871 CG ASN A 60 114.295 17.715 0.969 1.00 0.00 C ATOM 872 OD1 ASN A 60 114.181 18.447 1.952 1.00 0.00 O ATOM 873 ND2 ASN A 60 114.133 18.204 -0.230 1.00 0.00 N ATOM 0 H ASN A 60 117.233 16.412 2.087 1.00 0.00 H new ATOM 0 HA ASN A 60 114.521 16.282 3.286 1.00 0.00 H new ATOM 0 HB2 ASN A 60 115.328 15.923 0.360 1.00 0.00 H new ATOM 0 HB3 ASN A 60 113.723 15.636 1.003 1.00 0.00 H new ATOM 0 HD21 ASN A 60 113.912 19.192 -0.352 1.00 0.00 H new ATOM 0 HD22 ASN A 60 114.227 17.598 -1.045 1.00 0.00 H new ATOM 880 N GLN A 61 114.743 13.810 3.533 1.00 0.00 N ATOM 881 CA GLN A 61 114.932 12.377 3.747 1.00 0.00 C ATOM 882 C GLN A 61 113.587 11.666 3.826 1.00 0.00 C ATOM 883 O GLN A 61 112.623 12.218 4.353 1.00 0.00 O ATOM 884 CB GLN A 61 115.713 12.145 5.042 1.00 0.00 C ATOM 885 CG GLN A 61 116.039 10.657 5.189 1.00 0.00 C ATOM 886 CD GLN A 61 116.668 10.394 6.553 1.00 0.00 C ATOM 887 OE1 GLN A 61 116.065 10.692 7.585 1.00 0.00 O ATOM 888 NE2 GLN A 61 117.852 9.849 6.622 1.00 0.00 N ATOM 0 H GLN A 61 113.998 14.231 4.088 1.00 0.00 H new ATOM 0 HA GLN A 61 115.494 11.971 2.905 1.00 0.00 H new ATOM 0 HB2 GLN A 61 116.633 12.729 5.033 1.00 0.00 H new ATOM 0 HB3 GLN A 61 115.128 12.485 5.897 1.00 0.00 H new ATOM 0 HG2 GLN A 61 115.131 10.064 5.078 1.00 0.00 H new ATOM 0 HG3 GLN A 61 116.722 10.346 4.398 1.00 0.00 H new ATOM 0 HE21 GLN A 61 118.351 9.603 5.767 1.00 0.00 H new ATOM 0 HE22 GLN A 61 118.279 9.670 7.531 1.00 0.00 H new ATOM 897 N TYR A 62 113.529 10.448 3.293 1.00 0.00 N ATOM 898 CA TYR A 62 112.310 9.649 3.365 1.00 0.00 C ATOM 899 C TYR A 62 112.653 8.180 3.597 1.00 0.00 C ATOM 900 O TYR A 62 113.590 7.659 2.996 1.00 0.00 O ATOM 901 CB TYR A 62 111.531 9.802 2.058 1.00 0.00 C ATOM 902 CG TYR A 62 110.202 9.086 2.039 1.00 0.00 C ATOM 903 CD1 TYR A 62 109.057 9.720 2.535 1.00 0.00 C ATOM 904 CD2 TYR A 62 110.113 7.791 1.513 1.00 0.00 C ATOM 905 CE1 TYR A 62 107.823 9.061 2.505 1.00 0.00 C ATOM 906 CE2 TYR A 62 108.878 7.132 1.485 1.00 0.00 C ATOM 907 CZ TYR A 62 107.734 7.767 1.980 1.00 0.00 C ATOM 908 OH TYR A 62 106.517 7.117 1.951 1.00 0.00 O ATOM 0 H TYR A 62 114.306 9.996 2.810 1.00 0.00 H new ATOM 0 HA TYR A 62 111.700 9.998 4.198 1.00 0.00 H new ATOM 0 HB2 TYR A 62 111.362 10.863 1.872 1.00 0.00 H new ATOM 0 HB3 TYR A 62 112.144 9.428 1.238 1.00 0.00 H new ATOM 0 HD1 TYR A 62 109.126 10.718 2.941 1.00 0.00 H new ATOM 0 HD2 TYR A 62 110.996 7.301 1.129 1.00 0.00 H new ATOM 0 HE1 TYR A 62 106.940 9.551 2.887 1.00 0.00 H new ATOM 0 HE2 TYR A 62 108.809 6.133 1.081 1.00 0.00 H new ATOM 0 HH TYR A 62 106.630 6.228 1.554 1.00 0.00 H new ATOM 918 N TYR A 63 111.898 7.512 4.466 1.00 0.00 N ATOM 919 CA TYR A 63 112.125 6.091 4.730 1.00 0.00 C ATOM 920 C TYR A 63 110.793 5.349 4.766 1.00 0.00 C ATOM 921 O TYR A 63 109.776 5.934 5.125 1.00 0.00 O ATOM 922 CB TYR A 63 112.872 5.919 6.057 1.00 0.00 C ATOM 923 CG TYR A 63 112.065 6.293 7.280 1.00 0.00 C ATOM 924 CD1 TYR A 63 111.285 5.326 7.926 1.00 0.00 C ATOM 925 CD2 TYR A 63 112.098 7.605 7.766 1.00 0.00 C ATOM 926 CE1 TYR A 63 110.539 5.672 9.059 1.00 0.00 C ATOM 927 CE2 TYR A 63 111.352 7.951 8.898 1.00 0.00 C ATOM 928 CZ TYR A 63 110.572 6.985 9.545 1.00 0.00 C ATOM 929 OH TYR A 63 109.837 7.325 10.662 1.00 0.00 O ATOM 0 H TYR A 63 111.131 7.926 4.995 1.00 0.00 H new ATOM 0 HA TYR A 63 112.735 5.671 3.930 1.00 0.00 H new ATOM 0 HB2 TYR A 63 113.189 4.880 6.150 1.00 0.00 H new ATOM 0 HB3 TYR A 63 113.776 6.528 6.033 1.00 0.00 H new ATOM 0 HD1 TYR A 63 111.259 4.314 7.550 1.00 0.00 H new ATOM 0 HD2 TYR A 63 112.699 8.351 7.267 1.00 0.00 H new ATOM 0 HE1 TYR A 63 109.938 4.926 9.558 1.00 0.00 H new ATOM 0 HE2 TYR A 63 111.378 8.964 9.273 1.00 0.00 H new ATOM 0 HH TYR A 63 108.883 7.327 10.438 1.00 0.00 H new ATOM 939 N GLY A 64 110.805 4.066 4.412 1.00 0.00 N ATOM 940 CA GLY A 64 109.565 3.299 4.328 1.00 0.00 C ATOM 941 C GLY A 64 109.779 1.845 4.734 1.00 0.00 C ATOM 942 O GLY A 64 110.783 1.238 4.362 1.00 0.00 O ATOM 0 H GLY A 64 111.648 3.541 4.181 1.00 0.00 H new ATOM 0 HA2 GLY A 64 108.812 3.751 4.973 1.00 0.00 H new ATOM 0 HA3 GLY A 64 109.179 3.340 3.310 1.00 0.00 H new ATOM 946 N ILE A 65 108.846 1.297 5.515 1.00 0.00 N ATOM 947 CA ILE A 65 108.937 -0.098 5.945 1.00 0.00 C ATOM 948 C ILE A 65 107.769 -0.890 5.369 1.00 0.00 C ATOM 949 O ILE A 65 106.651 -0.381 5.289 1.00 0.00 O ATOM 950 CB ILE A 65 108.945 -0.181 7.475 1.00 0.00 C ATOM 951 CG1 ILE A 65 107.670 0.449 8.047 1.00 0.00 C ATOM 952 CG2 ILE A 65 110.167 0.571 8.007 1.00 0.00 C ATOM 953 CD1 ILE A 65 107.557 0.131 9.541 1.00 0.00 C ATOM 0 H ILE A 65 108.025 1.794 5.860 1.00 0.00 H new ATOM 0 HA ILE A 65 109.868 -0.528 5.576 1.00 0.00 H new ATOM 0 HB ILE A 65 108.987 -1.227 7.779 1.00 0.00 H new ATOM 0 HG12 ILE A 65 107.688 1.528 7.896 1.00 0.00 H new ATOM 0 HG13 ILE A 65 106.797 0.068 7.518 1.00 0.00 H new ATOM 0 HG21 ILE A 65 110.182 0.518 9.096 1.00 0.00 H new ATOM 0 HG22 ILE A 65 111.075 0.117 7.609 1.00 0.00 H new ATOM 0 HG23 ILE A 65 110.116 1.614 7.696 1.00 0.00 H new ATOM 0 HD11 ILE A 65 106.649 0.582 9.941 1.00 0.00 H new ATOM 0 HD12 ILE A 65 107.518 -0.949 9.681 1.00 0.00 H new ATOM 0 HD13 ILE A 65 108.423 0.534 10.065 1.00 0.00 H new ATOM 965 N THR A 66 108.039 -2.120 4.935 1.00 0.00 N ATOM 966 CA THR A 66 107.017 -2.940 4.290 1.00 0.00 C ATOM 967 C THR A 66 107.002 -4.359 4.851 1.00 0.00 C ATOM 968 O THR A 66 107.969 -4.810 5.467 1.00 0.00 O ATOM 969 CB THR A 66 107.275 -3.009 2.781 1.00 0.00 C ATOM 970 OG1 THR A 66 108.540 -3.609 2.548 1.00 0.00 O ATOM 971 CG2 THR A 66 107.254 -1.605 2.172 1.00 0.00 C ATOM 0 H THR A 66 108.952 -2.568 5.018 1.00 0.00 H new ATOM 0 HA THR A 66 106.051 -2.475 4.487 1.00 0.00 H new ATOM 0 HB THR A 66 106.491 -3.605 2.314 1.00 0.00 H new ATOM 0 HG1 THR A 66 108.707 -3.656 1.583 1.00 0.00 H new ATOM 0 HG21 THR A 66 107.439 -1.671 1.100 1.00 0.00 H new ATOM 0 HG22 THR A 66 106.280 -1.148 2.345 1.00 0.00 H new ATOM 0 HG23 THR A 66 108.029 -0.995 2.637 1.00 0.00 H new ATOM 979 N ALA A 67 105.890 -5.052 4.628 1.00 0.00 N ATOM 980 CA ALA A 67 105.772 -6.459 4.994 1.00 0.00 C ATOM 981 C ALA A 67 104.701 -7.112 4.126 1.00 0.00 C ATOM 982 O ALA A 67 103.734 -6.444 3.755 1.00 0.00 O ATOM 983 CB ALA A 67 105.393 -6.591 6.470 1.00 0.00 C ATOM 0 H ALA A 67 105.054 -4.660 4.194 1.00 0.00 H new ATOM 0 HA ALA A 67 106.729 -6.955 4.834 1.00 0.00 H new ATOM 0 HB1 ALA A 67 105.308 -7.646 6.731 1.00 0.00 H new ATOM 0 HB2 ALA A 67 106.162 -6.126 7.086 1.00 0.00 H new ATOM 0 HB3 ALA A 67 104.438 -6.096 6.646 1.00 0.00 H new ATOM 989 N GLY A 68 104.889 -8.383 3.759 1.00 0.00 N ATOM 990 CA GLY A 68 103.861 -9.069 2.974 1.00 0.00 C ATOM 991 C GLY A 68 104.107 -10.575 2.797 1.00 0.00 C ATOM 992 O GLY A 68 105.237 -11.037 2.963 1.00 0.00 O ATOM 0 H GLY A 68 105.713 -8.941 3.983 1.00 0.00 H new ATOM 0 HA2 GLY A 68 102.894 -8.924 3.456 1.00 0.00 H new ATOM 0 HA3 GLY A 68 103.800 -8.604 1.990 1.00 0.00 H new ATOM 996 N PRO A 69 103.076 -11.344 2.478 1.00 0.00 N ATOM 997 CA PRO A 69 103.224 -12.812 2.220 1.00 0.00 C ATOM 998 C PRO A 69 103.853 -13.120 0.859 1.00 0.00 C ATOM 999 O PRO A 69 103.882 -12.261 -0.026 1.00 0.00 O ATOM 1000 CB PRO A 69 101.794 -13.349 2.284 1.00 0.00 C ATOM 1001 CG PRO A 69 100.935 -12.206 1.873 1.00 0.00 C ATOM 1002 CD PRO A 69 101.659 -10.938 2.323 1.00 0.00 C ATOM 0 HA PRO A 69 103.894 -13.272 2.946 1.00 0.00 H new ATOM 0 HB2 PRO A 69 101.662 -14.201 1.618 1.00 0.00 H new ATOM 0 HB3 PRO A 69 101.545 -13.689 3.289 1.00 0.00 H new ATOM 0 HG2 PRO A 69 100.782 -12.204 0.794 1.00 0.00 H new ATOM 0 HG3 PRO A 69 99.950 -12.275 2.334 1.00 0.00 H new ATOM 0 HD2 PRO A 69 101.554 -10.141 1.587 1.00 0.00 H new ATOM 0 HD3 PRO A 69 101.251 -10.561 3.261 1.00 0.00 H new ATOM 1010 N ALA A 70 104.338 -14.354 0.686 1.00 0.00 N ATOM 1011 CA ALA A 70 104.975 -14.743 -0.568 1.00 0.00 C ATOM 1012 C ALA A 70 104.735 -16.226 -0.852 1.00 0.00 C ATOM 1013 O ALA A 70 104.507 -17.008 0.071 1.00 0.00 O ATOM 1014 CB ALA A 70 106.478 -14.457 -0.497 1.00 0.00 C ATOM 0 H ALA A 70 104.301 -15.090 1.391 1.00 0.00 H new ATOM 0 HA ALA A 70 104.538 -14.161 -1.379 1.00 0.00 H new ATOM 0 HB1 ALA A 70 106.949 -14.749 -1.436 1.00 0.00 H new ATOM 0 HB2 ALA A 70 106.638 -13.392 -0.327 1.00 0.00 H new ATOM 0 HB3 ALA A 70 106.918 -15.026 0.322 1.00 0.00 H new ATOM 1020 N TYR A 71 104.785 -16.611 -2.127 1.00 0.00 N ATOM 1021 CA TYR A 71 104.584 -18.005 -2.509 1.00 0.00 C ATOM 1022 C TYR A 71 105.841 -18.539 -3.184 1.00 0.00 C ATOM 1023 O TYR A 71 106.354 -17.922 -4.117 1.00 0.00 O ATOM 1024 CB TYR A 71 103.398 -18.120 -3.467 1.00 0.00 C ATOM 1025 CG TYR A 71 102.098 -17.628 -2.876 1.00 0.00 C ATOM 1026 CD1 TYR A 71 101.353 -18.462 -2.034 1.00 0.00 C ATOM 1027 CD2 TYR A 71 101.638 -16.340 -3.170 1.00 0.00 C ATOM 1028 CE1 TYR A 71 100.148 -18.007 -1.485 1.00 0.00 C ATOM 1029 CE2 TYR A 71 100.434 -15.884 -2.621 1.00 0.00 C ATOM 1030 CZ TYR A 71 99.688 -16.717 -1.780 1.00 0.00 C ATOM 1031 OH TYR A 71 98.501 -16.269 -1.239 1.00 0.00 O ATOM 0 H TYR A 71 104.962 -15.979 -2.908 1.00 0.00 H new ATOM 0 HA TYR A 71 104.377 -18.592 -1.614 1.00 0.00 H new ATOM 0 HB2 TYR A 71 103.615 -17.552 -4.372 1.00 0.00 H new ATOM 0 HB3 TYR A 71 103.281 -19.162 -3.765 1.00 0.00 H new ATOM 0 HD1 TYR A 71 101.708 -19.457 -1.808 1.00 0.00 H new ATOM 0 HD2 TYR A 71 102.212 -15.697 -3.821 1.00 0.00 H new ATOM 0 HE1 TYR A 71 99.574 -18.650 -0.835 1.00 0.00 H new ATOM 0 HE2 TYR A 71 100.081 -14.889 -2.847 1.00 0.00 H new ATOM 0 HH TYR A 71 98.328 -15.354 -1.543 1.00 0.00 H new ATOM 1041 N ARG A 72 106.312 -19.692 -2.716 1.00 0.00 N ATOM 1042 CA ARG A 72 107.548 -20.283 -3.222 1.00 0.00 C ATOM 1043 C ARG A 72 107.262 -21.593 -3.949 1.00 0.00 C ATOM 1044 O ARG A 72 106.445 -22.397 -3.499 1.00 0.00 O ATOM 1045 CB ARG A 72 108.511 -20.544 -2.062 1.00 0.00 C ATOM 1046 CG ARG A 72 108.895 -19.216 -1.407 1.00 0.00 C ATOM 1047 CD ARG A 72 109.883 -19.475 -0.268 1.00 0.00 C ATOM 1048 NE ARG A 72 111.173 -19.917 -0.807 1.00 0.00 N ATOM 1049 CZ ARG A 72 112.073 -19.085 -1.352 1.00 0.00 C ATOM 1050 NH1 ARG A 72 111.864 -17.793 -1.446 1.00 0.00 N ATOM 1051 NH2 ARG A 72 113.194 -19.576 -1.804 1.00 0.00 N ATOM 0 H ARG A 72 105.855 -20.237 -1.985 1.00 0.00 H new ATOM 0 HA ARG A 72 108.001 -19.584 -3.925 1.00 0.00 H new ATOM 0 HB2 ARG A 72 108.044 -21.201 -1.329 1.00 0.00 H new ATOM 0 HB3 ARG A 72 109.403 -21.054 -2.424 1.00 0.00 H new ATOM 0 HG2 ARG A 72 109.341 -18.550 -2.145 1.00 0.00 H new ATOM 0 HG3 ARG A 72 108.005 -18.717 -1.024 1.00 0.00 H new ATOM 0 HD2 ARG A 72 110.018 -18.567 0.319 1.00 0.00 H new ATOM 0 HD3 ARG A 72 109.483 -20.233 0.405 1.00 0.00 H new ATOM 0 HE ARG A 72 111.398 -20.911 -0.765 1.00 0.00 H new ATOM 0 HH11 ARG A 72 110.994 -17.391 -1.098 1.00 0.00 H new ATOM 0 HH12 ARG A 72 112.572 -17.191 -1.867 1.00 0.00 H new ATOM 0 HH21 ARG A 72 113.375 -20.578 -1.740 1.00 0.00 H new ATOM 0 HH22 ARG A 72 113.890 -18.958 -2.222 1.00 0.00 H new ATOM 1065 N ILE A 73 107.932 -21.790 -5.079 1.00 0.00 N ATOM 1066 CA ILE A 73 107.741 -22.994 -5.881 1.00 0.00 C ATOM 1067 C ILE A 73 106.304 -23.053 -6.395 1.00 0.00 C ATOM 1068 O ILE A 73 105.610 -24.063 -6.262 1.00 0.00 O ATOM 1069 CB ILE A 73 108.075 -24.253 -5.061 1.00 0.00 C ATOM 1070 CG1 ILE A 73 109.474 -24.133 -4.424 1.00 0.00 C ATOM 1071 CG2 ILE A 73 108.035 -25.487 -5.971 1.00 0.00 C ATOM 1072 CD1 ILE A 73 110.563 -23.888 -5.481 1.00 0.00 C ATOM 0 H ILE A 73 108.612 -21.132 -5.461 1.00 0.00 H new ATOM 0 HA ILE A 73 108.419 -22.958 -6.734 1.00 0.00 H new ATOM 0 HB ILE A 73 107.335 -24.355 -4.267 1.00 0.00 H new ATOM 0 HG12 ILE A 73 109.476 -23.315 -3.703 1.00 0.00 H new ATOM 0 HG13 ILE A 73 109.702 -25.045 -3.872 1.00 0.00 H new ATOM 0 HG21 ILE A 73 108.272 -26.377 -5.388 1.00 0.00 H new ATOM 0 HG22 ILE A 73 107.039 -25.590 -6.401 1.00 0.00 H new ATOM 0 HG23 ILE A 73 108.766 -25.373 -6.771 1.00 0.00 H new ATOM 0 HD11 ILE A 73 111.534 -23.809 -4.992 1.00 0.00 H new ATOM 0 HD12 ILE A 73 110.579 -24.719 -6.187 1.00 0.00 H new ATOM 0 HD13 ILE A 73 110.350 -22.962 -6.015 1.00 0.00 H new ATOM 1084 N ASN A 74 105.858 -21.946 -6.979 1.00 0.00 N ATOM 1085 CA ASN A 74 104.527 -21.882 -7.570 1.00 0.00 C ATOM 1086 C ASN A 74 104.563 -22.474 -8.976 1.00 0.00 C ATOM 1087 O ASN A 74 105.623 -22.877 -9.455 1.00 0.00 O ATOM 1088 CB ASN A 74 104.058 -20.426 -7.629 1.00 0.00 C ATOM 1089 CG ASN A 74 102.537 -20.364 -7.723 1.00 0.00 C ATOM 1090 OD1 ASN A 74 101.839 -20.795 -6.806 1.00 0.00 O ATOM 1091 ND2 ASN A 74 101.979 -19.852 -8.786 1.00 0.00 N ATOM 0 H ASN A 74 106.397 -21.083 -7.056 1.00 0.00 H new ATOM 0 HA ASN A 74 103.831 -22.455 -6.958 1.00 0.00 H new ATOM 0 HB2 ASN A 74 104.397 -19.891 -6.741 1.00 0.00 H new ATOM 0 HB3 ASN A 74 104.503 -19.928 -8.490 1.00 0.00 H new ATOM 0 HD21 ASN A 74 100.962 -19.809 -8.858 1.00 0.00 H new ATOM 0 HD22 ASN A 74 102.559 -19.495 -9.545 1.00 0.00 H new ATOM 1098 N ASP A 75 103.410 -22.527 -9.639 1.00 0.00 N ATOM 1099 CA ASP A 75 103.343 -23.047 -11.003 1.00 0.00 C ATOM 1100 C ASP A 75 104.342 -22.333 -11.915 1.00 0.00 C ATOM 1101 O ASP A 75 104.949 -22.951 -12.789 1.00 0.00 O ATOM 1102 CB ASP A 75 101.929 -22.870 -11.559 1.00 0.00 C ATOM 1103 CG ASP A 75 101.804 -23.578 -12.904 1.00 0.00 C ATOM 1104 OD1 ASP A 75 101.562 -24.774 -12.901 1.00 0.00 O ATOM 1105 OD2 ASP A 75 101.953 -22.913 -13.916 1.00 0.00 O ATOM 0 H ASP A 75 102.516 -22.219 -9.258 1.00 0.00 H new ATOM 0 HA ASP A 75 103.597 -24.106 -10.973 1.00 0.00 H new ATOM 0 HB2 ASP A 75 101.200 -23.275 -10.857 1.00 0.00 H new ATOM 0 HB3 ASP A 75 101.705 -21.810 -11.675 1.00 0.00 H new ATOM 1110 N TRP A 76 104.503 -21.029 -11.705 1.00 0.00 N ATOM 1111 CA TRP A 76 105.477 -20.253 -12.466 1.00 0.00 C ATOM 1112 C TRP A 76 106.258 -19.322 -11.542 1.00 0.00 C ATOM 1113 O TRP A 76 105.729 -18.316 -11.070 1.00 0.00 O ATOM 1114 CB TRP A 76 104.766 -19.429 -13.541 1.00 0.00 C ATOM 1115 CG TRP A 76 105.706 -18.699 -14.447 1.00 0.00 C ATOM 1116 CD1 TRP A 76 105.919 -17.364 -14.433 1.00 0.00 C ATOM 1117 CD2 TRP A 76 106.562 -19.239 -15.497 1.00 0.00 C ATOM 1118 NE1 TRP A 76 106.849 -17.047 -15.405 1.00 0.00 N ATOM 1119 CE2 TRP A 76 107.276 -18.169 -16.088 1.00 0.00 C ATOM 1120 CE3 TRP A 76 106.786 -20.537 -15.987 1.00 0.00 C ATOM 1121 CZ2 TRP A 76 108.181 -18.382 -17.131 1.00 0.00 C ATOM 1122 CZ3 TRP A 76 107.694 -20.755 -17.034 1.00 0.00 C ATOM 1123 CH2 TRP A 76 108.390 -19.681 -17.606 1.00 0.00 C ATOM 0 H TRP A 76 103.975 -20.490 -11.018 1.00 0.00 H new ATOM 0 HA TRP A 76 106.173 -20.944 -12.941 1.00 0.00 H new ATOM 0 HB2 TRP A 76 104.137 -20.089 -14.138 1.00 0.00 H new ATOM 0 HB3 TRP A 76 104.105 -18.709 -13.059 1.00 0.00 H new ATOM 0 HD1 TRP A 76 105.440 -16.659 -13.770 1.00 0.00 H new ATOM 0 HE1 TRP A 76 107.179 -16.101 -15.595 1.00 0.00 H new ATOM 0 HE3 TRP A 76 106.255 -21.372 -15.555 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 108.715 -17.550 -17.567 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 107.858 -21.757 -17.402 1.00 0.00 H new ATOM 0 HH2 TRP A 76 109.087 -19.856 -18.412 1.00 0.00 H new ATOM 1134 N ALA A 77 107.518 -19.666 -11.287 1.00 0.00 N ATOM 1135 CA ALA A 77 108.379 -18.840 -10.442 1.00 0.00 C ATOM 1136 C ALA A 77 107.721 -18.548 -9.093 1.00 0.00 C ATOM 1137 O ALA A 77 106.667 -19.099 -8.774 1.00 0.00 O ATOM 1138 CB ALA A 77 108.694 -17.528 -11.164 1.00 0.00 C ATOM 0 H ALA A 77 107.965 -20.507 -11.651 1.00 0.00 H new ATOM 0 HA ALA A 77 109.302 -19.388 -10.252 1.00 0.00 H new ATOM 0 HB1 ALA A 77 109.336 -16.911 -10.535 1.00 0.00 H new ATOM 0 HB2 ALA A 77 109.204 -17.743 -12.103 1.00 0.00 H new ATOM 0 HB3 ALA A 77 107.766 -16.994 -11.369 1.00 0.00 H new ATOM 1144 N SER A 78 108.349 -17.677 -8.305 1.00 0.00 N ATOM 1145 CA SER A 78 107.812 -17.296 -7.002 1.00 0.00 C ATOM 1146 C SER A 78 107.344 -15.846 -7.048 1.00 0.00 C ATOM 1147 O SER A 78 107.878 -15.047 -7.816 1.00 0.00 O ATOM 1148 CB SER A 78 108.886 -17.457 -5.924 1.00 0.00 C ATOM 1149 OG SER A 78 109.322 -18.810 -5.900 1.00 0.00 O ATOM 0 H SER A 78 109.230 -17.223 -8.547 1.00 0.00 H new ATOM 0 HA SER A 78 106.969 -17.943 -6.761 1.00 0.00 H new ATOM 0 HB2 SER A 78 109.727 -16.795 -6.129 1.00 0.00 H new ATOM 0 HB3 SER A 78 108.487 -17.173 -4.950 1.00 0.00 H new ATOM 0 HG SER A 78 110.012 -18.919 -5.212 1.00 0.00 H new ATOM 1155 N ILE A 79 106.345 -15.507 -6.236 1.00 0.00 N ATOM 1156 CA ILE A 79 105.756 -14.171 -6.298 1.00 0.00 C ATOM 1157 C ILE A 79 105.509 -13.636 -4.895 1.00 0.00 C ATOM 1158 O ILE A 79 105.297 -14.409 -3.964 1.00 0.00 O ATOM 1159 CB ILE A 79 104.447 -14.223 -7.099 1.00 0.00 C ATOM 1160 CG1 ILE A 79 103.865 -12.812 -7.234 1.00 0.00 C ATOM 1161 CG2 ILE A 79 103.431 -15.132 -6.401 1.00 0.00 C ATOM 1162 CD1 ILE A 79 102.791 -12.804 -8.323 1.00 0.00 C ATOM 0 H ILE A 79 105.932 -16.126 -5.539 1.00 0.00 H new ATOM 0 HA ILE A 79 106.449 -13.495 -6.799 1.00 0.00 H new ATOM 0 HB ILE A 79 104.659 -14.625 -8.090 1.00 0.00 H new ATOM 0 HG12 ILE A 79 103.437 -12.491 -6.284 1.00 0.00 H new ATOM 0 HG13 ILE A 79 104.655 -12.104 -7.483 1.00 0.00 H new ATOM 0 HG21 ILE A 79 102.508 -15.159 -6.981 1.00 0.00 H new ATOM 0 HG22 ILE A 79 103.839 -16.140 -6.321 1.00 0.00 H new ATOM 0 HG23 ILE A 79 103.222 -14.745 -5.404 1.00 0.00 H new ATOM 0 HD11 ILE A 79 102.377 -11.800 -8.419 1.00 0.00 H new ATOM 0 HD12 ILE A 79 103.233 -13.106 -9.272 1.00 0.00 H new ATOM 0 HD13 ILE A 79 101.996 -13.500 -8.055 1.00 0.00 H new ATOM 1174 N TYR A 80 105.539 -12.316 -4.749 1.00 0.00 N ATOM 1175 CA TYR A 80 105.269 -11.706 -3.455 1.00 0.00 C ATOM 1176 C TYR A 80 104.578 -10.358 -3.621 1.00 0.00 C ATOM 1177 O TYR A 80 104.733 -9.696 -4.646 1.00 0.00 O ATOM 1178 CB TYR A 80 106.584 -11.544 -2.683 1.00 0.00 C ATOM 1179 CG TYR A 80 107.520 -10.504 -3.257 1.00 0.00 C ATOM 1180 CD1 TYR A 80 107.440 -9.174 -2.825 1.00 0.00 C ATOM 1181 CD2 TYR A 80 108.469 -10.871 -4.218 1.00 0.00 C ATOM 1182 CE1 TYR A 80 108.308 -8.213 -3.355 1.00 0.00 C ATOM 1183 CE2 TYR A 80 109.337 -9.909 -4.749 1.00 0.00 C ATOM 1184 CZ TYR A 80 109.257 -8.580 -4.316 1.00 0.00 C ATOM 1185 OH TYR A 80 110.114 -7.632 -4.839 1.00 0.00 O ATOM 0 H TYR A 80 105.745 -11.657 -5.500 1.00 0.00 H new ATOM 0 HA TYR A 80 104.598 -12.356 -2.893 1.00 0.00 H new ATOM 0 HB2 TYR A 80 106.355 -11.279 -1.651 1.00 0.00 H new ATOM 0 HB3 TYR A 80 107.098 -12.505 -2.659 1.00 0.00 H new ATOM 0 HD1 TYR A 80 106.708 -8.890 -2.083 1.00 0.00 H new ATOM 0 HD2 TYR A 80 108.532 -11.897 -4.550 1.00 0.00 H new ATOM 0 HE1 TYR A 80 108.246 -7.187 -3.022 1.00 0.00 H new ATOM 0 HE2 TYR A 80 110.068 -10.192 -5.492 1.00 0.00 H new ATOM 0 HH TYR A 80 110.710 -8.055 -5.493 1.00 0.00 H new ATOM 1195 N GLY A 81 103.836 -9.953 -2.599 1.00 0.00 N ATOM 1196 CA GLY A 81 103.225 -8.628 -2.591 1.00 0.00 C ATOM 1197 C GLY A 81 103.342 -8.030 -1.197 1.00 0.00 C ATOM 1198 O GLY A 81 103.254 -8.758 -0.212 1.00 0.00 O ATOM 0 H GLY A 81 103.643 -10.516 -1.771 1.00 0.00 H new ATOM 0 HA2 GLY A 81 103.718 -7.983 -3.319 1.00 0.00 H new ATOM 0 HA3 GLY A 81 102.177 -8.696 -2.883 1.00 0.00 H new ATOM 1202 N VAL A 82 103.516 -6.713 -1.112 1.00 0.00 N ATOM 1203 CA VAL A 82 103.773 -6.080 0.177 1.00 0.00 C ATOM 1204 C VAL A 82 103.051 -4.745 0.300 1.00 0.00 C ATOM 1205 O VAL A 82 102.713 -4.115 -0.703 1.00 0.00 O ATOM 1206 CB VAL A 82 105.278 -5.867 0.358 1.00 0.00 C ATOM 1207 CG1 VAL A 82 105.990 -7.220 0.335 1.00 0.00 C ATOM 1208 CG2 VAL A 82 105.816 -4.994 -0.780 1.00 0.00 C ATOM 0 H VAL A 82 103.484 -6.074 -1.906 1.00 0.00 H new ATOM 0 HA VAL A 82 103.394 -6.742 0.956 1.00 0.00 H new ATOM 0 HB VAL A 82 105.459 -5.372 1.312 1.00 0.00 H new ATOM 0 HG11 VAL A 82 107.062 -7.069 0.464 1.00 0.00 H new ATOM 0 HG12 VAL A 82 105.611 -7.844 1.144 1.00 0.00 H new ATOM 0 HG13 VAL A 82 105.805 -7.712 -0.620 1.00 0.00 H new ATOM 0 HG21 VAL A 82 106.888 -4.844 -0.648 1.00 0.00 H new ATOM 0 HG22 VAL A 82 105.633 -5.487 -1.735 1.00 0.00 H new ATOM 0 HG23 VAL A 82 105.311 -4.028 -0.768 1.00 0.00 H new ATOM 1218 N VAL A 83 102.830 -4.330 1.542 1.00 0.00 N ATOM 1219 CA VAL A 83 102.298 -3.003 1.826 1.00 0.00 C ATOM 1220 C VAL A 83 103.188 -2.356 2.878 1.00 0.00 C ATOM 1221 O VAL A 83 103.828 -3.071 3.649 1.00 0.00 O ATOM 1222 CB VAL A 83 100.862 -3.095 2.353 1.00 0.00 C ATOM 1223 CG1 VAL A 83 100.300 -1.684 2.530 1.00 0.00 C ATOM 1224 CG2 VAL A 83 99.988 -3.884 1.368 1.00 0.00 C ATOM 0 H VAL A 83 103.012 -4.896 2.371 1.00 0.00 H new ATOM 0 HA VAL A 83 102.284 -2.410 0.912 1.00 0.00 H new ATOM 0 HB VAL A 83 100.862 -3.612 3.312 1.00 0.00 H new ATOM 0 HG11 VAL A 83 99.278 -1.744 2.905 1.00 0.00 H new ATOM 0 HG12 VAL A 83 100.916 -1.134 3.241 1.00 0.00 H new ATOM 0 HG13 VAL A 83 100.305 -1.167 1.570 1.00 0.00 H new ATOM 0 HG21 VAL A 83 98.970 -3.943 1.752 1.00 0.00 H new ATOM 0 HG22 VAL A 83 99.983 -3.380 0.402 1.00 0.00 H new ATOM 0 HG23 VAL A 83 100.390 -4.890 1.250 1.00 0.00 H new ATOM 1234 N GLY A 84 103.245 -1.026 2.908 1.00 0.00 N ATOM 1235 CA GLY A 84 104.092 -0.352 3.885 1.00 0.00 C ATOM 1236 C GLY A 84 103.736 1.117 4.040 1.00 0.00 C ATOM 1237 O GLY A 84 102.853 1.633 3.356 1.00 0.00 O ATOM 0 H GLY A 84 102.728 -0.408 2.283 1.00 0.00 H new ATOM 0 HA2 GLY A 84 103.997 -0.850 4.850 1.00 0.00 H new ATOM 0 HA3 GLY A 84 105.135 -0.441 3.581 1.00 0.00 H new ATOM 1241 N VAL A 85 104.467 1.786 4.925 1.00 0.00 N ATOM 1242 CA VAL A 85 104.226 3.195 5.201 1.00 0.00 C ATOM 1243 C VAL A 85 105.560 3.919 5.293 1.00 0.00 C ATOM 1244 O VAL A 85 106.540 3.355 5.778 1.00 0.00 O ATOM 1245 CB VAL A 85 103.450 3.353 6.512 1.00 0.00 C ATOM 1246 CG1 VAL A 85 102.082 2.682 6.378 1.00 0.00 C ATOM 1247 CG2 VAL A 85 104.225 2.695 7.657 1.00 0.00 C ATOM 0 H VAL A 85 105.230 1.375 5.462 1.00 0.00 H new ATOM 0 HA VAL A 85 103.632 3.626 4.395 1.00 0.00 H new ATOM 0 HB VAL A 85 103.321 4.414 6.726 1.00 0.00 H new ATOM 0 HG11 VAL A 85 101.529 2.794 7.311 1.00 0.00 H new ATOM 0 HG12 VAL A 85 101.525 3.151 5.567 1.00 0.00 H new ATOM 0 HG13 VAL A 85 102.216 1.622 6.161 1.00 0.00 H new ATOM 0 HG21 VAL A 85 103.668 2.811 8.587 1.00 0.00 H new ATOM 0 HG22 VAL A 85 104.359 1.635 7.444 1.00 0.00 H new ATOM 0 HG23 VAL A 85 105.201 3.171 7.757 1.00 0.00 H new ATOM 1257 N GLY A 86 105.606 5.156 4.808 1.00 0.00 N ATOM 1258 CA GLY A 86 106.849 5.922 4.826 1.00 0.00 C ATOM 1259 C GLY A 86 106.630 7.335 5.346 1.00 0.00 C ATOM 1260 O GLY A 86 105.536 7.886 5.227 1.00 0.00 O ATOM 0 H GLY A 86 104.808 5.645 4.402 1.00 0.00 H new ATOM 0 HA2 GLY A 86 107.581 5.413 5.452 1.00 0.00 H new ATOM 0 HA3 GLY A 86 107.265 5.965 3.819 1.00 0.00 H new ATOM 1264 N TYR A 87 107.690 7.911 5.906 1.00 0.00 N ATOM 1265 CA TYR A 87 107.642 9.264 6.446 1.00 0.00 C ATOM 1266 C TYR A 87 108.785 10.083 5.860 1.00 0.00 C ATOM 1267 O TYR A 87 109.862 9.547 5.605 1.00 0.00 O ATOM 1268 CB TYR A 87 107.764 9.225 7.970 1.00 0.00 C ATOM 1269 CG TYR A 87 106.690 8.400 8.639 1.00 0.00 C ATOM 1270 CD1 TYR A 87 105.442 8.969 8.917 1.00 0.00 C ATOM 1271 CD2 TYR A 87 106.943 7.066 8.981 1.00 0.00 C ATOM 1272 CE1 TYR A 87 104.446 8.204 9.537 1.00 0.00 C ATOM 1273 CE2 TYR A 87 105.948 6.301 9.601 1.00 0.00 C ATOM 1274 CZ TYR A 87 104.699 6.871 9.878 1.00 0.00 C ATOM 1275 OH TYR A 87 103.718 6.116 10.489 1.00 0.00 O ATOM 0 H TYR A 87 108.599 7.457 5.997 1.00 0.00 H new ATOM 0 HA TYR A 87 106.690 9.723 6.180 1.00 0.00 H new ATOM 0 HB2 TYR A 87 108.741 8.822 8.238 1.00 0.00 H new ATOM 0 HB3 TYR A 87 107.722 10.243 8.356 1.00 0.00 H new ATOM 0 HD1 TYR A 87 105.247 9.998 8.653 1.00 0.00 H new ATOM 0 HD2 TYR A 87 107.906 6.627 8.766 1.00 0.00 H new ATOM 0 HE1 TYR A 87 103.483 8.643 9.752 1.00 0.00 H new ATOM 0 HE2 TYR A 87 106.143 5.272 9.865 1.00 0.00 H new ATOM 0 HH TYR A 87 104.058 5.212 10.657 1.00 0.00 H new ATOM 1285 N GLY A 88 108.548 11.372 5.636 1.00 0.00 N ATOM 1286 CA GLY A 88 109.580 12.235 5.075 1.00 0.00 C ATOM 1287 C GLY A 88 109.540 13.633 5.681 1.00 0.00 C ATOM 1288 O GLY A 88 108.506 14.081 6.184 1.00 0.00 O ATOM 0 H GLY A 88 107.661 11.837 5.832 1.00 0.00 H new ATOM 0 HA2 GLY A 88 110.560 11.791 5.250 1.00 0.00 H new ATOM 0 HA3 GLY A 88 109.449 12.303 3.995 1.00 0.00 H new ATOM 1292 N LYS A 89 110.684 14.309 5.622 1.00 0.00 N ATOM 1293 CA LYS A 89 110.791 15.679 6.101 1.00 0.00 C ATOM 1294 C LYS A 89 111.666 16.501 5.156 1.00 0.00 C ATOM 1295 O LYS A 89 112.667 15.999 4.643 1.00 0.00 O ATOM 1296 CB LYS A 89 111.344 15.691 7.535 1.00 0.00 C ATOM 1297 CG LYS A 89 112.804 15.219 7.569 1.00 0.00 C ATOM 1298 CD LYS A 89 113.276 15.123 9.022 1.00 0.00 C ATOM 1299 CE LYS A 89 114.797 14.963 9.056 1.00 0.00 C ATOM 1300 NZ LYS A 89 115.173 13.656 8.448 1.00 0.00 N ATOM 0 H LYS A 89 111.551 13.927 5.245 1.00 0.00 H new ATOM 0 HA LYS A 89 109.801 16.135 6.118 1.00 0.00 H new ATOM 0 HB2 LYS A 89 111.275 16.698 7.946 1.00 0.00 H new ATOM 0 HB3 LYS A 89 110.735 15.046 8.168 1.00 0.00 H new ATOM 0 HG2 LYS A 89 112.895 14.249 7.081 1.00 0.00 H new ATOM 0 HG3 LYS A 89 113.435 15.914 7.016 1.00 0.00 H new ATOM 0 HD2 LYS A 89 112.982 16.018 9.571 1.00 0.00 H new ATOM 0 HD3 LYS A 89 112.800 14.276 9.515 1.00 0.00 H new ATOM 0 HE2 LYS A 89 115.271 15.779 8.511 1.00 0.00 H new ATOM 0 HE3 LYS A 89 115.156 15.015 10.084 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 115.819 13.149 9.086 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 114.317 13.085 8.297 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 115.645 13.820 7.536 1.00 0.00 H new ATOM 1314 N PHE A 90 111.276 17.751 4.923 1.00 0.00 N ATOM 1315 CA PHE A 90 112.020 18.616 4.015 1.00 0.00 C ATOM 1316 C PHE A 90 112.031 20.055 4.519 1.00 0.00 C ATOM 1317 O PHE A 90 111.149 20.463 5.276 1.00 0.00 O ATOM 1318 CB PHE A 90 111.390 18.569 2.622 1.00 0.00 C ATOM 1319 CG PHE A 90 109.974 19.091 2.586 1.00 0.00 C ATOM 1320 CD1 PHE A 90 108.900 18.216 2.796 1.00 0.00 C ATOM 1321 CD2 PHE A 90 109.732 20.448 2.343 1.00 0.00 C ATOM 1322 CE1 PHE A 90 107.587 18.699 2.762 1.00 0.00 C ATOM 1323 CE2 PHE A 90 108.419 20.931 2.309 1.00 0.00 C ATOM 1324 CZ PHE A 90 107.346 20.056 2.519 1.00 0.00 C ATOM 0 H PHE A 90 110.456 18.184 5.347 1.00 0.00 H new ATOM 0 HA PHE A 90 113.048 18.257 3.967 1.00 0.00 H new ATOM 0 HB2 PHE A 90 112.002 19.153 1.935 1.00 0.00 H new ATOM 0 HB3 PHE A 90 111.399 17.540 2.262 1.00 0.00 H new ATOM 0 HD1 PHE A 90 109.085 17.169 2.984 1.00 0.00 H new ATOM 0 HD2 PHE A 90 110.559 21.123 2.182 1.00 0.00 H new ATOM 0 HE1 PHE A 90 106.759 18.024 2.923 1.00 0.00 H new ATOM 0 HE2 PHE A 90 108.233 21.978 2.121 1.00 0.00 H new ATOM 0 HZ PHE A 90 106.333 20.428 2.493 1.00 0.00 H new ATOM 1334 N GLN A 91 113.034 20.819 4.096 1.00 0.00 N ATOM 1335 CA GLN A 91 113.134 22.224 4.479 1.00 0.00 C ATOM 1336 C GLN A 91 112.771 23.123 3.302 1.00 0.00 C ATOM 1337 O GLN A 91 113.319 22.981 2.208 1.00 0.00 O ATOM 1338 CB GLN A 91 114.561 22.539 4.942 1.00 0.00 C ATOM 1339 CG GLN A 91 114.968 21.614 6.095 1.00 0.00 C ATOM 1340 CD GLN A 91 114.014 21.766 7.278 1.00 0.00 C ATOM 1341 OE1 GLN A 91 113.728 22.884 7.706 1.00 0.00 O ATOM 1342 NE2 GLN A 91 113.505 20.702 7.835 1.00 0.00 N ATOM 0 H GLN A 91 113.786 20.491 3.490 1.00 0.00 H new ATOM 0 HA GLN A 91 112.437 22.411 5.296 1.00 0.00 H new ATOM 0 HB2 GLN A 91 115.254 22.419 4.110 1.00 0.00 H new ATOM 0 HB3 GLN A 91 114.624 23.579 5.262 1.00 0.00 H new ATOM 0 HG2 GLN A 91 114.968 20.579 5.753 1.00 0.00 H new ATOM 0 HG3 GLN A 91 115.985 21.846 6.411 1.00 0.00 H new ATOM 0 HE21 GLN A 91 113.743 19.776 7.479 1.00 0.00 H new ATOM 0 HE22 GLN A 91 112.869 20.796 8.627 1.00 0.00 H new ATOM 1351 N THR A 92 111.845 24.049 3.533 1.00 0.00 N ATOM 1352 CA THR A 92 111.408 24.961 2.482 1.00 0.00 C ATOM 1353 C THR A 92 111.089 26.339 3.058 1.00 0.00 C ATOM 1354 O THR A 92 111.042 26.516 4.275 1.00 0.00 O ATOM 1355 CB THR A 92 110.182 24.382 1.765 1.00 0.00 C ATOM 1356 OG1 THR A 92 109.818 25.235 0.689 1.00 0.00 O ATOM 1357 CG2 THR A 92 109.007 24.244 2.738 1.00 0.00 C ATOM 0 H THR A 92 111.385 24.187 4.433 1.00 0.00 H new ATOM 0 HA THR A 92 112.218 25.076 1.762 1.00 0.00 H new ATOM 0 HB THR A 92 110.431 23.393 1.380 1.00 0.00 H new ATOM 0 HG1 THR A 92 109.036 24.865 0.229 1.00 0.00 H new ATOM 0 HG21 THR A 92 108.146 23.832 2.212 1.00 0.00 H new ATOM 0 HG22 THR A 92 109.287 23.578 3.554 1.00 0.00 H new ATOM 0 HG23 THR A 92 108.751 25.224 3.141 1.00 0.00 H new ATOM 1365 N THR A 93 110.869 27.312 2.178 1.00 0.00 N ATOM 1366 CA THR A 93 110.493 28.651 2.617 1.00 0.00 C ATOM 1367 C THR A 93 108.983 28.826 2.501 1.00 0.00 C ATOM 1368 O THR A 93 108.405 28.619 1.435 1.00 0.00 O ATOM 1369 CB THR A 93 111.202 29.703 1.761 1.00 0.00 C ATOM 1370 OG1 THR A 93 112.602 29.467 1.788 1.00 0.00 O ATOM 1371 CG2 THR A 93 110.906 31.098 2.315 1.00 0.00 C ATOM 0 H THR A 93 110.944 27.200 1.167 1.00 0.00 H new ATOM 0 HA THR A 93 110.792 28.780 3.657 1.00 0.00 H new ATOM 0 HB THR A 93 110.843 29.639 0.734 1.00 0.00 H new ATOM 0 HG1 THR A 93 113.058 30.139 1.239 1.00 0.00 H new ATOM 0 HG21 THR A 93 111.411 31.847 1.705 1.00 0.00 H new ATOM 0 HG22 THR A 93 109.831 31.278 2.293 1.00 0.00 H new ATOM 0 HG23 THR A 93 111.264 31.165 3.342 1.00 0.00 H new ATOM 1379 N GLU A 94 108.356 29.222 3.605 1.00 0.00 N ATOM 1380 CA GLU A 94 106.900 29.287 3.668 1.00 0.00 C ATOM 1381 C GLU A 94 106.459 29.803 5.034 1.00 0.00 C ATOM 1382 O GLU A 94 107.139 29.575 6.036 1.00 0.00 O ATOM 1383 CB GLU A 94 106.308 27.895 3.428 1.00 0.00 C ATOM 1384 CG GLU A 94 104.784 27.987 3.277 1.00 0.00 C ATOM 1385 CD GLU A 94 104.142 26.605 3.111 1.00 0.00 C ATOM 1386 OE1 GLU A 94 104.848 25.605 3.141 1.00 0.00 O ATOM 1387 OE2 GLU A 94 102.933 26.565 2.952 1.00 0.00 O ATOM 0 H GLU A 94 108.831 29.501 4.464 1.00 0.00 H new ATOM 0 HA GLU A 94 106.542 29.969 2.897 1.00 0.00 H new ATOM 0 HB2 GLU A 94 106.744 27.456 2.531 1.00 0.00 H new ATOM 0 HB3 GLU A 94 106.559 27.236 4.259 1.00 0.00 H new ATOM 0 HG2 GLU A 94 104.362 28.481 4.152 1.00 0.00 H new ATOM 0 HG3 GLU A 94 104.541 28.606 2.413 1.00 0.00 H new ATOM 1394 N TYR A 95 105.325 30.498 5.074 1.00 0.00 N ATOM 1395 CA TYR A 95 104.795 30.988 6.341 1.00 0.00 C ATOM 1396 C TYR A 95 104.063 29.845 7.045 1.00 0.00 C ATOM 1397 O TYR A 95 103.471 28.999 6.372 1.00 0.00 O ATOM 1398 CB TYR A 95 103.831 32.150 6.098 1.00 0.00 C ATOM 1399 CG TYR A 95 102.672 31.794 5.198 1.00 0.00 C ATOM 1400 CD1 TYR A 95 101.526 31.197 5.736 1.00 0.00 C ATOM 1401 CD2 TYR A 95 102.744 32.060 3.825 1.00 0.00 C ATOM 1402 CE1 TYR A 95 100.451 30.867 4.901 1.00 0.00 C ATOM 1403 CE2 TYR A 95 101.669 31.729 2.991 1.00 0.00 C ATOM 1404 CZ TYR A 95 100.523 31.132 3.529 1.00 0.00 C ATOM 1405 OH TYR A 95 99.464 30.806 2.705 1.00 0.00 O ATOM 0 H TYR A 95 104.763 30.732 4.256 1.00 0.00 H new ATOM 0 HA TYR A 95 105.615 31.344 6.965 1.00 0.00 H new ATOM 0 HB2 TYR A 95 103.443 32.496 7.056 1.00 0.00 H new ATOM 0 HB3 TYR A 95 104.381 32.982 5.657 1.00 0.00 H new ATOM 0 HD1 TYR A 95 101.471 30.991 6.795 1.00 0.00 H new ATOM 0 HD2 TYR A 95 103.628 32.520 3.410 1.00 0.00 H new ATOM 0 HE1 TYR A 95 99.566 30.408 5.316 1.00 0.00 H new ATOM 0 HE2 TYR A 95 101.724 31.934 1.932 1.00 0.00 H new ATOM 0 HH TYR A 95 99.678 31.058 1.782 1.00 0.00 H new ATOM 1415 N PRO A 96 104.075 29.791 8.360 1.00 0.00 N ATOM 1416 CA PRO A 96 103.611 28.565 9.079 1.00 0.00 C ATOM 1417 C PRO A 96 102.190 28.158 8.696 1.00 0.00 C ATOM 1418 O PRO A 96 101.284 28.987 8.625 1.00 0.00 O ATOM 1419 CB PRO A 96 103.683 28.938 10.565 1.00 0.00 C ATOM 1420 CG PRO A 96 104.593 30.115 10.648 1.00 0.00 C ATOM 1421 CD PRO A 96 104.494 30.841 9.309 1.00 0.00 C ATOM 0 HA PRO A 96 104.230 27.705 8.823 1.00 0.00 H new ATOM 0 HB2 PRO A 96 102.694 29.181 10.955 1.00 0.00 H new ATOM 0 HB3 PRO A 96 104.065 28.107 11.158 1.00 0.00 H new ATOM 0 HG2 PRO A 96 104.302 30.772 11.467 1.00 0.00 H new ATOM 0 HG3 PRO A 96 105.618 29.799 10.842 1.00 0.00 H new ATOM 0 HD2 PRO A 96 103.769 31.654 9.349 1.00 0.00 H new ATOM 0 HD3 PRO A 96 105.450 31.280 9.022 1.00 0.00 H new ATOM 1429 N THR A 97 102.021 26.862 8.451 1.00 0.00 N ATOM 1430 CA THR A 97 100.711 26.284 8.176 1.00 0.00 C ATOM 1431 C THR A 97 100.372 25.253 9.246 1.00 0.00 C ATOM 1432 O THR A 97 101.271 24.718 9.898 1.00 0.00 O ATOM 1433 CB THR A 97 100.700 25.615 6.798 1.00 0.00 C ATOM 1434 OG1 THR A 97 101.614 24.527 6.795 1.00 0.00 O ATOM 1435 CG2 THR A 97 101.104 26.628 5.724 1.00 0.00 C ATOM 0 H THR A 97 102.785 26.186 8.438 1.00 0.00 H new ATOM 0 HA THR A 97 99.967 27.081 8.186 1.00 0.00 H new ATOM 0 HB THR A 97 99.696 25.249 6.583 1.00 0.00 H new ATOM 0 HG1 THR A 97 101.607 24.096 5.915 1.00 0.00 H new ATOM 0 HG21 THR A 97 101.094 26.146 4.747 1.00 0.00 H new ATOM 0 HG22 THR A 97 100.400 27.460 5.725 1.00 0.00 H new ATOM 0 HG23 THR A 97 102.106 27.001 5.934 1.00 0.00 H new ATOM 1443 N TYR A 98 99.084 24.974 9.432 1.00 0.00 N ATOM 1444 CA TYR A 98 98.676 23.939 10.377 1.00 0.00 C ATOM 1445 C TYR A 98 98.426 22.627 9.640 1.00 0.00 C ATOM 1446 O TYR A 98 97.596 22.560 8.733 1.00 0.00 O ATOM 1447 CB TYR A 98 97.413 24.380 11.123 1.00 0.00 C ATOM 1448 CG TYR A 98 96.187 24.488 10.245 1.00 0.00 C ATOM 1449 CD1 TYR A 98 95.942 25.666 9.528 1.00 0.00 C ATOM 1450 CD2 TYR A 98 95.296 23.413 10.149 1.00 0.00 C ATOM 1451 CE1 TYR A 98 94.808 25.767 8.714 1.00 0.00 C ATOM 1452 CE2 TYR A 98 94.162 23.514 9.335 1.00 0.00 C ATOM 1453 CZ TYR A 98 93.917 24.691 8.618 1.00 0.00 C ATOM 1454 OH TYR A 98 92.798 24.791 7.815 1.00 0.00 O ATOM 0 H TYR A 98 98.317 25.442 8.950 1.00 0.00 H new ATOM 0 HA TYR A 98 99.475 23.785 11.102 1.00 0.00 H new ATOM 0 HB2 TYR A 98 97.211 23.671 11.926 1.00 0.00 H new ATOM 0 HB3 TYR A 98 97.599 25.347 11.591 1.00 0.00 H new ATOM 0 HD1 TYR A 98 96.628 26.497 9.603 1.00 0.00 H new ATOM 0 HD2 TYR A 98 95.484 22.505 10.703 1.00 0.00 H new ATOM 0 HE1 TYR A 98 94.620 26.675 8.160 1.00 0.00 H new ATOM 0 HE2 TYR A 98 93.476 22.684 9.260 1.00 0.00 H new ATOM 0 HH TYR A 98 92.287 23.956 7.861 1.00 0.00 H new ATOM 1464 N LYS A 99 99.156 21.588 10.036 1.00 0.00 N ATOM 1465 CA LYS A 99 99.035 20.278 9.402 1.00 0.00 C ATOM 1466 C LYS A 99 98.471 19.252 10.378 1.00 0.00 C ATOM 1467 O LYS A 99 98.711 19.331 11.583 1.00 0.00 O ATOM 1468 CB LYS A 99 100.406 19.812 8.908 1.00 0.00 C ATOM 1469 CG LYS A 99 100.907 20.765 7.820 1.00 0.00 C ATOM 1470 CD LYS A 99 102.226 20.240 7.250 1.00 0.00 C ATOM 1471 CE LYS A 99 102.790 21.253 6.250 1.00 0.00 C ATOM 1472 NZ LYS A 99 103.905 20.629 5.485 1.00 0.00 N ATOM 0 H LYS A 99 99.838 21.628 10.793 1.00 0.00 H new ATOM 0 HA LYS A 99 98.351 20.369 8.558 1.00 0.00 H new ATOM 0 HB2 LYS A 99 101.113 19.785 9.737 1.00 0.00 H new ATOM 0 HB3 LYS A 99 100.337 18.798 8.515 1.00 0.00 H new ATOM 0 HG2 LYS A 99 100.164 20.851 7.027 1.00 0.00 H new ATOM 0 HG3 LYS A 99 101.049 21.764 8.233 1.00 0.00 H new ATOM 0 HD2 LYS A 99 102.941 20.072 8.055 1.00 0.00 H new ATOM 0 HD3 LYS A 99 102.066 19.280 6.760 1.00 0.00 H new ATOM 0 HE2 LYS A 99 102.006 21.581 5.568 1.00 0.00 H new ATOM 0 HE3 LYS A 99 103.147 22.139 6.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 104.288 21.317 4.806 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 104.656 20.337 6.142 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 103.551 19.797 4.972 1.00 0.00 H new ATOM 1486 N HIS A 100 97.722 18.289 9.850 1.00 0.00 N ATOM 1487 CA HIS A 100 97.206 17.201 10.674 1.00 0.00 C ATOM 1488 C HIS A 100 98.348 16.466 11.376 1.00 0.00 C ATOM 1489 O HIS A 100 98.221 16.069 12.535 1.00 0.00 O ATOM 1490 CB HIS A 100 96.421 16.217 9.805 1.00 0.00 C ATOM 1491 CG HIS A 100 95.229 16.837 9.129 1.00 0.00 C ATOM 1492 ND1 HIS A 100 94.104 17.235 9.834 1.00 0.00 N ATOM 1493 CD2 HIS A 100 94.971 17.134 7.813 1.00 0.00 C ATOM 1494 CE1 HIS A 100 93.230 17.746 8.948 1.00 0.00 C ATOM 1495 NE2 HIS A 100 93.707 17.708 7.701 1.00 0.00 N ATOM 0 H HIS A 100 97.461 18.239 8.865 1.00 0.00 H new ATOM 0 HA HIS A 100 96.546 17.626 11.431 1.00 0.00 H new ATOM 0 HB2 HIS A 100 97.085 15.804 9.046 1.00 0.00 H new ATOM 0 HB3 HIS A 100 96.086 15.384 10.424 1.00 0.00 H new ATOM 0 HD2 HIS A 100 95.646 16.950 6.990 1.00 0.00 H new ATOM 0 HE1 HIS A 100 92.260 18.139 9.213 1.00 0.00 H new ATOM 0 HE2 HIS A 100 93.245 18.030 6.850 1.00 0.00 H new ATOM 1503 N ASP A 101 99.462 16.289 10.668 1.00 0.00 N ATOM 1504 CA ASP A 101 100.625 15.608 11.230 1.00 0.00 C ATOM 1505 C ASP A 101 101.893 16.415 10.967 1.00 0.00 C ATOM 1506 O ASP A 101 102.079 16.960 9.879 1.00 0.00 O ATOM 1507 CB ASP A 101 100.766 14.216 10.607 1.00 0.00 C ATOM 1508 CG ASP A 101 101.890 13.449 11.294 1.00 0.00 C ATOM 1509 OD1 ASP A 101 101.610 12.770 12.268 1.00 0.00 O ATOM 1510 OD2 ASP A 101 103.016 13.552 10.835 1.00 0.00 O ATOM 0 H ASP A 101 99.583 16.607 9.706 1.00 0.00 H new ATOM 0 HA ASP A 101 100.484 15.512 12.306 1.00 0.00 H new ATOM 0 HB2 ASP A 101 99.829 13.668 10.704 1.00 0.00 H new ATOM 0 HB3 ASP A 101 100.974 14.305 9.541 1.00 0.00 H new ATOM 1515 N THR A 102 102.763 16.484 11.969 1.00 0.00 N ATOM 1516 CA THR A 102 103.999 17.251 11.848 1.00 0.00 C ATOM 1517 C THR A 102 104.829 16.764 10.662 1.00 0.00 C ATOM 1518 O THR A 102 105.430 17.565 9.947 1.00 0.00 O ATOM 1519 CB THR A 102 104.818 17.122 13.134 1.00 0.00 C ATOM 1520 OG1 THR A 102 104.008 17.478 14.245 1.00 0.00 O ATOM 1521 CG2 THR A 102 106.031 18.052 13.068 1.00 0.00 C ATOM 0 H THR A 102 102.637 16.021 12.869 1.00 0.00 H new ATOM 0 HA THR A 102 103.738 18.296 11.683 1.00 0.00 H new ATOM 0 HB THR A 102 105.159 16.093 13.245 1.00 0.00 H new ATOM 0 HG1 THR A 102 104.530 17.395 15.070 1.00 0.00 H new ATOM 0 HG21 THR A 102 106.612 17.958 13.985 1.00 0.00 H new ATOM 0 HG22 THR A 102 106.653 17.779 12.215 1.00 0.00 H new ATOM 0 HG23 THR A 102 105.694 19.082 12.956 1.00 0.00 H new ATOM 1529 N SER A 103 104.861 15.450 10.461 1.00 0.00 N ATOM 1530 CA SER A 103 105.632 14.867 9.366 1.00 0.00 C ATOM 1531 C SER A 103 104.707 14.432 8.235 1.00 0.00 C ATOM 1532 O SER A 103 103.510 14.234 8.443 1.00 0.00 O ATOM 1533 CB SER A 103 106.422 13.660 9.872 1.00 0.00 C ATOM 1534 OG SER A 103 105.517 12.623 10.223 1.00 0.00 O ATOM 0 H SER A 103 104.365 14.771 11.038 1.00 0.00 H new ATOM 0 HA SER A 103 106.322 15.621 8.988 1.00 0.00 H new ATOM 0 HB2 SER A 103 107.111 13.313 9.102 1.00 0.00 H new ATOM 0 HB3 SER A 103 107.025 13.941 10.736 1.00 0.00 H new ATOM 0 HG SER A 103 104.637 13.009 10.417 1.00 0.00 H new ATOM 1540 N ASP A 104 105.266 14.287 7.037 1.00 0.00 N ATOM 1541 CA ASP A 104 104.469 13.892 5.881 1.00 0.00 C ATOM 1542 C ASP A 104 104.569 12.386 5.674 1.00 0.00 C ATOM 1543 O ASP A 104 105.669 11.842 5.629 1.00 0.00 O ATOM 1544 CB ASP A 104 104.968 14.622 4.631 1.00 0.00 C ATOM 1545 CG ASP A 104 104.056 14.316 3.450 1.00 0.00 C ATOM 1546 OD1 ASP A 104 103.035 14.973 3.327 1.00 0.00 O ATOM 1547 OD2 ASP A 104 104.391 13.428 2.685 1.00 0.00 O ATOM 0 H ASP A 104 106.256 14.435 6.843 1.00 0.00 H new ATOM 0 HA ASP A 104 103.427 14.160 6.058 1.00 0.00 H new ATOM 0 HB2 ASP A 104 104.993 15.696 4.813 1.00 0.00 H new ATOM 0 HB3 ASP A 104 105.988 14.314 4.403 1.00 0.00 H new ATOM 1552 N TYR A 105 103.427 11.710 5.563 1.00 0.00 N ATOM 1553 CA TYR A 105 103.421 10.253 5.425 1.00 0.00 C ATOM 1554 C TYR A 105 102.578 9.807 4.233 1.00 0.00 C ATOM 1555 O TYR A 105 101.674 10.517 3.793 1.00 0.00 O ATOM 1556 CB TYR A 105 102.891 9.617 6.715 1.00 0.00 C ATOM 1557 CG TYR A 105 101.421 9.866 6.969 1.00 0.00 C ATOM 1558 CD1 TYR A 105 100.464 8.972 6.475 1.00 0.00 C ATOM 1559 CD2 TYR A 105 101.018 10.992 7.697 1.00 0.00 C ATOM 1560 CE1 TYR A 105 99.103 9.203 6.710 1.00 0.00 C ATOM 1561 CE2 TYR A 105 99.657 11.222 7.933 1.00 0.00 C ATOM 1562 CZ TYR A 105 98.700 10.328 7.439 1.00 0.00 C ATOM 1563 OH TYR A 105 97.359 10.555 7.671 1.00 0.00 O ATOM 0 H TYR A 105 102.503 12.141 5.566 1.00 0.00 H new ATOM 0 HA TYR A 105 104.444 9.923 5.247 1.00 0.00 H new ATOM 0 HB2 TYR A 105 103.064 8.542 6.675 1.00 0.00 H new ATOM 0 HB3 TYR A 105 103.464 10.001 7.559 1.00 0.00 H new ATOM 0 HD1 TYR A 105 100.775 8.104 5.913 1.00 0.00 H new ATOM 0 HD2 TYR A 105 101.756 11.683 8.076 1.00 0.00 H new ATOM 0 HE1 TYR A 105 98.364 8.513 6.329 1.00 0.00 H new ATOM 0 HE2 TYR A 105 99.346 12.089 8.496 1.00 0.00 H new ATOM 0 HH TYR A 105 97.252 11.378 8.193 1.00 0.00 H new ATOM 1573 N GLY A 106 102.890 8.621 3.718 1.00 0.00 N ATOM 1574 CA GLY A 106 102.154 8.068 2.585 1.00 0.00 C ATOM 1575 C GLY A 106 102.141 6.542 2.630 1.00 0.00 C ATOM 1576 O GLY A 106 102.877 5.933 3.406 1.00 0.00 O ATOM 0 H GLY A 106 103.643 8.027 4.065 1.00 0.00 H new ATOM 0 HA2 GLY A 106 101.131 8.444 2.594 1.00 0.00 H new ATOM 0 HA3 GLY A 106 102.609 8.404 1.653 1.00 0.00 H new ATOM 1580 N PHE A 107 101.322 5.937 1.773 1.00 0.00 N ATOM 1581 CA PHE A 107 101.172 4.481 1.749 1.00 0.00 C ATOM 1582 C PHE A 107 101.725 3.909 0.447 1.00 0.00 C ATOM 1583 O PHE A 107 101.636 4.553 -0.597 1.00 0.00 O ATOM 1584 CB PHE A 107 99.696 4.107 1.886 1.00 0.00 C ATOM 1585 CG PHE A 107 99.080 4.558 3.190 1.00 0.00 C ATOM 1586 CD1 PHE A 107 99.201 3.760 4.334 1.00 0.00 C ATOM 1587 CD2 PHE A 107 98.388 5.774 3.255 1.00 0.00 C ATOM 1588 CE1 PHE A 107 98.631 4.178 5.542 1.00 0.00 C ATOM 1589 CE2 PHE A 107 97.818 6.191 4.463 1.00 0.00 C ATOM 1590 CZ PHE A 107 97.940 5.393 5.607 1.00 0.00 C ATOM 0 H PHE A 107 100.752 6.430 1.086 1.00 0.00 H new ATOM 0 HA PHE A 107 101.732 4.061 2.585 1.00 0.00 H new ATOM 0 HB2 PHE A 107 99.139 4.547 1.059 1.00 0.00 H new ATOM 0 HB3 PHE A 107 99.594 3.025 1.800 1.00 0.00 H new ATOM 0 HD1 PHE A 107 99.734 2.822 4.284 1.00 0.00 H new ATOM 0 HD2 PHE A 107 98.294 6.390 2.373 1.00 0.00 H new ATOM 0 HE1 PHE A 107 98.725 3.562 6.424 1.00 0.00 H new ATOM 0 HE2 PHE A 107 97.284 7.128 4.513 1.00 0.00 H new ATOM 0 HZ PHE A 107 97.501 5.715 6.540 1.00 0.00 H new ATOM 1600 N SER A 108 102.282 2.698 0.501 1.00 0.00 N ATOM 1601 CA SER A 108 102.869 2.089 -0.692 1.00 0.00 C ATOM 1602 C SER A 108 102.433 0.632 -0.837 1.00 0.00 C ATOM 1603 O SER A 108 102.329 -0.092 0.151 1.00 0.00 O ATOM 1604 CB SER A 108 104.393 2.161 -0.607 1.00 0.00 C ATOM 1605 OG SER A 108 104.942 2.020 -1.910 1.00 0.00 O ATOM 0 H SER A 108 102.339 2.127 1.345 1.00 0.00 H new ATOM 0 HA SER A 108 102.520 2.640 -1.565 1.00 0.00 H new ATOM 0 HB2 SER A 108 104.700 3.112 -0.171 1.00 0.00 H new ATOM 0 HB3 SER A 108 104.770 1.374 0.046 1.00 0.00 H new ATOM 0 HG SER A 108 104.512 1.267 -2.367 1.00 0.00 H new ATOM 1611 N TYR A 109 102.174 0.223 -2.078 1.00 0.00 N ATOM 1612 CA TYR A 109 101.802 -1.157 -2.379 1.00 0.00 C ATOM 1613 C TYR A 109 102.580 -1.626 -3.606 1.00 0.00 C ATOM 1614 O TYR A 109 102.829 -0.822 -4.504 1.00 0.00 O ATOM 1615 CB TYR A 109 100.303 -1.234 -2.679 1.00 0.00 C ATOM 1616 CG TYR A 109 99.434 -0.589 -1.626 1.00 0.00 C ATOM 1617 CD1 TYR A 109 98.965 -1.341 -0.544 1.00 0.00 C ATOM 1618 CD2 TYR A 109 99.099 0.767 -1.733 1.00 0.00 C ATOM 1619 CE1 TYR A 109 98.161 -0.740 0.432 1.00 0.00 C ATOM 1620 CE2 TYR A 109 98.294 1.368 -0.758 1.00 0.00 C ATOM 1621 CZ TYR A 109 97.825 0.615 0.324 1.00 0.00 C ATOM 1622 OH TYR A 109 97.031 1.207 1.286 1.00 0.00 O ATOM 0 H TYR A 109 102.216 0.832 -2.895 1.00 0.00 H new ATOM 0 HA TYR A 109 102.034 -1.791 -1.523 1.00 0.00 H new ATOM 0 HB2 TYR A 109 100.110 -0.755 -3.639 1.00 0.00 H new ATOM 0 HB3 TYR A 109 100.016 -2.281 -2.781 1.00 0.00 H new ATOM 0 HD1 TYR A 109 99.223 -2.386 -0.461 1.00 0.00 H new ATOM 0 HD2 TYR A 109 99.462 1.349 -2.568 1.00 0.00 H new ATOM 0 HE1 TYR A 109 97.800 -1.321 1.268 1.00 0.00 H new ATOM 0 HE2 TYR A 109 98.035 2.413 -0.841 1.00 0.00 H new ATOM 0 HH TYR A 109 96.894 2.151 1.062 1.00 0.00 H new ATOM 1632 N GLY A 110 102.977 -2.901 -3.648 1.00 0.00 N ATOM 1633 CA GLY A 110 103.679 -3.408 -4.829 1.00 0.00 C ATOM 1634 C GLY A 110 103.818 -4.925 -4.820 1.00 0.00 C ATOM 1635 O GLY A 110 103.454 -5.589 -3.852 1.00 0.00 O ATOM 0 H GLY A 110 102.830 -3.582 -2.903 1.00 0.00 H new ATOM 0 HA2 GLY A 110 103.142 -3.101 -5.726 1.00 0.00 H new ATOM 0 HA3 GLY A 110 104.670 -2.956 -4.880 1.00 0.00 H new ATOM 1639 N ALA A 111 104.365 -5.455 -5.910 1.00 0.00 N ATOM 1640 CA ALA A 111 104.590 -6.890 -6.039 1.00 0.00 C ATOM 1641 C ALA A 111 105.834 -7.146 -6.884 1.00 0.00 C ATOM 1642 O ALA A 111 106.238 -6.292 -7.675 1.00 0.00 O ATOM 1643 CB ALA A 111 103.377 -7.556 -6.691 1.00 0.00 C ATOM 0 H ALA A 111 104.661 -4.909 -6.719 1.00 0.00 H new ATOM 0 HA ALA A 111 104.737 -7.314 -5.046 1.00 0.00 H new ATOM 0 HB1 ALA A 111 103.556 -8.627 -6.783 1.00 0.00 H new ATOM 0 HB2 ALA A 111 102.494 -7.387 -6.075 1.00 0.00 H new ATOM 0 HB3 ALA A 111 103.216 -7.129 -7.681 1.00 0.00 H new ATOM 1649 N GLY A 112 106.435 -8.321 -6.720 1.00 0.00 N ATOM 1650 CA GLY A 112 107.656 -8.643 -7.448 1.00 0.00 C ATOM 1651 C GLY A 112 107.747 -10.133 -7.755 1.00 0.00 C ATOM 1652 O GLY A 112 107.023 -10.941 -7.172 1.00 0.00 O ATOM 0 H GLY A 112 106.101 -9.057 -6.098 1.00 0.00 H new ATOM 0 HA2 GLY A 112 107.686 -8.076 -8.379 1.00 0.00 H new ATOM 0 HA3 GLY A 112 108.522 -8.338 -6.861 1.00 0.00 H new ATOM 1656 N LEU A 113 108.646 -10.481 -8.672 1.00 0.00 N ATOM 1657 CA LEU A 113 108.856 -11.872 -9.060 1.00 0.00 C ATOM 1658 C LEU A 113 110.309 -12.266 -8.822 1.00 0.00 C ATOM 1659 O LEU A 113 111.212 -11.446 -9.000 1.00 0.00 O ATOM 1660 CB LEU A 113 108.512 -12.067 -10.539 1.00 0.00 C ATOM 1661 CG LEU A 113 107.027 -11.761 -10.773 1.00 0.00 C ATOM 1662 CD1 LEU A 113 106.842 -10.259 -11.010 1.00 0.00 C ATOM 1663 CD2 LEU A 113 106.531 -12.531 -12.000 1.00 0.00 C ATOM 0 H LEU A 113 109.243 -9.815 -9.162 1.00 0.00 H new ATOM 0 HA LEU A 113 108.205 -12.503 -8.455 1.00 0.00 H new ATOM 0 HB2 LEU A 113 109.129 -11.412 -11.154 1.00 0.00 H new ATOM 0 HB3 LEU A 113 108.734 -13.091 -10.841 1.00 0.00 H new ATOM 0 HG LEU A 113 106.456 -12.065 -9.896 1.00 0.00 H new ATOM 0 HD11 LEU A 113 105.786 -10.044 -11.176 1.00 0.00 H new ATOM 0 HD12 LEU A 113 107.192 -9.707 -10.138 1.00 0.00 H new ATOM 0 HD13 LEU A 113 107.416 -9.955 -11.885 1.00 0.00 H new ATOM 0 HD21 LEU A 113 105.476 -12.312 -12.165 1.00 0.00 H new ATOM 0 HD22 LEU A 113 107.105 -12.229 -12.876 1.00 0.00 H new ATOM 0 HD23 LEU A 113 106.658 -13.601 -11.834 1.00 0.00 H new ATOM 1675 N GLN A 114 110.525 -13.513 -8.409 1.00 0.00 N ATOM 1676 CA GLN A 114 111.872 -14.010 -8.141 1.00 0.00 C ATOM 1677 C GLN A 114 112.241 -15.108 -9.133 1.00 0.00 C ATOM 1678 O GLN A 114 111.483 -16.057 -9.333 1.00 0.00 O ATOM 1679 CB GLN A 114 111.943 -14.561 -6.715 1.00 0.00 C ATOM 1680 CG GLN A 114 113.386 -14.957 -6.385 1.00 0.00 C ATOM 1681 CD GLN A 114 113.498 -15.462 -4.946 1.00 0.00 C ATOM 1682 OE1 GLN A 114 112.548 -15.375 -4.165 1.00 0.00 O ATOM 1683 NE2 GLN A 114 114.619 -15.993 -4.543 1.00 0.00 N ATOM 0 H GLN A 114 109.785 -14.197 -8.253 1.00 0.00 H new ATOM 0 HA GLN A 114 112.578 -13.186 -8.250 1.00 0.00 H new ATOM 0 HB2 GLN A 114 111.591 -13.811 -6.007 1.00 0.00 H new ATOM 0 HB3 GLN A 114 111.287 -15.426 -6.616 1.00 0.00 H new ATOM 0 HG2 GLN A 114 113.721 -15.732 -7.074 1.00 0.00 H new ATOM 0 HG3 GLN A 114 114.044 -14.099 -6.526 1.00 0.00 H new ATOM 0 HE21 GLN A 114 115.408 -16.067 -5.185 1.00 0.00 H new ATOM 0 HE22 GLN A 114 114.707 -16.334 -3.586 1.00 0.00 H new ATOM 1692 N PHE A 115 113.410 -14.974 -9.755 1.00 0.00 N ATOM 1693 CA PHE A 115 113.879 -15.964 -10.723 1.00 0.00 C ATOM 1694 C PHE A 115 115.236 -16.512 -10.299 1.00 0.00 C ATOM 1695 O PHE A 115 116.017 -15.812 -9.657 1.00 0.00 O ATOM 1696 CB PHE A 115 113.996 -15.323 -12.107 1.00 0.00 C ATOM 1697 CG PHE A 115 112.678 -14.824 -12.652 1.00 0.00 C ATOM 1698 CD1 PHE A 115 111.817 -15.704 -13.318 1.00 0.00 C ATOM 1699 CD2 PHE A 115 112.317 -13.481 -12.490 1.00 0.00 C ATOM 1700 CE1 PHE A 115 110.596 -15.242 -13.822 1.00 0.00 C ATOM 1701 CE2 PHE A 115 111.097 -13.018 -12.995 1.00 0.00 C ATOM 1702 CZ PHE A 115 110.236 -13.899 -13.661 1.00 0.00 C ATOM 0 H PHE A 115 114.049 -14.192 -9.607 1.00 0.00 H new ATOM 0 HA PHE A 115 113.161 -16.783 -10.763 1.00 0.00 H new ATOM 0 HB2 PHE A 115 114.698 -14.490 -12.055 1.00 0.00 H new ATOM 0 HB3 PHE A 115 114.416 -16.051 -12.802 1.00 0.00 H new ATOM 0 HD1 PHE A 115 112.095 -16.740 -13.443 1.00 0.00 H new ATOM 0 HD2 PHE A 115 112.981 -12.802 -11.975 1.00 0.00 H new ATOM 0 HE1 PHE A 115 109.932 -15.922 -14.335 1.00 0.00 H new ATOM 0 HE2 PHE A 115 110.819 -11.982 -12.871 1.00 0.00 H new ATOM 0 HZ PHE A 115 109.294 -13.542 -14.050 1.00 0.00 H new ATOM 1712 N ASN A 116 115.523 -17.754 -10.685 1.00 0.00 N ATOM 1713 CA ASN A 116 116.780 -18.400 -10.313 1.00 0.00 C ATOM 1714 C ASN A 116 117.603 -18.727 -11.564 1.00 0.00 C ATOM 1715 O ASN A 116 117.549 -19.855 -12.060 1.00 0.00 O ATOM 1716 CB ASN A 116 116.495 -19.681 -9.524 1.00 0.00 C ATOM 1717 CG ASN A 116 115.573 -20.600 -10.319 1.00 0.00 C ATOM 1718 OD1 ASN A 116 114.421 -20.250 -10.580 1.00 0.00 O ATOM 1719 ND2 ASN A 116 116.013 -21.760 -10.724 1.00 0.00 N ATOM 0 H ASN A 116 114.904 -18.332 -11.254 1.00 0.00 H new ATOM 0 HA ASN A 116 117.353 -17.716 -9.688 1.00 0.00 H new ATOM 0 HB2 ASN A 116 117.430 -20.196 -9.303 1.00 0.00 H new ATOM 0 HB3 ASN A 116 116.035 -19.432 -8.568 1.00 0.00 H new ATOM 0 HD21 ASN A 116 115.403 -22.379 -11.258 1.00 0.00 H new ATOM 0 HD22 ASN A 116 116.967 -22.048 -10.507 1.00 0.00 H new ATOM 1726 N PRO A 117 118.358 -17.782 -12.089 1.00 0.00 N ATOM 1727 CA PRO A 117 119.170 -18.028 -13.321 1.00 0.00 C ATOM 1728 C PRO A 117 120.027 -19.288 -13.209 1.00 0.00 C ATOM 1729 O PRO A 117 119.820 -20.252 -13.946 1.00 0.00 O ATOM 1730 CB PRO A 117 120.045 -16.779 -13.460 1.00 0.00 C ATOM 1731 CG PRO A 117 119.312 -15.704 -12.736 1.00 0.00 C ATOM 1732 CD PRO A 117 118.538 -16.392 -11.613 1.00 0.00 C ATOM 0 HA PRO A 117 118.534 -18.196 -14.190 1.00 0.00 H new ATOM 0 HB2 PRO A 117 121.033 -16.941 -13.029 1.00 0.00 H new ATOM 0 HB3 PRO A 117 120.193 -16.517 -14.508 1.00 0.00 H new ATOM 0 HG2 PRO A 117 120.004 -14.964 -12.334 1.00 0.00 H new ATOM 0 HG3 PRO A 117 118.635 -15.175 -13.407 1.00 0.00 H new ATOM 0 HD2 PRO A 117 119.090 -16.362 -10.674 1.00 0.00 H new ATOM 0 HD3 PRO A 117 117.579 -15.905 -11.435 1.00 0.00 H new ATOM 1740 N MET A 118 120.987 -19.276 -12.288 1.00 0.00 N ATOM 1741 CA MET A 118 121.886 -20.413 -12.128 1.00 0.00 C ATOM 1742 C MET A 118 121.388 -21.353 -11.030 1.00 0.00 C ATOM 1743 O MET A 118 120.877 -22.434 -11.322 1.00 0.00 O ATOM 1744 CB MET A 118 123.299 -19.919 -11.803 1.00 0.00 C ATOM 1745 CG MET A 118 123.834 -19.093 -12.974 1.00 0.00 C ATOM 1746 SD MET A 118 125.578 -18.702 -12.691 1.00 0.00 S ATOM 1747 CE MET A 118 126.234 -20.360 -12.995 1.00 0.00 C ATOM 0 H MET A 118 121.161 -18.501 -11.648 1.00 0.00 H new ATOM 0 HA MET A 118 121.909 -20.969 -13.065 1.00 0.00 H new ATOM 0 HB2 MET A 118 123.285 -19.316 -10.895 1.00 0.00 H new ATOM 0 HB3 MET A 118 123.957 -20.767 -11.612 1.00 0.00 H new ATOM 0 HG2 MET A 118 123.721 -19.648 -13.905 1.00 0.00 H new ATOM 0 HG3 MET A 118 123.257 -18.174 -13.078 1.00 0.00 H new ATOM 0 HE1 MET A 118 127.039 -20.304 -13.728 1.00 0.00 H new ATOM 0 HE2 MET A 118 126.619 -20.775 -12.064 1.00 0.00 H new ATOM 0 HE3 MET A 118 125.440 -21.001 -13.377 1.00 0.00 H new ATOM 1757 N GLU A 119 121.528 -20.939 -9.772 1.00 0.00 N ATOM 1758 CA GLU A 119 121.099 -21.773 -8.654 1.00 0.00 C ATOM 1759 C GLU A 119 121.249 -21.031 -7.330 1.00 0.00 C ATOM 1760 O GLU A 119 120.265 -20.774 -6.636 1.00 0.00 O ATOM 1761 CB GLU A 119 121.928 -23.057 -8.610 1.00 0.00 C ATOM 1762 CG GLU A 119 121.346 -24.008 -7.556 1.00 0.00 C ATOM 1763 CD GLU A 119 122.191 -25.278 -7.401 1.00 0.00 C ATOM 1764 OE1 GLU A 119 123.210 -25.407 -8.065 1.00 0.00 O ATOM 1765 OE2 GLU A 119 121.798 -26.117 -6.606 1.00 0.00 O ATOM 0 H GLU A 119 121.931 -20.041 -9.504 1.00 0.00 H new ATOM 0 HA GLU A 119 120.047 -22.019 -8.801 1.00 0.00 H new ATOM 0 HB2 GLU A 119 121.926 -23.537 -9.589 1.00 0.00 H new ATOM 0 HB3 GLU A 119 122.966 -22.824 -8.371 1.00 0.00 H new ATOM 0 HG2 GLU A 119 121.285 -23.493 -6.597 1.00 0.00 H new ATOM 0 HG3 GLU A 119 120.329 -24.281 -7.836 1.00 0.00 H new ATOM 1772 N ASN A 120 122.488 -20.687 -6.986 1.00 0.00 N ATOM 1773 CA ASN A 120 122.760 -20.018 -5.714 1.00 0.00 C ATOM 1774 C ASN A 120 122.548 -18.498 -5.769 1.00 0.00 C ATOM 1775 O ASN A 120 122.833 -17.805 -4.793 1.00 0.00 O ATOM 1776 CB ASN A 120 124.201 -20.306 -5.287 1.00 0.00 C ATOM 1777 CG ASN A 120 124.423 -21.811 -5.177 1.00 0.00 C ATOM 1778 OD1 ASN A 120 125.424 -22.329 -5.674 1.00 0.00 O ATOM 1779 ND2 ASN A 120 123.545 -22.547 -4.553 1.00 0.00 N ATOM 0 H ASN A 120 123.312 -20.858 -7.562 1.00 0.00 H new ATOM 0 HA ASN A 120 122.047 -20.415 -4.991 1.00 0.00 H new ATOM 0 HB2 ASN A 120 124.895 -19.880 -6.011 1.00 0.00 H new ATOM 0 HB3 ASN A 120 124.407 -19.829 -4.329 1.00 0.00 H new ATOM 0 HD21 ASN A 120 123.686 -23.554 -4.476 1.00 0.00 H new ATOM 0 HD22 ASN A 120 122.717 -22.115 -4.142 1.00 0.00 H new ATOM 1786 N VAL A 121 122.055 -17.973 -6.892 1.00 0.00 N ATOM 1787 CA VAL A 121 121.793 -16.542 -7.011 1.00 0.00 C ATOM 1788 C VAL A 121 120.404 -16.313 -7.607 1.00 0.00 C ATOM 1789 O VAL A 121 119.982 -17.035 -8.510 1.00 0.00 O ATOM 1790 CB VAL A 121 122.874 -15.889 -7.883 1.00 0.00 C ATOM 1791 CG1 VAL A 121 122.844 -16.478 -9.296 1.00 0.00 C ATOM 1792 CG2 VAL A 121 122.637 -14.378 -7.958 1.00 0.00 C ATOM 0 H VAL A 121 121.831 -18.515 -7.726 1.00 0.00 H new ATOM 0 HA VAL A 121 121.821 -16.085 -6.022 1.00 0.00 H new ATOM 0 HB VAL A 121 123.848 -16.085 -7.435 1.00 0.00 H new ATOM 0 HG11 VAL A 121 123.616 -16.006 -9.904 1.00 0.00 H new ATOM 0 HG12 VAL A 121 123.027 -17.551 -9.247 1.00 0.00 H new ATOM 0 HG13 VAL A 121 121.867 -16.297 -9.745 1.00 0.00 H new ATOM 0 HG21 VAL A 121 123.407 -13.919 -8.578 1.00 0.00 H new ATOM 0 HG22 VAL A 121 121.657 -14.185 -8.394 1.00 0.00 H new ATOM 0 HG23 VAL A 121 122.678 -13.953 -6.955 1.00 0.00 H new ATOM 1802 N ALA A 122 119.699 -15.305 -7.098 1.00 0.00 N ATOM 1803 CA ALA A 122 118.356 -15.003 -7.586 1.00 0.00 C ATOM 1804 C ALA A 122 118.203 -13.512 -7.860 1.00 0.00 C ATOM 1805 O ALA A 122 118.874 -12.687 -7.241 1.00 0.00 O ATOM 1806 CB ALA A 122 117.318 -15.439 -6.551 1.00 0.00 C ATOM 0 H ALA A 122 120.031 -14.689 -6.356 1.00 0.00 H new ATOM 0 HA ALA A 122 118.199 -15.548 -8.517 1.00 0.00 H new ATOM 0 HB1 ALA A 122 116.318 -15.211 -6.920 1.00 0.00 H new ATOM 0 HB2 ALA A 122 117.405 -16.512 -6.378 1.00 0.00 H new ATOM 0 HB3 ALA A 122 117.490 -14.905 -5.616 1.00 0.00 H new ATOM 1812 N LEU A 123 117.309 -13.182 -8.788 1.00 0.00 N ATOM 1813 CA LEU A 123 117.049 -11.791 -9.148 1.00 0.00 C ATOM 1814 C LEU A 123 115.615 -11.432 -8.778 1.00 0.00 C ATOM 1815 O LEU A 123 114.717 -12.259 -8.922 1.00 0.00 O ATOM 1816 CB LEU A 123 117.248 -11.587 -10.654 1.00 0.00 C ATOM 1817 CG LEU A 123 118.649 -12.039 -11.073 1.00 0.00 C ATOM 1818 CD1 LEU A 123 118.793 -11.909 -12.591 1.00 0.00 C ATOM 1819 CD2 LEU A 123 119.700 -11.160 -10.393 1.00 0.00 C ATOM 0 H LEU A 123 116.751 -13.861 -9.306 1.00 0.00 H new ATOM 0 HA LEU A 123 117.744 -11.150 -8.606 1.00 0.00 H new ATOM 0 HB2 LEU A 123 116.497 -12.151 -11.206 1.00 0.00 H new ATOM 0 HB3 LEU A 123 117.107 -10.536 -10.907 1.00 0.00 H new ATOM 0 HG LEU A 123 118.795 -13.077 -10.775 1.00 0.00 H new ATOM 0 HD11 LEU A 123 119.790 -12.231 -12.891 1.00 0.00 H new ATOM 0 HD12 LEU A 123 118.047 -12.534 -13.082 1.00 0.00 H new ATOM 0 HD13 LEU A 123 118.644 -10.869 -12.883 1.00 0.00 H new ATOM 0 HD21 LEU A 123 120.696 -11.485 -10.694 1.00 0.00 H new ATOM 0 HD22 LEU A 123 119.552 -10.121 -10.689 1.00 0.00 H new ATOM 0 HD23 LEU A 123 119.602 -11.246 -9.311 1.00 0.00 H new ATOM 1831 N ASP A 124 115.397 -10.206 -8.304 1.00 0.00 N ATOM 1832 CA ASP A 124 114.054 -9.778 -7.916 1.00 0.00 C ATOM 1833 C ASP A 124 113.690 -8.470 -8.607 1.00 0.00 C ATOM 1834 O ASP A 124 114.452 -7.505 -8.558 1.00 0.00 O ATOM 1835 CB ASP A 124 113.976 -9.606 -6.393 1.00 0.00 C ATOM 1836 CG ASP A 124 114.899 -8.487 -5.910 1.00 0.00 C ATOM 1837 OD1 ASP A 124 115.864 -8.190 -6.593 1.00 0.00 O ATOM 1838 OD2 ASP A 124 114.621 -7.939 -4.855 1.00 0.00 O ATOM 0 H ASP A 124 116.123 -9.500 -8.180 1.00 0.00 H new ATOM 0 HA ASP A 124 113.343 -10.544 -8.225 1.00 0.00 H new ATOM 0 HB2 ASP A 124 112.949 -9.384 -6.103 1.00 0.00 H new ATOM 0 HB3 ASP A 124 114.250 -10.542 -5.905 1.00 0.00 H new ATOM 1843 N PHE A 125 112.539 -8.463 -9.275 1.00 0.00 N ATOM 1844 CA PHE A 125 112.039 -7.256 -9.929 1.00 0.00 C ATOM 1845 C PHE A 125 110.653 -6.922 -9.393 1.00 0.00 C ATOM 1846 O PHE A 125 109.796 -7.799 -9.314 1.00 0.00 O ATOM 1847 CB PHE A 125 111.967 -7.471 -11.442 1.00 0.00 C ATOM 1848 CG PHE A 125 113.310 -7.746 -12.074 1.00 0.00 C ATOM 1849 CD1 PHE A 125 114.138 -6.682 -12.452 1.00 0.00 C ATOM 1850 CD2 PHE A 125 113.728 -9.066 -12.285 1.00 0.00 C ATOM 1851 CE1 PHE A 125 115.383 -6.937 -13.039 1.00 0.00 C ATOM 1852 CE2 PHE A 125 114.973 -9.321 -12.872 1.00 0.00 C ATOM 1853 CZ PHE A 125 115.800 -8.257 -13.249 1.00 0.00 C ATOM 0 H PHE A 125 111.935 -9.279 -9.378 1.00 0.00 H new ATOM 0 HA PHE A 125 112.719 -6.430 -9.720 1.00 0.00 H new ATOM 0 HB2 PHE A 125 111.298 -8.306 -11.651 1.00 0.00 H new ATOM 0 HB3 PHE A 125 111.529 -6.587 -11.906 1.00 0.00 H new ATOM 0 HD1 PHE A 125 113.816 -5.664 -12.291 1.00 0.00 H new ATOM 0 HD2 PHE A 125 113.090 -9.887 -11.995 1.00 0.00 H new ATOM 0 HE1 PHE A 125 116.022 -6.116 -13.330 1.00 0.00 H new ATOM 0 HE2 PHE A 125 115.295 -10.339 -13.034 1.00 0.00 H new ATOM 0 HZ PHE A 125 116.760 -8.454 -13.702 1.00 0.00 H new ATOM 1863 N SER A 126 110.438 -5.662 -9.023 1.00 0.00 N ATOM 1864 CA SER A 126 109.156 -5.261 -8.453 1.00 0.00 C ATOM 1865 C SER A 126 108.754 -3.864 -8.914 1.00 0.00 C ATOM 1866 O SER A 126 109.604 -3.003 -9.141 1.00 0.00 O ATOM 1867 CB SER A 126 109.238 -5.288 -6.926 1.00 0.00 C ATOM 1868 OG SER A 126 107.955 -5.006 -6.385 1.00 0.00 O ATOM 0 H SER A 126 111.124 -4.912 -9.106 1.00 0.00 H new ATOM 0 HA SER A 126 108.400 -5.966 -8.798 1.00 0.00 H new ATOM 0 HB2 SER A 126 109.583 -6.264 -6.585 1.00 0.00 H new ATOM 0 HB3 SER A 126 109.963 -4.554 -6.576 1.00 0.00 H new ATOM 0 HG SER A 126 107.270 -5.166 -7.067 1.00 0.00 H new ATOM 1874 N TYR A 127 107.448 -3.651 -9.050 1.00 0.00 N ATOM 1875 CA TYR A 127 106.917 -2.333 -9.382 1.00 0.00 C ATOM 1876 C TYR A 127 106.142 -1.781 -8.191 1.00 0.00 C ATOM 1877 O TYR A 127 105.205 -2.413 -7.704 1.00 0.00 O ATOM 1878 CB TYR A 127 105.991 -2.434 -10.597 1.00 0.00 C ATOM 1879 CG TYR A 127 105.451 -1.099 -11.053 1.00 0.00 C ATOM 1880 CD1 TYR A 127 104.247 -0.614 -10.527 1.00 0.00 C ATOM 1881 CD2 TYR A 127 106.152 -0.347 -12.002 1.00 0.00 C ATOM 1882 CE1 TYR A 127 103.746 0.623 -10.951 1.00 0.00 C ATOM 1883 CE2 TYR A 127 105.652 0.889 -12.426 1.00 0.00 C ATOM 1884 CZ TYR A 127 104.448 1.375 -11.900 1.00 0.00 C ATOM 1885 OH TYR A 127 103.954 2.594 -12.317 1.00 0.00 O ATOM 0 H TYR A 127 106.738 -4.374 -8.935 1.00 0.00 H new ATOM 0 HA TYR A 127 107.744 -1.663 -9.619 1.00 0.00 H new ATOM 0 HB2 TYR A 127 106.534 -2.898 -11.420 1.00 0.00 H new ATOM 0 HB3 TYR A 127 105.156 -3.092 -10.354 1.00 0.00 H new ATOM 0 HD1 TYR A 127 103.705 -1.194 -9.795 1.00 0.00 H new ATOM 0 HD2 TYR A 127 107.080 -0.721 -12.408 1.00 0.00 H new ATOM 0 HE1 TYR A 127 102.817 0.997 -10.546 1.00 0.00 H new ATOM 0 HE2 TYR A 127 106.194 1.468 -13.159 1.00 0.00 H new ATOM 0 HH TYR A 127 104.563 2.985 -12.977 1.00 0.00 H new ATOM 1895 N GLU A 128 106.535 -0.598 -7.725 1.00 0.00 N ATOM 1896 CA GLU A 128 105.926 -0.012 -6.533 1.00 0.00 C ATOM 1897 C GLU A 128 105.166 1.265 -6.880 1.00 0.00 C ATOM 1898 O GLU A 128 105.649 2.098 -7.646 1.00 0.00 O ATOM 1899 CB GLU A 128 107.018 0.313 -5.511 1.00 0.00 C ATOM 1900 CG GLU A 128 106.376 0.694 -4.174 1.00 0.00 C ATOM 1901 CD GLU A 128 105.750 -0.529 -3.501 1.00 0.00 C ATOM 1902 OE1 GLU A 128 106.193 -1.636 -3.767 1.00 0.00 O ATOM 1903 OE2 GLU A 128 104.829 -0.341 -2.724 1.00 0.00 O ATOM 0 H GLU A 128 107.267 -0.029 -8.151 1.00 0.00 H new ATOM 0 HA GLU A 128 105.223 -0.733 -6.116 1.00 0.00 H new ATOM 0 HB2 GLU A 128 107.674 -0.548 -5.379 1.00 0.00 H new ATOM 0 HB3 GLU A 128 107.638 1.133 -5.875 1.00 0.00 H new ATOM 0 HG2 GLU A 128 107.128 1.131 -3.517 1.00 0.00 H new ATOM 0 HG3 GLU A 128 105.613 1.455 -4.336 1.00 0.00 H new ATOM 1910 N GLN A 129 103.972 1.408 -6.312 1.00 0.00 N ATOM 1911 CA GLN A 129 103.177 2.618 -6.487 1.00 0.00 C ATOM 1912 C GLN A 129 102.875 3.216 -5.119 1.00 0.00 C ATOM 1913 O GLN A 129 102.434 2.505 -4.217 1.00 0.00 O ATOM 1914 CB GLN A 129 101.868 2.287 -7.208 1.00 0.00 C ATOM 1915 CG GLN A 129 101.108 3.579 -7.512 1.00 0.00 C ATOM 1916 CD GLN A 129 101.773 4.314 -8.671 1.00 0.00 C ATOM 1917 OE1 GLN A 129 101.811 3.804 -9.791 1.00 0.00 O ATOM 1918 NE2 GLN A 129 102.301 5.489 -8.469 1.00 0.00 N ATOM 0 H GLN A 129 103.533 0.698 -5.725 1.00 0.00 H new ATOM 0 HA GLN A 129 103.735 3.336 -7.088 1.00 0.00 H new ATOM 0 HB2 GLN A 129 102.077 1.750 -8.133 1.00 0.00 H new ATOM 0 HB3 GLN A 129 101.256 1.631 -6.589 1.00 0.00 H new ATOM 0 HG2 GLN A 129 100.072 3.351 -7.762 1.00 0.00 H new ATOM 0 HG3 GLN A 129 101.090 4.217 -6.628 1.00 0.00 H new ATOM 0 HE21 GLN A 129 102.269 5.910 -7.540 1.00 0.00 H new ATOM 0 HE22 GLN A 129 102.746 5.987 -9.240 1.00 0.00 H new ATOM 1927 N SER A 130 103.128 4.512 -4.954 1.00 0.00 N ATOM 1928 CA SER A 130 102.939 5.155 -3.655 1.00 0.00 C ATOM 1929 C SER A 130 102.144 6.446 -3.791 1.00 0.00 C ATOM 1930 O SER A 130 102.298 7.184 -4.765 1.00 0.00 O ATOM 1931 CB SER A 130 104.299 5.458 -3.026 1.00 0.00 C ATOM 1932 OG SER A 130 104.104 5.977 -1.717 1.00 0.00 O ATOM 0 H SER A 130 103.460 5.132 -5.693 1.00 0.00 H new ATOM 0 HA SER A 130 102.379 4.472 -3.016 1.00 0.00 H new ATOM 0 HB2 SER A 130 104.904 4.552 -2.984 1.00 0.00 H new ATOM 0 HB3 SER A 130 104.844 6.177 -3.638 1.00 0.00 H new ATOM 0 HG SER A 130 103.320 5.553 -1.310 1.00 0.00 H new ATOM 1938 N ARG A 131 101.301 6.712 -2.796 1.00 0.00 N ATOM 1939 CA ARG A 131 100.528 7.947 -2.754 1.00 0.00 C ATOM 1940 C ARG A 131 100.927 8.748 -1.520 1.00 0.00 C ATOM 1941 O ARG A 131 100.801 8.266 -0.392 1.00 0.00 O ATOM 1942 CB ARG A 131 99.032 7.631 -2.701 1.00 0.00 C ATOM 1943 CG ARG A 131 98.614 6.916 -3.987 1.00 0.00 C ATOM 1944 CD ARG A 131 97.111 6.634 -3.950 1.00 0.00 C ATOM 1945 NE ARG A 131 96.358 7.885 -4.060 1.00 0.00 N ATOM 1946 CZ ARG A 131 95.051 7.992 -3.769 1.00 0.00 C ATOM 1947 NH1 ARG A 131 94.341 6.970 -3.355 1.00 0.00 N ATOM 1948 NH2 ARG A 131 94.468 9.152 -3.903 1.00 0.00 N ATOM 0 H ARG A 131 101.137 6.086 -2.007 1.00 0.00 H new ATOM 0 HA ARG A 131 100.733 8.529 -3.652 1.00 0.00 H new ATOM 0 HB2 ARG A 131 98.813 7.004 -1.837 1.00 0.00 H new ATOM 0 HB3 ARG A 131 98.459 8.551 -2.582 1.00 0.00 H new ATOM 0 HG2 ARG A 131 98.858 7.531 -4.853 1.00 0.00 H new ATOM 0 HG3 ARG A 131 99.167 5.983 -4.093 1.00 0.00 H new ATOM 0 HD2 ARG A 131 96.839 5.965 -4.766 1.00 0.00 H new ATOM 0 HD3 ARG A 131 96.852 6.126 -3.021 1.00 0.00 H new ATOM 0 HE ARG A 131 96.852 8.720 -4.374 1.00 0.00 H new ATOM 0 HH11 ARG A 131 94.779 6.056 -3.244 1.00 0.00 H new ATOM 0 HH12 ARG A 131 93.350 7.089 -3.143 1.00 0.00 H new ATOM 0 HH21 ARG A 131 95.004 9.958 -4.224 1.00 0.00 H new ATOM 0 HH22 ARG A 131 93.476 9.252 -3.687 1.00 0.00 H new ATOM 1962 N ILE A 132 101.425 9.959 -1.749 1.00 0.00 N ATOM 1963 CA ILE A 132 101.906 10.808 -0.667 1.00 0.00 C ATOM 1964 C ILE A 132 101.215 12.152 -0.797 1.00 0.00 C ATOM 1965 O ILE A 132 101.688 13.012 -1.538 1.00 0.00 O ATOM 1966 CB ILE A 132 103.424 10.985 -0.772 1.00 0.00 C ATOM 1967 CG1 ILE A 132 104.104 9.614 -0.726 1.00 0.00 C ATOM 1968 CG2 ILE A 132 103.925 11.836 0.397 1.00 0.00 C ATOM 1969 CD1 ILE A 132 105.601 9.777 -0.997 1.00 0.00 C ATOM 0 H ILE A 132 101.506 10.374 -2.677 1.00 0.00 H new ATOM 0 HA ILE A 132 101.685 10.356 0.300 1.00 0.00 H new ATOM 0 HB ILE A 132 103.663 11.481 -1.713 1.00 0.00 H new ATOM 0 HG12 ILE A 132 103.948 9.152 0.249 1.00 0.00 H new ATOM 0 HG13 ILE A 132 103.659 8.951 -1.468 1.00 0.00 H new ATOM 0 HG21 ILE A 132 105.005 11.960 0.320 1.00 0.00 H new ATOM 0 HG22 ILE A 132 103.444 12.814 0.368 1.00 0.00 H new ATOM 0 HG23 ILE A 132 103.683 11.341 1.337 1.00 0.00 H new ATOM 0 HD11 ILE A 132 106.085 8.801 -0.964 1.00 0.00 H new ATOM 0 HD12 ILE A 132 105.746 10.221 -1.982 1.00 0.00 H new ATOM 0 HD13 ILE A 132 106.040 10.425 -0.238 1.00 0.00 H new ATOM 1981 N ARG A 133 100.108 12.317 -0.064 1.00 0.00 N ATOM 1982 CA ARG A 133 99.114 13.390 -0.267 1.00 0.00 C ATOM 1983 C ARG A 133 99.228 14.125 -1.610 1.00 0.00 C ATOM 1984 O ARG A 133 100.018 15.057 -1.755 1.00 0.00 O ATOM 1985 CB ARG A 133 99.240 14.412 0.863 1.00 0.00 C ATOM 1986 CG ARG A 133 98.879 13.750 2.194 1.00 0.00 C ATOM 1987 CD ARG A 133 98.868 14.796 3.312 1.00 0.00 C ATOM 1988 NE ARG A 133 100.162 15.481 3.389 1.00 0.00 N ATOM 1989 CZ ARG A 133 100.437 16.627 2.748 1.00 0.00 C ATOM 1990 NH1 ARG A 133 99.572 17.217 1.959 1.00 0.00 N ATOM 1991 NH2 ARG A 133 101.614 17.169 2.908 1.00 0.00 N ATOM 0 H ARG A 133 99.868 11.695 0.708 1.00 0.00 H new ATOM 0 HA ARG A 133 98.142 12.897 -0.269 1.00 0.00 H new ATOM 0 HB2 ARG A 133 100.257 14.802 0.903 1.00 0.00 H new ATOM 0 HB3 ARG A 133 98.581 15.260 0.676 1.00 0.00 H new ATOM 0 HG2 ARG A 133 97.901 13.274 2.120 1.00 0.00 H new ATOM 0 HG3 ARG A 133 99.598 12.965 2.426 1.00 0.00 H new ATOM 0 HD2 ARG A 133 98.076 15.522 3.130 1.00 0.00 H new ATOM 0 HD3 ARG A 133 98.647 14.315 4.265 1.00 0.00 H new ATOM 0 HE ARG A 133 100.895 15.063 3.962 1.00 0.00 H new ATOM 0 HH11 ARG A 133 98.650 16.805 1.814 1.00 0.00 H new ATOM 0 HH12 ARG A 133 99.821 18.088 1.490 1.00 0.00 H new ATOM 0 HH21 ARG A 133 102.304 16.721 3.511 1.00 0.00 H new ATOM 0 HH22 ARG A 133 101.844 18.040 2.430 1.00 0.00 H new ATOM 2005 N SER A 134 98.439 13.676 -2.583 1.00 0.00 N ATOM 2006 CA SER A 134 98.281 14.372 -3.867 1.00 0.00 C ATOM 2007 C SER A 134 99.494 14.218 -4.796 1.00 0.00 C ATOM 2008 O SER A 134 99.418 14.613 -5.961 1.00 0.00 O ATOM 2009 CB SER A 134 97.962 15.860 -3.655 1.00 0.00 C ATOM 2010 OG SER A 134 99.165 16.606 -3.519 1.00 0.00 O ATOM 0 H SER A 134 97.889 12.820 -2.508 1.00 0.00 H new ATOM 0 HA SER A 134 97.439 13.891 -4.364 1.00 0.00 H new ATOM 0 HB2 SER A 134 97.384 16.239 -4.498 1.00 0.00 H new ATOM 0 HB3 SER A 134 97.346 15.984 -2.764 1.00 0.00 H new ATOM 0 HG SER A 134 99.644 16.311 -2.716 1.00 0.00 H new ATOM 2016 N VAL A 135 100.604 13.660 -4.309 1.00 0.00 N ATOM 2017 CA VAL A 135 101.770 13.431 -5.158 1.00 0.00 C ATOM 2018 C VAL A 135 101.847 11.953 -5.534 1.00 0.00 C ATOM 2019 O VAL A 135 101.687 11.083 -4.680 1.00 0.00 O ATOM 2020 CB VAL A 135 103.049 13.848 -4.423 1.00 0.00 C ATOM 2021 CG1 VAL A 135 104.260 13.680 -5.345 1.00 0.00 C ATOM 2022 CG2 VAL A 135 102.945 15.316 -4.000 1.00 0.00 C ATOM 0 H VAL A 135 100.718 13.362 -3.340 1.00 0.00 H new ATOM 0 HA VAL A 135 101.674 14.030 -6.063 1.00 0.00 H new ATOM 0 HB VAL A 135 103.171 13.217 -3.542 1.00 0.00 H new ATOM 0 HG11 VAL A 135 105.165 13.978 -4.815 1.00 0.00 H new ATOM 0 HG12 VAL A 135 104.344 12.636 -5.648 1.00 0.00 H new ATOM 0 HG13 VAL A 135 104.134 14.305 -6.229 1.00 0.00 H new ATOM 0 HG21 VAL A 135 103.856 15.610 -3.478 1.00 0.00 H new ATOM 0 HG22 VAL A 135 102.816 15.941 -4.884 1.00 0.00 H new ATOM 0 HG23 VAL A 135 102.089 15.444 -3.337 1.00 0.00 H new ATOM 2032 N ASP A 136 102.087 11.683 -6.814 1.00 0.00 N ATOM 2033 CA ASP A 136 102.139 10.304 -7.300 1.00 0.00 C ATOM 2034 C ASP A 136 103.583 9.874 -7.535 1.00 0.00 C ATOM 2035 O ASP A 136 104.327 10.556 -8.235 1.00 0.00 O ATOM 2036 CB ASP A 136 101.350 10.181 -8.607 1.00 0.00 C ATOM 2037 CG ASP A 136 99.874 10.497 -8.374 1.00 0.00 C ATOM 2038 OD1 ASP A 136 99.391 10.235 -7.285 1.00 0.00 O ATOM 2039 OD2 ASP A 136 99.248 10.997 -9.294 1.00 0.00 O ATOM 0 H ASP A 136 102.247 12.392 -7.529 1.00 0.00 H new ATOM 0 HA ASP A 136 101.696 9.655 -6.545 1.00 0.00 H new ATOM 0 HB2 ASP A 136 101.761 10.863 -9.352 1.00 0.00 H new ATOM 0 HB3 ASP A 136 101.453 9.172 -9.007 1.00 0.00 H new ATOM 2044 N VAL A 137 103.980 8.738 -6.963 1.00 0.00 N ATOM 2045 CA VAL A 137 105.349 8.249 -7.126 1.00 0.00 C ATOM 2046 C VAL A 137 105.343 6.864 -7.766 1.00 0.00 C ATOM 2047 O VAL A 137 104.634 5.967 -7.309 1.00 0.00 O ATOM 2048 CB VAL A 137 106.050 8.185 -5.761 1.00 0.00 C ATOM 2049 CG1 VAL A 137 107.511 7.765 -5.942 1.00 0.00 C ATOM 2050 CG2 VAL A 137 106.011 9.562 -5.090 1.00 0.00 C ATOM 0 H VAL A 137 103.381 8.145 -6.389 1.00 0.00 H new ATOM 0 HA VAL A 137 105.890 8.937 -7.776 1.00 0.00 H new ATOM 0 HB VAL A 137 105.533 7.456 -5.138 1.00 0.00 H new ATOM 0 HG11 VAL A 137 108.000 7.722 -4.969 1.00 0.00 H new ATOM 0 HG12 VAL A 137 107.552 6.782 -6.412 1.00 0.00 H new ATOM 0 HG13 VAL A 137 108.023 8.491 -6.574 1.00 0.00 H new ATOM 0 HG21 VAL A 137 106.510 9.509 -4.122 1.00 0.00 H new ATOM 0 HG22 VAL A 137 106.521 10.289 -5.722 1.00 0.00 H new ATOM 0 HG23 VAL A 137 104.975 9.868 -4.948 1.00 0.00 H new ATOM 2060 N GLY A 138 106.143 6.698 -8.817 1.00 0.00 N ATOM 2061 CA GLY A 138 106.276 5.404 -9.482 1.00 0.00 C ATOM 2062 C GLY A 138 107.729 4.952 -9.443 1.00 0.00 C ATOM 2063 O GLY A 138 108.610 5.660 -9.924 1.00 0.00 O ATOM 0 H GLY A 138 106.708 7.442 -9.226 1.00 0.00 H new ATOM 0 HA2 GLY A 138 105.642 4.665 -8.991 1.00 0.00 H new ATOM 0 HA3 GLY A 138 105.936 5.479 -10.515 1.00 0.00 H new ATOM 2067 N THR A 139 107.982 3.779 -8.868 1.00 0.00 N ATOM 2068 CA THR A 139 109.353 3.316 -8.669 1.00 0.00 C ATOM 2069 C THR A 139 109.584 1.954 -9.316 1.00 0.00 C ATOM 2070 O THR A 139 108.769 1.042 -9.182 1.00 0.00 O ATOM 2071 CB THR A 139 109.640 3.218 -7.169 1.00 0.00 C ATOM 2072 OG1 THR A 139 109.326 4.456 -6.547 1.00 0.00 O ATOM 2073 CG2 THR A 139 111.119 2.893 -6.941 1.00 0.00 C ATOM 0 H THR A 139 107.263 3.137 -8.534 1.00 0.00 H new ATOM 0 HA THR A 139 110.025 4.033 -9.140 1.00 0.00 H new ATOM 0 HB THR A 139 109.029 2.425 -6.738 1.00 0.00 H new ATOM 0 HG1 THR A 139 110.142 4.991 -6.452 1.00 0.00 H new ATOM 0 HG21 THR A 139 111.316 2.825 -5.871 1.00 0.00 H new ATOM 0 HG22 THR A 139 111.360 1.942 -7.416 1.00 0.00 H new ATOM 0 HG23 THR A 139 111.736 3.681 -7.374 1.00 0.00 H new ATOM 2081 N TRP A 140 110.705 1.832 -10.021 1.00 0.00 N ATOM 2082 CA TRP A 140 111.138 0.546 -10.557 1.00 0.00 C ATOM 2083 C TRP A 140 112.382 0.090 -9.804 1.00 0.00 C ATOM 2084 O TRP A 140 113.359 0.831 -9.704 1.00 0.00 O ATOM 2085 CB TRP A 140 111.452 0.675 -12.048 1.00 0.00 C ATOM 2086 CG TRP A 140 110.252 0.985 -12.884 1.00 0.00 C ATOM 2087 CD1 TRP A 140 109.272 0.106 -13.192 1.00 0.00 C ATOM 2088 CD2 TRP A 140 109.889 2.244 -13.525 1.00 0.00 C ATOM 2089 NE1 TRP A 140 108.330 0.743 -13.979 1.00 0.00 N ATOM 2090 CE2 TRP A 140 108.665 2.062 -14.213 1.00 0.00 C ATOM 2091 CE3 TRP A 140 110.495 3.511 -13.575 1.00 0.00 C ATOM 2092 CZ2 TRP A 140 108.065 3.103 -14.926 1.00 0.00 C ATOM 2093 CZ3 TRP A 140 109.896 4.559 -14.291 1.00 0.00 C ATOM 2094 CH2 TRP A 140 108.684 4.356 -14.965 1.00 0.00 C ATOM 0 H TRP A 140 111.330 2.609 -10.234 1.00 0.00 H new ATOM 0 HA TRP A 140 110.341 -0.187 -10.432 1.00 0.00 H new ATOM 0 HB2 TRP A 140 112.196 1.460 -12.188 1.00 0.00 H new ATOM 0 HB3 TRP A 140 111.900 -0.255 -12.399 1.00 0.00 H new ATOM 0 HD1 TRP A 140 109.231 -0.926 -12.875 1.00 0.00 H new ATOM 0 HE1 TRP A 140 107.490 0.293 -14.342 1.00 0.00 H new ATOM 0 HE3 TRP A 140 111.428 3.679 -13.059 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 107.131 2.941 -15.443 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 110.372 5.528 -14.323 1.00 0.00 H new ATOM 0 HH2 TRP A 140 108.229 5.167 -15.514 1.00 0.00 H new ATOM 2105 N ILE A 141 112.349 -1.130 -9.275 1.00 0.00 N ATOM 2106 CA ILE A 141 113.434 -1.614 -8.425 1.00 0.00 C ATOM 2107 C ILE A 141 113.923 -2.991 -8.870 1.00 0.00 C ATOM 2108 O ILE A 141 113.133 -3.847 -9.270 1.00 0.00 O ATOM 2109 CB ILE A 141 112.947 -1.658 -6.970 1.00 0.00 C ATOM 2110 CG1 ILE A 141 114.099 -2.069 -6.048 1.00 0.00 C ATOM 2111 CG2 ILE A 141 111.794 -2.655 -6.824 1.00 0.00 C ATOM 2112 CD1 ILE A 141 113.790 -1.617 -4.620 1.00 0.00 C ATOM 0 H ILE A 141 111.590 -1.797 -9.418 1.00 0.00 H new ATOM 0 HA ILE A 141 114.279 -0.930 -8.510 1.00 0.00 H new ATOM 0 HB ILE A 141 112.594 -0.665 -6.691 1.00 0.00 H new ATOM 0 HG12 ILE A 141 114.236 -3.150 -6.078 1.00 0.00 H new ATOM 0 HG13 ILE A 141 115.032 -1.620 -6.390 1.00 0.00 H new ATOM 0 HG21 ILE A 141 111.459 -2.675 -5.787 1.00 0.00 H new ATOM 0 HG22 ILE A 141 110.967 -2.352 -7.466 1.00 0.00 H new ATOM 0 HG23 ILE A 141 112.134 -3.649 -7.115 1.00 0.00 H new ATOM 0 HD11 ILE A 141 114.608 -1.908 -3.961 1.00 0.00 H new ATOM 0 HD12 ILE A 141 113.675 -0.533 -4.598 1.00 0.00 H new ATOM 0 HD13 ILE A 141 112.867 -2.087 -4.281 1.00 0.00 H new ATOM 2124 N ALA A 142 115.235 -3.189 -8.795 1.00 0.00 N ATOM 2125 CA ALA A 142 115.824 -4.492 -9.090 1.00 0.00 C ATOM 2126 C ALA A 142 116.975 -4.771 -8.129 1.00 0.00 C ATOM 2127 O ALA A 142 117.687 -3.848 -7.729 1.00 0.00 O ATOM 2128 CB ALA A 142 116.336 -4.522 -10.531 1.00 0.00 C ATOM 0 H ALA A 142 115.908 -2.469 -8.534 1.00 0.00 H new ATOM 0 HA ALA A 142 115.060 -5.260 -8.968 1.00 0.00 H new ATOM 0 HB1 ALA A 142 116.774 -5.498 -10.741 1.00 0.00 H new ATOM 0 HB2 ALA A 142 115.507 -4.341 -11.215 1.00 0.00 H new ATOM 0 HB3 ALA A 142 117.093 -3.749 -10.664 1.00 0.00 H new ATOM 2134 N GLY A 143 117.146 -6.037 -7.748 1.00 0.00 N ATOM 2135 CA GLY A 143 118.215 -6.392 -6.820 1.00 0.00 C ATOM 2136 C GLY A 143 118.608 -7.861 -6.938 1.00 0.00 C ATOM 2137 O GLY A 143 118.054 -8.601 -7.751 1.00 0.00 O ATOM 0 H GLY A 143 116.570 -6.818 -8.061 1.00 0.00 H new ATOM 0 HA2 GLY A 143 119.086 -5.767 -7.014 1.00 0.00 H new ATOM 0 HA3 GLY A 143 117.894 -6.183 -5.800 1.00 0.00 H new ATOM 2141 N VAL A 144 119.550 -8.275 -6.093 1.00 0.00 N ATOM 2142 CA VAL A 144 120.054 -9.644 -6.110 1.00 0.00 C ATOM 2143 C VAL A 144 119.993 -10.238 -4.706 1.00 0.00 C ATOM 2144 O VAL A 144 120.030 -9.502 -3.721 1.00 0.00 O ATOM 2145 CB VAL A 144 121.500 -9.663 -6.618 1.00 0.00 C ATOM 2146 CG1 VAL A 144 121.547 -9.140 -8.055 1.00 0.00 C ATOM 2147 CG2 VAL A 144 122.373 -8.772 -5.727 1.00 0.00 C ATOM 0 H VAL A 144 119.980 -7.679 -5.386 1.00 0.00 H new ATOM 0 HA VAL A 144 119.433 -10.241 -6.778 1.00 0.00 H new ATOM 0 HB VAL A 144 121.875 -10.686 -6.589 1.00 0.00 H new ATOM 0 HG11 VAL A 144 122.576 -9.154 -8.414 1.00 0.00 H new ATOM 0 HG12 VAL A 144 120.931 -9.774 -8.693 1.00 0.00 H new ATOM 0 HG13 VAL A 144 121.167 -8.119 -8.083 1.00 0.00 H new ATOM 0 HG21 VAL A 144 123.400 -8.788 -6.091 1.00 0.00 H new ATOM 0 HG22 VAL A 144 121.995 -7.750 -5.753 1.00 0.00 H new ATOM 0 HG23 VAL A 144 122.346 -9.143 -4.703 1.00 0.00 H new ATOM 2157 N GLY A 145 119.897 -11.561 -4.619 1.00 0.00 N ATOM 2158 CA GLY A 145 119.822 -12.224 -3.321 1.00 0.00 C ATOM 2159 C GLY A 145 120.623 -13.520 -3.305 1.00 0.00 C ATOM 2160 O GLY A 145 120.777 -14.176 -4.335 1.00 0.00 O ATOM 0 H GLY A 145 119.869 -12.190 -5.422 1.00 0.00 H new ATOM 0 HA2 GLY A 145 120.198 -11.554 -2.548 1.00 0.00 H new ATOM 0 HA3 GLY A 145 118.780 -12.437 -3.080 1.00 0.00 H new ATOM 2164 N TYR A 146 121.115 -13.882 -2.122 1.00 0.00 N ATOM 2165 CA TYR A 146 121.861 -15.124 -1.944 1.00 0.00 C ATOM 2166 C TYR A 146 121.275 -15.907 -0.775 1.00 0.00 C ATOM 2167 O TYR A 146 120.860 -15.314 0.221 1.00 0.00 O ATOM 2168 CB TYR A 146 123.335 -14.816 -1.674 1.00 0.00 C ATOM 2169 CG TYR A 146 123.998 -14.032 -2.781 1.00 0.00 C ATOM 2170 CD1 TYR A 146 124.463 -14.691 -3.924 1.00 0.00 C ATOM 2171 CD2 TYR A 146 124.147 -12.645 -2.664 1.00 0.00 C ATOM 2172 CE1 TYR A 146 125.078 -13.964 -4.951 1.00 0.00 C ATOM 2173 CE2 TYR A 146 124.762 -11.918 -3.690 1.00 0.00 C ATOM 2174 CZ TYR A 146 125.226 -12.577 -4.834 1.00 0.00 C ATOM 2175 OH TYR A 146 125.833 -11.860 -5.846 1.00 0.00 O ATOM 0 H TYR A 146 121.010 -13.330 -1.271 1.00 0.00 H new ATOM 0 HA TYR A 146 121.786 -15.720 -2.853 1.00 0.00 H new ATOM 0 HB2 TYR A 146 123.416 -14.255 -0.743 1.00 0.00 H new ATOM 0 HB3 TYR A 146 123.873 -15.753 -1.530 1.00 0.00 H new ATOM 0 HD1 TYR A 146 124.348 -15.761 -4.015 1.00 0.00 H new ATOM 0 HD2 TYR A 146 123.787 -12.136 -1.782 1.00 0.00 H new ATOM 0 HE1 TYR A 146 125.438 -14.473 -5.833 1.00 0.00 H new ATOM 0 HE2 TYR A 146 124.878 -10.848 -3.599 1.00 0.00 H new ATOM 0 HH TYR A 146 125.854 -10.910 -5.606 1.00 0.00 H new ATOM 2185 N ARG A 147 121.240 -17.231 -0.894 1.00 0.00 N ATOM 2186 CA ARG A 147 120.654 -18.076 0.147 1.00 0.00 C ATOM 2187 C ARG A 147 121.701 -19.007 0.756 1.00 0.00 C ATOM 2188 O ARG A 147 122.603 -19.482 0.065 1.00 0.00 O ATOM 2189 CB ARG A 147 119.491 -18.885 -0.444 1.00 0.00 C ATOM 2190 CG ARG A 147 119.998 -19.852 -1.521 1.00 0.00 C ATOM 2191 CD ARG A 147 118.807 -20.497 -2.232 1.00 0.00 C ATOM 2192 NE ARG A 147 119.272 -21.516 -3.176 1.00 0.00 N ATOM 2193 CZ ARG A 147 118.533 -22.572 -3.549 1.00 0.00 C ATOM 2194 NH1 ARG A 147 117.321 -22.774 -3.091 1.00 0.00 N ATOM 2195 NH2 ARG A 147 119.037 -23.428 -4.396 1.00 0.00 N ATOM 0 H ARG A 147 121.608 -17.742 -1.696 1.00 0.00 H new ATOM 0 HA ARG A 147 120.278 -17.436 0.946 1.00 0.00 H new ATOM 0 HB2 ARG A 147 118.990 -19.443 0.347 1.00 0.00 H new ATOM 0 HB3 ARG A 147 118.752 -18.209 -0.874 1.00 0.00 H new ATOM 0 HG2 ARG A 147 120.619 -19.318 -2.241 1.00 0.00 H new ATOM 0 HG3 ARG A 147 120.624 -20.621 -1.068 1.00 0.00 H new ATOM 0 HD2 ARG A 147 118.138 -20.948 -1.499 1.00 0.00 H new ATOM 0 HD3 ARG A 147 118.234 -19.735 -2.761 1.00 0.00 H new ATOM 0 HE ARG A 147 120.207 -21.418 -3.571 1.00 0.00 H new ATOM 0 HH11 ARG A 147 116.910 -22.117 -2.428 1.00 0.00 H new ATOM 0 HH12 ARG A 147 116.789 -23.589 -3.398 1.00 0.00 H new ATOM 0 HH21 ARG A 147 119.978 -23.288 -4.763 1.00 0.00 H new ATOM 0 HH22 ARG A 147 118.489 -24.237 -4.691 1.00 0.00 H new ATOM 2209 N PHE A 148 121.571 -19.260 2.054 1.00 0.00 N ATOM 2210 CA PHE A 148 122.498 -20.149 2.746 1.00 0.00 C ATOM 2211 C PHE A 148 122.006 -20.457 4.159 1.00 0.00 C ATOM 2212 O PHE A 148 120.894 -20.069 4.480 1.00 0.00 O ATOM 2213 CB PHE A 148 123.884 -19.505 2.816 1.00 0.00 C ATOM 2214 CG PHE A 148 123.920 -18.235 3.632 1.00 0.00 C ATOM 2215 CD1 PHE A 148 123.580 -17.012 3.040 1.00 0.00 C ATOM 2216 CD2 PHE A 148 124.294 -18.279 4.980 1.00 0.00 C ATOM 2217 CE1 PHE A 148 123.613 -15.835 3.797 1.00 0.00 C ATOM 2218 CE2 PHE A 148 124.327 -17.102 5.737 1.00 0.00 C ATOM 2219 CZ PHE A 148 123.987 -15.880 5.145 1.00 0.00 C ATOM 2220 OXT PHE A 148 122.751 -21.078 4.900 1.00 0.00 O ATOM 0 H PHE A 148 120.839 -18.866 2.645 1.00 0.00 H new ATOM 0 HA PHE A 148 122.556 -21.083 2.187 1.00 0.00 H new ATOM 0 HB2 PHE A 148 124.587 -20.221 3.242 1.00 0.00 H new ATOM 0 HB3 PHE A 148 124.226 -19.287 1.804 1.00 0.00 H new ATOM 0 HD1 PHE A 148 123.292 -16.977 2.000 1.00 0.00 H new ATOM 0 HD2 PHE A 148 124.557 -19.222 5.436 1.00 0.00 H new ATOM 0 HE1 PHE A 148 123.350 -14.892 3.341 1.00 0.00 H new ATOM 0 HE2 PHE A 148 124.615 -17.137 6.777 1.00 0.00 H new ATOM 0 HZ PHE A 148 124.013 -14.972 5.729 1.00 0.00 H new TER 2230 PHE A 148