USER MOD reduce.3.24.130724 H: found=0, std=0, add=1060, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 890 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 127 TYR OH : rot -159:sc= 0.00248 USER MOD Set 1.2: A 129 GLN : amide:sc= -0.234 K(o=-0.23,f=-1.3) USER MOD Set 2.1: A 102 THR OG1 : rot 180:sc=0.000304 USER MOD Set 2.2: A 103 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 78 SER OG : rot 130:sc= 0.0632 USER MOD Set 3.2: A 114 GLN : amide:sc= -5.71! C(o=-5.6!,f=-5.3!) USER MOD Set 4.1: A 25 ASN : amide:sc= -0.124 K(o=0.91,f=-4.1!) USER MOD Set 4.2: A 44 THR OG1 : rot 78:sc= 1.03 USER MOD Set 5.1: A 19 ASN : amide:sc= -0.439 K(o=-0.44,f=-4.6!) USER MOD Set 5.2: A 49 SER OG : rot 123:sc= 0.00183 USER MOD Set 6.1: A 12 SER OG : rot -3:sc= -2.89! USER MOD Set 6.2: A 139 THR OG1 : rot -6:sc= 0.816 USER MOD Single : A 2 THR OG1 : rot -37:sc= 0.127 USER MOD Single : A 3 SER OG : rot 180:sc= -0.934 USER MOD Single : A 4 THR OG1 : rot 180:sc=-0.00344 USER MOD Single : A 6 THR OG1 : rot -20:sc= 0.00226 USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 15 GLN : amide:sc= -0.0111 K(o=-0.011,f=-2!) USER MOD Single : A 17 GLN : amide:sc= -1.83 K(o=-1.8,f=-5.5!) USER MOD Single : A 18 MET CE :methyl -153:sc= -0.319 (180deg=-1.69!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 MET CE :methyl -157:sc= -8.14! (180deg=-9.82!) USER MOD Single : A 27 LYS NZ :NH3+ -133:sc= -0.395 (180deg=-1.9!) USER MOD Single : A 28 TYR OH : rot 8:sc= -3.23! USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 ASN : amide:sc= -0.532 K(o=-0.53,f=-2) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot -116:sc= -2.29 USER MOD Single : A 45 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=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 -65:sc= 0.419 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= -1.1 K(o=-1.1,f=-2!) USER MOD Single : A 59 LYS NZ :NH3+ -156:sc= 0 (180deg=-0.00442) USER MOD Single : A 60 ASN : amide:sc= -0.378 K(o=-0.38,f=-1.9) USER MOD Single : A 61 GLN : amide:sc= 0 K(o=0,f=-1.5) USER MOD Single : A 62 TYR OH : rot 180:sc= -0.0234 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot 180:sc= -1.22 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 TYR OH : rot 4:sc= -1.12 USER MOD Single : A 87 TYR OH : rot -120:sc= 0.501 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0.00254 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 ASN : amide:sc= -0.111 X(o=-0.11,f=-0.14) USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 133:sc= 0.0664 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 116 ASN : amide:sc= -0.101 X(o=-0.1,f=-0.00076) USER MOD Single : A 118 MET CE :methyl -144:sc= -0.29 (180deg=-1.63!) USER MOD Single : A 120 ASN : amide:sc= -1.47 K(o=-1.5,f=-2.6!) USER MOD Single : A 126 SER OG : rot 180:sc= -1.51 USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 134 SER OG : rot 180:sc= -1.14 USER MOD Single : A 146 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 2 125.927 -16.793 0.632 1.00 0.00 N ATOM 2 CA THR A 2 125.881 -16.197 -0.737 1.00 0.00 C ATOM 3 C THR A 2 125.384 -14.750 -0.653 1.00 0.00 C ATOM 4 O THR A 2 124.936 -14.303 0.386 1.00 0.00 O ATOM 5 CB THR A 2 124.890 -17.061 -1.523 1.00 0.00 C ATOM 6 OG1 THR A 2 123.600 -16.949 -0.938 1.00 0.00 O ATOM 7 CG2 THR A 2 125.340 -18.523 -1.498 1.00 0.00 C ATOM 0 HA THR A 2 126.861 -16.178 -1.214 1.00 0.00 H new ATOM 0 HB THR A 2 124.854 -16.717 -2.557 1.00 0.00 H new ATOM 0 HG1 THR A 2 123.686 -16.901 0.037 1.00 0.00 H new ATOM 0 HG21 THR A 2 124.631 -19.132 -2.059 1.00 0.00 H new ATOM 0 HG22 THR A 2 126.328 -18.607 -1.951 1.00 0.00 H new ATOM 0 HG23 THR A 2 125.382 -18.873 -0.467 1.00 0.00 H new ATOM 15 N SER A 3 125.455 -14.018 -1.734 1.00 0.00 N ATOM 16 CA SER A 3 124.978 -12.604 -1.708 1.00 0.00 C ATOM 17 C SER A 3 123.732 -12.465 -2.582 1.00 0.00 C ATOM 18 O SER A 3 123.602 -13.124 -3.595 1.00 0.00 O ATOM 19 CB SER A 3 126.133 -11.784 -2.282 1.00 0.00 C ATOM 20 OG SER A 3 126.335 -12.145 -3.641 1.00 0.00 O ATOM 0 H SER A 3 125.821 -14.337 -2.631 1.00 0.00 H new ATOM 0 HA SER A 3 124.708 -12.272 -0.706 1.00 0.00 H new ATOM 0 HB2 SER A 3 125.912 -10.719 -2.206 1.00 0.00 H new ATOM 0 HB3 SER A 3 127.042 -11.963 -1.707 1.00 0.00 H new ATOM 0 HG SER A 3 127.074 -11.620 -4.013 1.00 0.00 H new ATOM 25 N THR A 4 122.816 -11.614 -2.203 1.00 0.00 N ATOM 26 CA THR A 4 121.580 -11.439 -3.020 1.00 0.00 C ATOM 27 C THR A 4 121.225 -9.954 -3.151 1.00 0.00 C ATOM 28 O THR A 4 121.318 -9.195 -2.206 1.00 0.00 O ATOM 29 CB THR A 4 120.494 -12.191 -2.251 1.00 0.00 C ATOM 30 OG1 THR A 4 120.888 -13.546 -2.085 1.00 0.00 O ATOM 31 CG2 THR A 4 119.177 -12.130 -3.027 1.00 0.00 C ATOM 0 H THR A 4 122.870 -11.034 -1.366 1.00 0.00 H new ATOM 0 HA THR A 4 121.700 -11.817 -4.035 1.00 0.00 H new ATOM 0 HB THR A 4 120.355 -11.729 -1.273 1.00 0.00 H new ATOM 0 HG1 THR A 4 120.194 -14.030 -1.591 1.00 0.00 H new ATOM 0 HG21 THR A 4 118.405 -12.667 -2.476 1.00 0.00 H new ATOM 0 HG22 THR A 4 118.876 -11.090 -3.152 1.00 0.00 H new ATOM 0 HG23 THR A 4 119.310 -12.590 -4.006 1.00 0.00 H new ATOM 39 N VAL A 5 120.808 -9.544 -4.319 1.00 0.00 N ATOM 40 CA VAL A 5 120.428 -8.113 -4.524 1.00 0.00 C ATOM 41 C VAL A 5 119.031 -8.030 -5.147 1.00 0.00 C ATOM 42 O VAL A 5 118.671 -8.831 -5.986 1.00 0.00 O ATOM 43 CB VAL A 5 121.488 -7.544 -5.473 1.00 0.00 C ATOM 44 CG1 VAL A 5 122.868 -7.651 -4.822 1.00 0.00 C ATOM 45 CG2 VAL A 5 121.486 -8.333 -6.785 1.00 0.00 C ATOM 0 H VAL A 5 120.713 -10.138 -5.143 1.00 0.00 H new ATOM 0 HA VAL A 5 120.392 -7.554 -3.589 1.00 0.00 H new ATOM 0 HB VAL A 5 121.259 -6.498 -5.678 1.00 0.00 H new ATOM 0 HG11 VAL A 5 123.621 -7.246 -5.498 1.00 0.00 H new ATOM 0 HG12 VAL A 5 122.875 -7.086 -3.890 1.00 0.00 H new ATOM 0 HG13 VAL A 5 123.092 -8.697 -4.614 1.00 0.00 H new ATOM 0 HG21 VAL A 5 122.241 -7.925 -7.456 1.00 0.00 H new ATOM 0 HG22 VAL A 5 121.710 -9.380 -6.580 1.00 0.00 H new ATOM 0 HG23 VAL A 5 120.505 -8.257 -7.254 1.00 0.00 H new ATOM 55 N THR A 6 118.245 -7.065 -4.743 1.00 0.00 N ATOM 56 CA THR A 6 116.870 -6.925 -5.312 1.00 0.00 C ATOM 57 C THR A 6 116.383 -5.482 -5.163 1.00 0.00 C ATOM 58 O THR A 6 116.456 -4.909 -4.091 1.00 0.00 O ATOM 59 CB THR A 6 116.004 -7.869 -4.475 1.00 0.00 C ATOM 60 OG1 THR A 6 116.542 -9.183 -4.532 1.00 0.00 O ATOM 61 CG2 THR A 6 114.574 -7.874 -5.019 1.00 0.00 C ATOM 0 H THR A 6 118.496 -6.367 -4.043 1.00 0.00 H new ATOM 0 HA THR A 6 116.833 -7.166 -6.374 1.00 0.00 H new ATOM 0 HB THR A 6 115.993 -7.527 -3.440 1.00 0.00 H new ATOM 0 HG1 THR A 6 117.128 -9.263 -5.314 1.00 0.00 H new ATOM 0 HG21 THR A 6 113.960 -8.547 -4.421 1.00 0.00 H new ATOM 0 HG22 THR A 6 114.162 -6.866 -4.969 1.00 0.00 H new ATOM 0 HG23 THR A 6 114.580 -8.212 -6.055 1.00 0.00 H new ATOM 69 N GLY A 7 115.883 -4.886 -6.216 1.00 0.00 N ATOM 70 CA GLY A 7 115.393 -3.480 -6.111 1.00 0.00 C ATOM 71 C GLY A 7 114.546 -3.130 -7.337 1.00 0.00 C ATOM 72 O GLY A 7 114.478 -3.883 -8.290 1.00 0.00 O ATOM 0 H GLY A 7 115.794 -5.311 -7.139 1.00 0.00 H new ATOM 0 HA2 GLY A 7 114.802 -3.359 -5.203 1.00 0.00 H new ATOM 0 HA3 GLY A 7 116.238 -2.796 -6.035 1.00 0.00 H new ATOM 75 N GLY A 8 113.902 -1.990 -7.320 1.00 0.00 N ATOM 76 CA GLY A 8 113.056 -1.588 -8.484 1.00 0.00 C ATOM 77 C GLY A 8 112.500 -0.175 -8.269 1.00 0.00 C ATOM 78 O GLY A 8 113.201 0.722 -7.843 1.00 0.00 O ATOM 0 H GLY A 8 113.926 -1.321 -6.551 1.00 0.00 H new ATOM 0 HA2 GLY A 8 113.646 -1.620 -9.400 1.00 0.00 H new ATOM 0 HA3 GLY A 8 112.236 -2.295 -8.609 1.00 0.00 H new ATOM 81 N TYR A 9 111.240 0.022 -8.565 1.00 0.00 N ATOM 82 CA TYR A 9 110.616 1.371 -8.386 1.00 0.00 C ATOM 83 C TYR A 9 109.280 1.212 -7.662 1.00 0.00 C ATOM 84 O TYR A 9 108.704 0.140 -7.664 1.00 0.00 O ATOM 85 CB TYR A 9 110.405 1.909 -9.802 1.00 0.00 C ATOM 86 CG TYR A 9 111.738 2.021 -10.506 1.00 0.00 C ATOM 87 CD1 TYR A 9 112.556 3.135 -10.285 1.00 0.00 C ATOM 88 CD2 TYR A 9 112.155 1.008 -11.378 1.00 0.00 C ATOM 89 CE1 TYR A 9 113.790 3.237 -10.937 1.00 0.00 C ATOM 90 CE2 TYR A 9 113.389 1.111 -12.031 1.00 0.00 C ATOM 91 CZ TYR A 9 114.207 2.226 -11.810 1.00 0.00 C ATOM 92 OH TYR A 9 115.423 2.328 -12.453 1.00 0.00 O ATOM 0 H TYR A 9 110.612 -0.697 -8.925 1.00 0.00 H new ATOM 0 HA TYR A 9 111.233 2.047 -7.794 1.00 0.00 H new ATOM 0 HB2 TYR A 9 109.743 1.246 -10.359 1.00 0.00 H new ATOM 0 HB3 TYR A 9 109.920 2.884 -9.763 1.00 0.00 H new ATOM 0 HD1 TYR A 9 112.235 3.916 -9.611 1.00 0.00 H new ATOM 0 HD2 TYR A 9 111.525 0.147 -11.547 1.00 0.00 H new ATOM 0 HE1 TYR A 9 114.421 4.097 -10.766 1.00 0.00 H new ATOM 0 HE2 TYR A 9 113.710 0.331 -12.705 1.00 0.00 H new ATOM 0 HH TYR A 9 115.559 1.541 -13.021 1.00 0.00 H new ATOM 101 N ALA A 10 108.776 2.247 -7.033 1.00 0.00 N ATOM 102 CA ALA A 10 107.477 2.083 -6.317 1.00 0.00 C ATOM 103 C ALA A 10 106.619 3.349 -6.374 1.00 0.00 C ATOM 104 O ALA A 10 107.105 4.456 -6.256 1.00 0.00 O ATOM 105 CB ALA A 10 107.872 1.778 -4.873 1.00 0.00 C ATOM 0 H ALA A 10 109.197 3.175 -6.985 1.00 0.00 H new ATOM 0 HA ALA A 10 106.872 1.299 -6.772 1.00 0.00 H new ATOM 0 HB1 ALA A 10 106.974 1.642 -4.271 1.00 0.00 H new ATOM 0 HB2 ALA A 10 108.470 0.867 -4.844 1.00 0.00 H new ATOM 0 HB3 ALA A 10 108.455 2.607 -4.472 1.00 0.00 H new ATOM 111 N GLN A 11 105.332 3.170 -6.506 1.00 0.00 N ATOM 112 CA GLN A 11 104.392 4.326 -6.521 1.00 0.00 C ATOM 113 C GLN A 11 103.567 4.256 -5.237 1.00 0.00 C ATOM 114 O GLN A 11 103.297 3.176 -4.744 1.00 0.00 O ATOM 115 CB GLN A 11 103.509 4.120 -7.753 1.00 0.00 C ATOM 116 CG GLN A 11 104.369 4.188 -9.016 1.00 0.00 C ATOM 117 CD GLN A 11 103.496 3.933 -10.249 1.00 0.00 C ATOM 118 OE1 GLN A 11 102.427 3.366 -10.144 1.00 0.00 O ATOM 119 NE2 GLN A 11 103.910 4.334 -11.419 1.00 0.00 N ATOM 0 H GLN A 11 104.887 2.258 -6.605 1.00 0.00 H new ATOM 0 HA GLN A 11 104.886 5.297 -6.567 1.00 0.00 H new ATOM 0 HB2 GLN A 11 103.005 3.155 -7.695 1.00 0.00 H new ATOM 0 HB3 GLN A 11 102.732 4.884 -7.788 1.00 0.00 H new ATOM 0 HG2 GLN A 11 104.845 5.166 -9.091 1.00 0.00 H new ATOM 0 HG3 GLN A 11 105.167 3.448 -8.964 1.00 0.00 H new ATOM 0 HE21 GLN A 11 104.808 4.810 -11.507 1.00 0.00 H new ATOM 0 HE22 GLN A 11 103.336 4.172 -12.246 1.00 0.00 H new ATOM 126 N SER A 12 103.196 5.368 -4.658 1.00 0.00 N ATOM 127 CA SER A 12 102.432 5.282 -3.380 1.00 0.00 C ATOM 128 C SER A 12 101.404 6.404 -3.224 1.00 0.00 C ATOM 129 O SER A 12 101.585 7.509 -3.700 1.00 0.00 O ATOM 130 CB SER A 12 103.509 5.408 -2.301 1.00 0.00 C ATOM 131 OG SER A 12 102.946 5.141 -1.022 1.00 0.00 O ATOM 0 H SER A 12 103.383 6.309 -5.004 1.00 0.00 H new ATOM 0 HA SER A 12 101.856 4.358 -3.328 1.00 0.00 H new ATOM 0 HB2 SER A 12 104.322 4.711 -2.503 1.00 0.00 H new ATOM 0 HB3 SER A 12 103.937 6.410 -2.318 1.00 0.00 H new ATOM 0 HG SER A 12 101.982 4.991 -1.114 1.00 0.00 H new ATOM 136 N ASP A 13 100.346 6.125 -2.507 1.00 0.00 N ATOM 137 CA ASP A 13 99.308 7.157 -2.241 1.00 0.00 C ATOM 138 C ASP A 13 99.549 7.681 -0.829 1.00 0.00 C ATOM 139 O ASP A 13 100.060 6.963 0.007 1.00 0.00 O ATOM 140 CB ASP A 13 97.967 6.424 -2.336 1.00 0.00 C ATOM 141 CG ASP A 13 97.751 5.915 -3.766 1.00 0.00 C ATOM 142 OD1 ASP A 13 98.396 6.429 -4.666 1.00 0.00 O ATOM 143 OD2 ASP A 13 96.939 5.021 -3.935 1.00 0.00 O ATOM 0 H ASP A 13 100.158 5.213 -2.091 1.00 0.00 H new ATOM 0 HA ASP A 13 99.328 7.997 -2.935 1.00 0.00 H new ATOM 0 HB2 ASP A 13 97.949 5.588 -1.637 1.00 0.00 H new ATOM 0 HB3 ASP A 13 97.155 7.094 -2.053 1.00 0.00 H new ATOM 147 N ALA A 14 99.216 8.909 -0.541 1.00 0.00 N ATOM 148 CA ALA A 14 99.480 9.423 0.828 1.00 0.00 C ATOM 149 C ALA A 14 98.280 10.171 1.393 1.00 0.00 C ATOM 150 O ALA A 14 97.888 11.212 0.901 1.00 0.00 O ATOM 151 CB ALA A 14 100.671 10.364 0.668 1.00 0.00 C ATOM 0 H ALA A 14 98.779 9.569 -1.185 1.00 0.00 H new ATOM 0 HA ALA A 14 99.678 8.610 1.527 1.00 0.00 H new ATOM 0 HB1 ALA A 14 100.932 10.789 1.637 1.00 0.00 H new ATOM 0 HB2 ALA A 14 101.522 9.809 0.274 1.00 0.00 H new ATOM 0 HB3 ALA A 14 100.410 11.167 -0.021 1.00 0.00 H new ATOM 157 N GLN A 15 97.722 9.653 2.449 1.00 0.00 N ATOM 158 CA GLN A 15 96.568 10.332 3.095 1.00 0.00 C ATOM 159 C GLN A 15 97.060 11.647 3.695 1.00 0.00 C ATOM 160 O GLN A 15 97.926 11.662 4.557 1.00 0.00 O ATOM 161 CB GLN A 15 96.096 9.377 4.194 1.00 0.00 C ATOM 162 CG GLN A 15 94.830 9.936 4.848 1.00 0.00 C ATOM 163 CD GLN A 15 94.337 8.969 5.930 1.00 0.00 C ATOM 164 OE1 GLN A 15 94.836 7.867 6.056 1.00 0.00 O ATOM 165 NE2 GLN A 15 93.369 9.339 6.723 1.00 0.00 N ATOM 0 H GLN A 15 98.017 8.784 2.894 1.00 0.00 H new ATOM 0 HA GLN A 15 95.758 10.557 2.401 1.00 0.00 H new ATOM 0 HB2 GLN A 15 95.896 8.392 3.773 1.00 0.00 H new ATOM 0 HB3 GLN A 15 96.879 9.251 4.942 1.00 0.00 H new ATOM 0 HG2 GLN A 15 95.036 10.913 5.286 1.00 0.00 H new ATOM 0 HG3 GLN A 15 94.054 10.081 4.096 1.00 0.00 H new ATOM 0 HE21 GLN A 15 92.949 10.263 6.619 1.00 0.00 H new ATOM 0 HE22 GLN A 15 93.032 8.704 7.447 1.00 0.00 H new ATOM 172 N GLY A 16 96.545 12.745 3.209 1.00 0.00 N ATOM 173 CA GLY A 16 96.996 14.082 3.690 1.00 0.00 C ATOM 174 C GLY A 16 97.844 14.749 2.592 1.00 0.00 C ATOM 175 O GLY A 16 98.090 15.940 2.623 1.00 0.00 O ATOM 0 H GLY A 16 95.822 12.772 2.490 1.00 0.00 H new ATOM 0 HA2 GLY A 16 96.135 14.705 3.932 1.00 0.00 H new ATOM 0 HA3 GLY A 16 97.580 13.976 4.604 1.00 0.00 H new ATOM 178 N GLN A 17 98.266 13.989 1.606 1.00 0.00 N ATOM 179 CA GLN A 17 99.065 14.569 0.485 1.00 0.00 C ATOM 180 C GLN A 17 98.261 14.468 -0.818 1.00 0.00 C ATOM 181 O GLN A 17 97.373 13.646 -0.938 1.00 0.00 O ATOM 182 CB GLN A 17 100.335 13.724 0.406 1.00 0.00 C ATOM 183 CG GLN A 17 101.113 13.848 1.720 1.00 0.00 C ATOM 184 CD GLN A 17 102.406 13.031 1.640 1.00 0.00 C ATOM 185 OE1 GLN A 17 102.613 12.283 0.704 1.00 0.00 O ATOM 186 NE2 GLN A 17 103.292 13.143 2.591 1.00 0.00 N ATOM 0 H GLN A 17 98.088 12.987 1.533 1.00 0.00 H new ATOM 0 HA GLN A 17 99.303 15.621 0.642 1.00 0.00 H new ATOM 0 HB2 GLN A 17 100.080 12.681 0.219 1.00 0.00 H new ATOM 0 HB3 GLN A 17 100.954 14.055 -0.428 1.00 0.00 H new ATOM 0 HG2 GLN A 17 101.346 14.894 1.918 1.00 0.00 H new ATOM 0 HG3 GLN A 17 100.501 13.495 2.550 1.00 0.00 H new ATOM 0 HE21 GLN A 17 103.120 13.770 3.377 1.00 0.00 H new ATOM 0 HE22 GLN A 17 104.157 12.604 2.549 1.00 0.00 H new ATOM 193 N MET A 18 98.550 15.299 -1.785 1.00 0.00 N ATOM 194 CA MET A 18 97.782 15.248 -3.067 1.00 0.00 C ATOM 195 C MET A 18 98.559 14.502 -4.163 1.00 0.00 C ATOM 196 O MET A 18 98.238 13.381 -4.509 1.00 0.00 O ATOM 197 CB MET A 18 97.576 16.713 -3.457 1.00 0.00 C ATOM 198 CG MET A 18 96.664 17.392 -2.433 1.00 0.00 C ATOM 199 SD MET A 18 96.279 19.070 -2.988 1.00 0.00 S ATOM 200 CE MET A 18 97.981 19.685 -3.053 1.00 0.00 C ATOM 0 H MET A 18 99.281 16.009 -1.744 1.00 0.00 H new ATOM 0 HA MET A 18 96.841 14.710 -2.949 1.00 0.00 H new ATOM 0 HB2 MET A 18 98.536 17.227 -3.501 1.00 0.00 H new ATOM 0 HB3 MET A 18 97.134 16.777 -4.451 1.00 0.00 H new ATOM 0 HG2 MET A 18 95.745 16.818 -2.311 1.00 0.00 H new ATOM 0 HG3 MET A 18 97.152 17.423 -1.459 1.00 0.00 H new ATOM 0 HE1 MET A 18 97.984 20.764 -2.901 1.00 0.00 H new ATOM 0 HE2 MET A 18 98.571 19.207 -2.271 1.00 0.00 H new ATOM 0 HE3 MET A 18 98.414 19.455 -4.026 1.00 0.00 H new ATOM 208 N ASN A 19 99.556 15.130 -4.730 1.00 0.00 N ATOM 209 CA ASN A 19 100.338 14.480 -5.830 1.00 0.00 C ATOM 210 C ASN A 19 100.944 13.146 -5.378 1.00 0.00 C ATOM 211 O ASN A 19 101.554 13.049 -4.331 1.00 0.00 O ATOM 212 CB ASN A 19 101.446 15.481 -6.171 1.00 0.00 C ATOM 213 CG ASN A 19 102.064 15.127 -7.527 1.00 0.00 C ATOM 214 OD1 ASN A 19 101.810 14.070 -8.070 1.00 0.00 O ATOM 215 ND2 ASN A 19 102.869 15.978 -8.102 1.00 0.00 N ATOM 0 H ASN A 19 99.865 16.069 -4.479 1.00 0.00 H new ATOM 0 HA ASN A 19 99.704 14.249 -6.686 1.00 0.00 H new ATOM 0 HB2 ASN A 19 101.040 16.492 -6.199 1.00 0.00 H new ATOM 0 HB3 ASN A 19 102.213 15.467 -5.396 1.00 0.00 H new ATOM 0 HD21 ASN A 19 103.285 15.756 -9.007 1.00 0.00 H new ATOM 0 HD22 ASN A 19 103.083 16.865 -7.647 1.00 0.00 H new ATOM 221 N LYS A 20 100.780 12.119 -6.176 1.00 0.00 N ATOM 222 CA LYS A 20 101.345 10.781 -5.820 1.00 0.00 C ATOM 223 C LYS A 20 102.875 10.850 -5.762 1.00 0.00 C ATOM 224 O LYS A 20 103.472 11.833 -6.157 1.00 0.00 O ATOM 225 CB LYS A 20 100.876 9.836 -6.935 1.00 0.00 C ATOM 226 CG LYS A 20 101.494 10.253 -8.274 1.00 0.00 C ATOM 227 CD LYS A 20 100.916 9.389 -9.396 1.00 0.00 C ATOM 228 CE LYS A 20 101.733 9.594 -10.674 1.00 0.00 C ATOM 229 NZ LYS A 20 100.970 10.605 -11.459 1.00 0.00 N ATOM 0 H LYS A 20 100.277 12.151 -7.063 1.00 0.00 H new ATOM 0 HA LYS A 20 101.012 10.438 -4.840 1.00 0.00 H new ATOM 0 HB2 LYS A 20 101.161 8.811 -6.698 1.00 0.00 H new ATOM 0 HB3 LYS A 20 99.788 9.856 -7.006 1.00 0.00 H new ATOM 0 HG2 LYS A 20 101.289 11.306 -8.469 1.00 0.00 H new ATOM 0 HG3 LYS A 20 102.578 10.141 -8.237 1.00 0.00 H new ATOM 0 HD2 LYS A 20 100.933 8.339 -9.106 1.00 0.00 H new ATOM 0 HD3 LYS A 20 99.873 9.654 -9.572 1.00 0.00 H new ATOM 0 HE2 LYS A 20 102.739 9.947 -10.447 1.00 0.00 H new ATOM 0 HE3 LYS A 20 101.840 8.662 -11.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 101.467 10.799 -12.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 100.019 10.239 -11.665 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 100.890 11.484 -10.909 1.00 0.00 H new ATOM 239 N MET A 21 103.513 9.826 -5.253 1.00 0.00 N ATOM 240 CA MET A 21 105.003 9.853 -5.153 1.00 0.00 C ATOM 241 C MET A 21 105.630 8.598 -5.776 1.00 0.00 C ATOM 242 O MET A 21 104.963 7.618 -6.044 1.00 0.00 O ATOM 243 CB MET A 21 105.284 9.898 -3.651 1.00 0.00 C ATOM 244 CG MET A 21 104.718 11.193 -3.063 1.00 0.00 C ATOM 245 SD MET A 21 105.163 11.310 -1.312 1.00 0.00 S ATOM 246 CE MET A 21 106.910 11.724 -1.539 1.00 0.00 C ATOM 0 H MET A 21 103.069 8.977 -4.904 1.00 0.00 H new ATOM 0 HA MET A 21 105.429 10.701 -5.689 1.00 0.00 H new ATOM 0 HB2 MET A 21 104.833 9.036 -3.160 1.00 0.00 H new ATOM 0 HB3 MET A 21 106.357 9.843 -3.469 1.00 0.00 H new ATOM 0 HG2 MET A 21 105.110 12.053 -3.606 1.00 0.00 H new ATOM 0 HG3 MET A 21 103.634 11.212 -3.175 1.00 0.00 H new ATOM 0 HE1 MET A 21 107.468 11.450 -0.644 1.00 0.00 H new ATOM 0 HE2 MET A 21 107.305 11.177 -2.395 1.00 0.00 H new ATOM 0 HE3 MET A 21 107.010 12.795 -1.715 1.00 0.00 H new ATOM 254 N GLY A 22 106.921 8.633 -5.988 1.00 0.00 N ATOM 255 CA GLY A 22 107.634 7.456 -6.574 1.00 0.00 C ATOM 256 C GLY A 22 108.768 7.073 -5.624 1.00 0.00 C ATOM 257 O GLY A 22 108.963 7.726 -4.620 1.00 0.00 O ATOM 0 H GLY A 22 107.517 9.434 -5.778 1.00 0.00 H new ATOM 0 HA2 GLY A 22 106.947 6.620 -6.705 1.00 0.00 H new ATOM 0 HA3 GLY A 22 108.029 7.701 -7.560 1.00 0.00 H new ATOM 260 N GLY A 23 109.528 6.044 -5.920 1.00 0.00 N ATOM 261 CA GLY A 23 110.641 5.687 -4.990 1.00 0.00 C ATOM 262 C GLY A 23 111.486 4.533 -5.529 1.00 0.00 C ATOM 263 O GLY A 23 111.001 3.641 -6.197 1.00 0.00 O ATOM 0 H GLY A 23 109.429 5.451 -6.744 1.00 0.00 H new ATOM 0 HA2 GLY A 23 111.276 6.559 -4.832 1.00 0.00 H new ATOM 0 HA3 GLY A 23 110.229 5.413 -4.019 1.00 0.00 H new ATOM 266 N PHE A 24 112.754 4.546 -5.208 1.00 0.00 N ATOM 267 CA PHE A 24 113.670 3.455 -5.653 1.00 0.00 C ATOM 268 C PHE A 24 114.055 2.608 -4.437 1.00 0.00 C ATOM 269 O PHE A 24 114.378 3.136 -3.388 1.00 0.00 O ATOM 270 CB PHE A 24 114.895 4.170 -6.224 1.00 0.00 C ATOM 271 CG PHE A 24 115.859 3.153 -6.786 1.00 0.00 C ATOM 272 CD1 PHE A 24 115.687 2.671 -8.089 1.00 0.00 C ATOM 273 CD2 PHE A 24 116.924 2.692 -6.004 1.00 0.00 C ATOM 274 CE1 PHE A 24 116.582 1.728 -8.610 1.00 0.00 C ATOM 275 CE2 PHE A 24 117.819 1.749 -6.524 1.00 0.00 C ATOM 276 CZ PHE A 24 117.648 1.268 -7.827 1.00 0.00 C ATOM 0 H PHE A 24 113.198 5.275 -4.650 1.00 0.00 H new ATOM 0 HA PHE A 24 113.219 2.792 -6.391 1.00 0.00 H new ATOM 0 HB2 PHE A 24 114.591 4.867 -7.004 1.00 0.00 H new ATOM 0 HB3 PHE A 24 115.382 4.756 -5.445 1.00 0.00 H new ATOM 0 HD1 PHE A 24 114.865 3.026 -8.692 1.00 0.00 H new ATOM 0 HD2 PHE A 24 117.056 3.064 -4.999 1.00 0.00 H new ATOM 0 HE1 PHE A 24 116.450 1.356 -9.615 1.00 0.00 H new ATOM 0 HE2 PHE A 24 118.641 1.393 -5.920 1.00 0.00 H new ATOM 0 HZ PHE A 24 118.339 0.542 -8.229 1.00 0.00 H new ATOM 285 N ASN A 25 114.001 1.305 -4.552 1.00 0.00 N ATOM 286 CA ASN A 25 114.343 0.446 -3.378 1.00 0.00 C ATOM 287 C ASN A 25 115.513 -0.496 -3.682 1.00 0.00 C ATOM 288 O ASN A 25 115.499 -1.231 -4.647 1.00 0.00 O ATOM 289 CB ASN A 25 113.073 -0.364 -3.108 1.00 0.00 C ATOM 290 CG ASN A 25 111.927 0.582 -2.742 1.00 0.00 C ATOM 291 OD1 ASN A 25 112.149 1.736 -2.435 1.00 0.00 O ATOM 292 ND2 ASN A 25 110.700 0.141 -2.765 1.00 0.00 N ATOM 0 H ASN A 25 113.737 0.803 -5.400 1.00 0.00 H new ATOM 0 HA ASN A 25 114.655 1.048 -2.524 1.00 0.00 H new ATOM 0 HB2 ASN A 25 112.808 -0.948 -3.989 1.00 0.00 H new ATOM 0 HB3 ASN A 25 113.247 -1.072 -2.297 1.00 0.00 H new ATOM 0 HD21 ASN A 25 109.929 0.765 -2.526 1.00 0.00 H new ATOM 0 HD22 ASN A 25 110.511 -0.828 -3.023 1.00 0.00 H new ATOM 298 N LEU A 26 116.509 -0.495 -2.836 1.00 0.00 N ATOM 299 CA LEU A 26 117.677 -1.409 -3.024 1.00 0.00 C ATOM 300 C LEU A 26 117.779 -2.276 -1.773 1.00 0.00 C ATOM 301 O LEU A 26 117.668 -1.766 -0.673 1.00 0.00 O ATOM 302 CB LEU A 26 118.894 -0.491 -3.155 1.00 0.00 C ATOM 303 CG LEU A 26 120.140 -1.330 -3.444 1.00 0.00 C ATOM 304 CD1 LEU A 26 120.096 -1.830 -4.889 1.00 0.00 C ATOM 305 CD2 LEU A 26 121.389 -0.470 -3.240 1.00 0.00 C ATOM 0 H LEU A 26 116.565 0.106 -2.014 1.00 0.00 H new ATOM 0 HA LEU A 26 117.595 -2.060 -3.895 1.00 0.00 H new ATOM 0 HB2 LEU A 26 118.734 0.230 -3.957 1.00 0.00 H new ATOM 0 HB3 LEU A 26 119.032 0.080 -2.237 1.00 0.00 H new ATOM 0 HG LEU A 26 120.169 -2.183 -2.766 1.00 0.00 H new ATOM 0 HD11 LEU A 26 120.984 -2.428 -5.094 1.00 0.00 H new ATOM 0 HD12 LEU A 26 119.205 -2.441 -5.036 1.00 0.00 H new ATOM 0 HD13 LEU A 26 120.067 -0.978 -5.568 1.00 0.00 H new ATOM 0 HD21 LEU A 26 122.278 -1.066 -3.445 1.00 0.00 H new ATOM 0 HD22 LEU A 26 121.359 0.382 -3.919 1.00 0.00 H new ATOM 0 HD23 LEU A 26 121.421 -0.113 -2.211 1.00 0.00 H new ATOM 316 N LYS A 27 117.953 -3.573 -1.888 1.00 0.00 N ATOM 317 CA LYS A 27 118.011 -4.399 -0.646 1.00 0.00 C ATOM 318 C LYS A 27 119.146 -5.426 -0.709 1.00 0.00 C ATOM 319 O LYS A 27 119.454 -5.969 -1.751 1.00 0.00 O ATOM 320 CB LYS A 27 116.664 -5.130 -0.604 1.00 0.00 C ATOM 321 CG LYS A 27 115.514 -4.126 -0.723 1.00 0.00 C ATOM 322 CD LYS A 27 114.181 -4.853 -0.536 1.00 0.00 C ATOM 323 CE LYS A 27 113.026 -3.885 -0.810 1.00 0.00 C ATOM 324 NZ LYS A 27 112.098 -4.637 -1.701 1.00 0.00 N ATOM 0 H LYS A 27 118.055 -4.082 -2.766 1.00 0.00 H new ATOM 0 HA LYS A 27 118.195 -3.782 0.233 1.00 0.00 H new ATOM 0 HB2 LYS A 27 116.610 -5.854 -1.417 1.00 0.00 H new ATOM 0 HB3 LYS A 27 116.574 -5.689 0.328 1.00 0.00 H new ATOM 0 HG2 LYS A 27 115.622 -3.343 0.027 1.00 0.00 H new ATOM 0 HG3 LYS A 27 115.541 -3.639 -1.698 1.00 0.00 H new ATOM 0 HD2 LYS A 27 114.122 -5.706 -1.212 1.00 0.00 H new ATOM 0 HD3 LYS A 27 114.108 -5.245 0.479 1.00 0.00 H new ATOM 0 HE2 LYS A 27 112.532 -3.588 0.115 1.00 0.00 H new ATOM 0 HE3 LYS A 27 113.381 -2.972 -1.289 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 111.818 -4.033 -2.500 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 112.575 -5.488 -2.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 111.251 -4.915 -1.165 1.00 0.00 H new ATOM 334 N TYR A 28 119.739 -5.719 0.418 1.00 0.00 N ATOM 335 CA TYR A 28 120.827 -6.740 0.461 1.00 0.00 C ATOM 336 C TYR A 28 120.352 -7.912 1.325 1.00 0.00 C ATOM 337 O TYR A 28 119.871 -7.712 2.423 1.00 0.00 O ATOM 338 CB TYR A 28 122.019 -6.036 1.113 1.00 0.00 C ATOM 339 CG TYR A 28 122.437 -4.857 0.267 1.00 0.00 C ATOM 340 CD1 TYR A 28 123.264 -5.052 -0.846 1.00 0.00 C ATOM 341 CD2 TYR A 28 122.001 -3.568 0.597 1.00 0.00 C ATOM 342 CE1 TYR A 28 123.654 -3.960 -1.629 1.00 0.00 C ATOM 343 CE2 TYR A 28 122.390 -2.475 -0.187 1.00 0.00 C ATOM 344 CZ TYR A 28 123.217 -2.671 -1.300 1.00 0.00 C ATOM 345 OH TYR A 28 123.602 -1.594 -2.072 1.00 0.00 O ATOM 0 H TYR A 28 119.515 -5.292 1.317 1.00 0.00 H new ATOM 0 HA TYR A 28 121.093 -7.128 -0.522 1.00 0.00 H new ATOM 0 HB2 TYR A 28 121.752 -5.701 2.115 1.00 0.00 H new ATOM 0 HB3 TYR A 28 122.851 -6.732 1.221 1.00 0.00 H new ATOM 0 HD1 TYR A 28 123.601 -6.046 -1.100 1.00 0.00 H new ATOM 0 HD2 TYR A 28 121.365 -3.417 1.456 1.00 0.00 H new ATOM 0 HE1 TYR A 28 124.292 -4.111 -2.487 1.00 0.00 H new ATOM 0 HE2 TYR A 28 122.052 -1.481 0.067 1.00 0.00 H new ATOM 0 HH TYR A 28 124.067 -1.915 -2.872 1.00 0.00 H new ATOM 354 N ARG A 29 120.455 -9.125 0.841 1.00 0.00 N ATOM 355 CA ARG A 29 119.970 -10.282 1.656 1.00 0.00 C ATOM 356 C ARG A 29 121.029 -11.381 1.784 1.00 0.00 C ATOM 357 O ARG A 29 121.660 -11.780 0.823 1.00 0.00 O ATOM 358 CB ARG A 29 118.740 -10.799 0.907 1.00 0.00 C ATOM 359 CG ARG A 29 118.093 -11.937 1.701 1.00 0.00 C ATOM 360 CD ARG A 29 116.846 -12.429 0.962 1.00 0.00 C ATOM 361 NE ARG A 29 117.363 -13.083 -0.271 1.00 0.00 N ATOM 362 CZ ARG A 29 116.629 -13.114 -1.350 1.00 0.00 C ATOM 363 NH1 ARG A 29 116.328 -12.004 -1.968 1.00 0.00 N ATOM 364 NH2 ARG A 29 116.195 -14.255 -1.811 1.00 0.00 N ATOM 0 H ARG A 29 120.848 -9.363 -0.070 1.00 0.00 H new ATOM 0 HA ARG A 29 119.742 -9.979 2.678 1.00 0.00 H new ATOM 0 HB2 ARG A 29 118.024 -9.990 0.763 1.00 0.00 H new ATOM 0 HB3 ARG A 29 119.027 -11.151 -0.084 1.00 0.00 H new ATOM 0 HG2 ARG A 29 118.801 -12.756 1.827 1.00 0.00 H new ATOM 0 HG3 ARG A 29 117.825 -11.592 2.699 1.00 0.00 H new ATOM 0 HD2 ARG A 29 116.277 -13.130 1.572 1.00 0.00 H new ATOM 0 HD3 ARG A 29 116.178 -11.602 0.720 1.00 0.00 H new ATOM 0 HE ARG A 29 118.291 -13.507 -0.273 1.00 0.00 H new ATOM 0 HH11 ARG A 29 116.666 -11.112 -1.608 1.00 0.00 H new ATOM 0 HH12 ARG A 29 115.754 -12.029 -2.811 1.00 0.00 H new ATOM 0 HH21 ARG A 29 116.429 -15.122 -1.328 1.00 0.00 H new ATOM 0 HH22 ARG A 29 115.621 -14.279 -2.654 1.00 0.00 H new ATOM 375 N TYR A 30 121.204 -11.872 2.982 1.00 0.00 N ATOM 376 CA TYR A 30 122.196 -12.958 3.231 1.00 0.00 C ATOM 377 C TYR A 30 121.501 -14.143 3.911 1.00 0.00 C ATOM 378 O TYR A 30 120.666 -13.965 4.775 1.00 0.00 O ATOM 379 CB TYR A 30 123.242 -12.341 4.161 1.00 0.00 C ATOM 380 CG TYR A 30 123.920 -11.187 3.460 1.00 0.00 C ATOM 381 CD1 TYR A 30 124.969 -11.430 2.567 1.00 0.00 C ATOM 382 CD2 TYR A 30 123.499 -9.874 3.705 1.00 0.00 C ATOM 383 CE1 TYR A 30 125.598 -10.361 1.917 1.00 0.00 C ATOM 384 CE2 TYR A 30 124.128 -8.805 3.055 1.00 0.00 C ATOM 385 CZ TYR A 30 125.178 -9.049 2.162 1.00 0.00 C ATOM 386 OH TYR A 30 125.798 -7.996 1.522 1.00 0.00 O ATOM 0 H TYR A 30 120.695 -11.562 3.810 1.00 0.00 H new ATOM 0 HA TYR A 30 122.648 -13.330 2.312 1.00 0.00 H new ATOM 0 HB2 TYR A 30 122.769 -11.995 5.080 1.00 0.00 H new ATOM 0 HB3 TYR A 30 123.979 -13.092 4.446 1.00 0.00 H new ATOM 0 HD1 TYR A 30 125.294 -12.443 2.379 1.00 0.00 H new ATOM 0 HD2 TYR A 30 122.690 -9.686 4.395 1.00 0.00 H new ATOM 0 HE1 TYR A 30 126.407 -10.549 1.227 1.00 0.00 H new ATOM 0 HE2 TYR A 30 123.803 -7.792 3.243 1.00 0.00 H new ATOM 0 HH TYR A 30 125.385 -7.153 1.803 1.00 0.00 H new ATOM 395 N GLU A 31 121.837 -15.348 3.534 1.00 0.00 N ATOM 396 CA GLU A 31 121.191 -16.536 4.168 1.00 0.00 C ATOM 397 C GLU A 31 122.213 -17.659 4.354 1.00 0.00 C ATOM 398 O GLU A 31 123.156 -17.782 3.595 1.00 0.00 O ATOM 399 CB GLU A 31 120.092 -16.956 3.192 1.00 0.00 C ATOM 400 CG GLU A 31 119.262 -18.083 3.811 1.00 0.00 C ATOM 401 CD GLU A 31 118.184 -18.544 2.822 1.00 0.00 C ATOM 402 OE1 GLU A 31 118.022 -17.896 1.800 1.00 0.00 O ATOM 403 OE2 GLU A 31 117.532 -19.534 3.109 1.00 0.00 O ATOM 0 H GLU A 31 122.529 -15.562 2.816 1.00 0.00 H new ATOM 0 HA GLU A 31 120.790 -16.312 5.157 1.00 0.00 H new ATOM 0 HB2 GLU A 31 119.452 -16.104 2.960 1.00 0.00 H new ATOM 0 HB3 GLU A 31 120.533 -17.289 2.252 1.00 0.00 H new ATOM 0 HG2 GLU A 31 119.909 -18.920 4.073 1.00 0.00 H new ATOM 0 HG3 GLU A 31 118.797 -17.738 4.734 1.00 0.00 H new ATOM 408 N GLU A 32 122.036 -18.479 5.360 1.00 0.00 N ATOM 409 CA GLU A 32 122.999 -19.591 5.593 1.00 0.00 C ATOM 410 C GLU A 32 122.421 -20.898 5.040 1.00 0.00 C ATOM 411 O GLU A 32 121.273 -21.228 5.269 1.00 0.00 O ATOM 412 CB GLU A 32 123.152 -19.654 7.114 1.00 0.00 C ATOM 413 CG GLU A 32 124.338 -20.551 7.480 1.00 0.00 C ATOM 414 CD GLU A 32 124.447 -20.681 9.004 1.00 0.00 C ATOM 415 OE1 GLU A 32 123.569 -20.186 9.694 1.00 0.00 O ATOM 416 OE2 GLU A 32 125.411 -21.278 9.457 1.00 0.00 O ATOM 0 H GLU A 32 121.267 -18.424 6.027 1.00 0.00 H new ATOM 0 HA GLU A 32 123.958 -19.438 5.098 1.00 0.00 H new ATOM 0 HB2 GLU A 32 123.305 -18.652 7.515 1.00 0.00 H new ATOM 0 HB3 GLU A 32 122.238 -20.042 7.565 1.00 0.00 H new ATOM 0 HG2 GLU A 32 124.212 -21.536 7.031 1.00 0.00 H new ATOM 0 HG3 GLU A 32 125.260 -20.132 7.076 1.00 0.00 H new ATOM 421 N ASP A 33 123.207 -21.633 4.302 1.00 0.00 N ATOM 422 CA ASP A 33 122.717 -22.915 3.705 1.00 0.00 C ATOM 423 C ASP A 33 122.194 -23.867 4.787 1.00 0.00 C ATOM 424 O ASP A 33 121.397 -24.744 4.514 1.00 0.00 O ATOM 425 CB ASP A 33 123.938 -23.523 3.010 1.00 0.00 C ATOM 426 CG ASP A 33 124.354 -22.648 1.820 1.00 0.00 C ATOM 427 OD1 ASP A 33 123.554 -21.829 1.397 1.00 0.00 O ATOM 428 OD2 ASP A 33 125.468 -22.815 1.352 1.00 0.00 O ATOM 0 H ASP A 33 124.176 -21.401 4.083 1.00 0.00 H new ATOM 0 HA ASP A 33 121.889 -22.744 3.017 1.00 0.00 H new ATOM 0 HB2 ASP A 33 124.764 -23.608 3.716 1.00 0.00 H new ATOM 0 HB3 ASP A 33 123.707 -24.532 2.667 1.00 0.00 H new ATOM 432 N ASN A 34 122.648 -23.718 6.002 1.00 0.00 N ATOM 433 CA ASN A 34 122.188 -24.637 7.089 1.00 0.00 C ATOM 434 C ASN A 34 120.669 -24.539 7.284 1.00 0.00 C ATOM 435 O ASN A 34 120.003 -25.536 7.488 1.00 0.00 O ATOM 436 CB ASN A 34 122.920 -24.171 8.348 1.00 0.00 C ATOM 437 CG ASN A 34 124.424 -24.416 8.189 1.00 0.00 C ATOM 438 OD1 ASN A 34 124.844 -25.162 7.326 1.00 0.00 O ATOM 439 ND2 ASN A 34 125.258 -23.817 8.993 1.00 0.00 N ATOM 0 H ASN A 34 123.315 -23.003 6.291 1.00 0.00 H new ATOM 0 HA ASN A 34 122.404 -25.679 6.852 1.00 0.00 H new ATOM 0 HB2 ASN A 34 122.730 -23.112 8.520 1.00 0.00 H new ATOM 0 HB3 ASN A 34 122.544 -24.708 9.219 1.00 0.00 H new ATOM 0 HD21 ASN A 34 126.261 -23.975 8.897 1.00 0.00 H new ATOM 0 HD22 ASN A 34 124.907 -23.191 9.718 1.00 0.00 H new ATOM 445 N SER A 35 120.117 -23.355 7.227 1.00 0.00 N ATOM 446 CA SER A 35 118.643 -23.210 7.415 1.00 0.00 C ATOM 447 C SER A 35 118.076 -22.163 6.445 1.00 0.00 C ATOM 448 O SER A 35 118.823 -21.416 5.843 1.00 0.00 O ATOM 449 CB SER A 35 118.472 -22.748 8.862 1.00 0.00 C ATOM 450 OG SER A 35 118.082 -23.854 9.666 1.00 0.00 O ATOM 0 H SER A 35 120.621 -22.485 7.059 1.00 0.00 H new ATOM 0 HA SER A 35 118.112 -24.141 7.217 1.00 0.00 H new ATOM 0 HB2 SER A 35 119.405 -22.325 9.233 1.00 0.00 H new ATOM 0 HB3 SER A 35 117.721 -21.960 8.918 1.00 0.00 H new ATOM 0 HG SER A 35 117.973 -23.561 10.595 1.00 0.00 H new ATOM 455 N PRO A 36 116.767 -22.137 6.327 1.00 0.00 N ATOM 456 CA PRO A 36 116.104 -21.165 5.427 1.00 0.00 C ATOM 457 C PRO A 36 115.899 -19.813 6.129 1.00 0.00 C ATOM 458 O PRO A 36 114.860 -19.195 6.004 1.00 0.00 O ATOM 459 CB PRO A 36 114.760 -21.821 5.131 1.00 0.00 C ATOM 460 CG PRO A 36 114.485 -22.727 6.297 1.00 0.00 C ATOM 461 CD PRO A 36 115.792 -23.001 7.004 1.00 0.00 C ATOM 0 HA PRO A 36 116.688 -20.952 4.532 1.00 0.00 H new ATOM 0 HB2 PRO A 36 113.975 -21.073 5.022 1.00 0.00 H new ATOM 0 HB3 PRO A 36 114.796 -22.383 4.198 1.00 0.00 H new ATOM 0 HG2 PRO A 36 113.774 -22.262 6.980 1.00 0.00 H new ATOM 0 HG3 PRO A 36 114.035 -23.659 5.956 1.00 0.00 H new ATOM 0 HD2 PRO A 36 115.725 -22.767 8.066 1.00 0.00 H new ATOM 0 HD3 PRO A 36 116.072 -24.052 6.927 1.00 0.00 H new ATOM 466 N LEU A 37 116.880 -19.353 6.863 1.00 0.00 N ATOM 467 CA LEU A 37 116.739 -18.044 7.569 1.00 0.00 C ATOM 468 C LEU A 37 117.208 -16.901 6.663 1.00 0.00 C ATOM 469 O LEU A 37 118.286 -16.364 6.834 1.00 0.00 O ATOM 470 CB LEU A 37 117.628 -18.153 8.815 1.00 0.00 C ATOM 471 CG LEU A 37 119.079 -18.451 8.405 1.00 0.00 C ATOM 472 CD1 LEU A 37 120.023 -17.464 9.095 1.00 0.00 C ATOM 473 CD2 LEU A 37 119.447 -19.879 8.822 1.00 0.00 C ATOM 0 H LEU A 37 117.772 -19.827 7.004 1.00 0.00 H new ATOM 0 HA LEU A 37 115.704 -17.831 7.835 1.00 0.00 H new ATOM 0 HB2 LEU A 37 117.586 -17.224 9.383 1.00 0.00 H new ATOM 0 HB3 LEU A 37 117.257 -18.943 9.468 1.00 0.00 H new ATOM 0 HG LEU A 37 119.174 -18.350 7.324 1.00 0.00 H new ATOM 0 HD11 LEU A 37 121.051 -17.678 8.802 1.00 0.00 H new ATOM 0 HD12 LEU A 37 119.766 -16.447 8.799 1.00 0.00 H new ATOM 0 HD13 LEU A 37 119.926 -17.563 10.176 1.00 0.00 H new ATOM 0 HD21 LEU A 37 120.476 -20.089 8.531 1.00 0.00 H new ATOM 0 HD22 LEU A 37 119.348 -19.979 9.903 1.00 0.00 H new ATOM 0 HD23 LEU A 37 118.779 -20.585 8.329 1.00 0.00 H new ATOM 484 N GLY A 38 116.405 -16.527 5.702 1.00 0.00 N ATOM 485 CA GLY A 38 116.804 -15.421 4.786 1.00 0.00 C ATOM 486 C GLY A 38 116.559 -14.078 5.471 1.00 0.00 C ATOM 487 O GLY A 38 115.503 -13.841 6.021 1.00 0.00 O ATOM 0 H GLY A 38 115.492 -16.940 5.513 1.00 0.00 H new ATOM 0 HA2 GLY A 38 117.856 -15.518 4.518 1.00 0.00 H new ATOM 0 HA3 GLY A 38 116.233 -15.478 3.859 1.00 0.00 H new ATOM 490 N VAL A 39 117.516 -13.189 5.424 1.00 0.00 N ATOM 491 CA VAL A 39 117.326 -11.849 6.051 1.00 0.00 C ATOM 492 C VAL A 39 117.774 -10.772 5.064 1.00 0.00 C ATOM 493 O VAL A 39 118.854 -10.841 4.509 1.00 0.00 O ATOM 494 CB VAL A 39 118.204 -11.850 7.309 1.00 0.00 C ATOM 495 CG1 VAL A 39 117.713 -12.937 8.268 1.00 0.00 C ATOM 496 CG2 VAL A 39 119.668 -12.120 6.933 1.00 0.00 C ATOM 0 H VAL A 39 118.422 -13.334 4.978 1.00 0.00 H new ATOM 0 HA VAL A 39 116.287 -11.646 6.309 1.00 0.00 H new ATOM 0 HB VAL A 39 118.138 -10.875 7.792 1.00 0.00 H new ATOM 0 HG11 VAL A 39 118.335 -12.940 9.163 1.00 0.00 H new ATOM 0 HG12 VAL A 39 116.678 -12.737 8.546 1.00 0.00 H new ATOM 0 HG13 VAL A 39 117.776 -13.909 7.779 1.00 0.00 H new ATOM 0 HG21 VAL A 39 120.281 -12.118 7.834 1.00 0.00 H new ATOM 0 HG22 VAL A 39 119.745 -13.091 6.444 1.00 0.00 H new ATOM 0 HG23 VAL A 39 120.019 -11.343 6.254 1.00 0.00 H new ATOM 506 N ILE A 40 116.952 -9.789 4.825 1.00 0.00 N ATOM 507 CA ILE A 40 117.334 -8.727 3.853 1.00 0.00 C ATOM 508 C ILE A 40 117.084 -7.331 4.424 1.00 0.00 C ATOM 509 O ILE A 40 116.119 -7.099 5.123 1.00 0.00 O ATOM 510 CB ILE A 40 116.447 -8.982 2.628 1.00 0.00 C ATOM 511 CG1 ILE A 40 116.780 -7.964 1.533 1.00 0.00 C ATOM 512 CG2 ILE A 40 114.972 -8.848 3.017 1.00 0.00 C ATOM 513 CD1 ILE A 40 116.056 -8.346 0.239 1.00 0.00 C ATOM 0 H ILE A 40 116.036 -9.675 5.259 1.00 0.00 H new ATOM 0 HA ILE A 40 118.396 -8.763 3.611 1.00 0.00 H new ATOM 0 HB ILE A 40 116.631 -9.990 2.257 1.00 0.00 H new ATOM 0 HG12 ILE A 40 116.480 -6.965 1.848 1.00 0.00 H new ATOM 0 HG13 ILE A 40 117.856 -7.935 1.364 1.00 0.00 H new ATOM 0 HG21 ILE A 40 114.347 -9.030 2.143 1.00 0.00 H new ATOM 0 HG22 ILE A 40 114.733 -9.576 3.792 1.00 0.00 H new ATOM 0 HG23 ILE A 40 114.785 -7.842 3.393 1.00 0.00 H new ATOM 0 HD11 ILE A 40 116.294 -7.621 -0.539 1.00 0.00 H new ATOM 0 HD12 ILE A 40 116.378 -9.338 -0.079 1.00 0.00 H new ATOM 0 HD13 ILE A 40 114.980 -8.352 0.412 1.00 0.00 H new ATOM 524 N GLY A 41 117.934 -6.396 4.091 1.00 0.00 N ATOM 525 CA GLY A 41 117.744 -4.997 4.563 1.00 0.00 C ATOM 526 C GLY A 41 117.275 -4.177 3.363 1.00 0.00 C ATOM 527 O GLY A 41 117.626 -4.480 2.240 1.00 0.00 O ATOM 0 H GLY A 41 118.757 -6.545 3.508 1.00 0.00 H new ATOM 0 HA2 GLY A 41 117.009 -4.958 5.367 1.00 0.00 H new ATOM 0 HA3 GLY A 41 118.675 -4.596 4.963 1.00 0.00 H new ATOM 530 N SER A 42 116.471 -3.169 3.568 1.00 0.00 N ATOM 531 CA SER A 42 115.982 -2.381 2.398 1.00 0.00 C ATOM 532 C SER A 42 115.975 -0.879 2.685 1.00 0.00 C ATOM 533 O SER A 42 115.620 -0.442 3.763 1.00 0.00 O ATOM 534 CB SER A 42 114.558 -2.882 2.168 1.00 0.00 C ATOM 535 OG SER A 42 113.970 -2.155 1.098 1.00 0.00 O ATOM 0 H SER A 42 116.135 -2.859 4.480 1.00 0.00 H new ATOM 0 HA SER A 42 116.627 -2.515 1.530 1.00 0.00 H new ATOM 0 HB2 SER A 42 114.568 -3.947 1.937 1.00 0.00 H new ATOM 0 HB3 SER A 42 113.966 -2.759 3.075 1.00 0.00 H new ATOM 0 HG SER A 42 113.205 -1.641 1.433 1.00 0.00 H new ATOM 540 N PHE A 43 116.331 -0.089 1.706 1.00 0.00 N ATOM 541 CA PHE A 43 116.315 1.388 1.884 1.00 0.00 C ATOM 542 C PHE A 43 115.463 1.992 0.770 1.00 0.00 C ATOM 543 O PHE A 43 115.544 1.567 -0.368 1.00 0.00 O ATOM 544 CB PHE A 43 117.774 1.829 1.753 1.00 0.00 C ATOM 545 CG PHE A 43 118.588 1.209 2.863 1.00 0.00 C ATOM 546 CD1 PHE A 43 118.640 1.821 4.121 1.00 0.00 C ATOM 547 CD2 PHE A 43 119.293 0.021 2.634 1.00 0.00 C ATOM 548 CE1 PHE A 43 119.396 1.246 5.150 1.00 0.00 C ATOM 549 CE2 PHE A 43 120.048 -0.554 3.663 1.00 0.00 C ATOM 550 CZ PHE A 43 120.100 0.058 4.920 1.00 0.00 C ATOM 0 H PHE A 43 116.634 -0.408 0.786 1.00 0.00 H new ATOM 0 HA PHE A 43 115.899 1.704 2.841 1.00 0.00 H new ATOM 0 HB2 PHE A 43 118.171 1.527 0.784 1.00 0.00 H new ATOM 0 HB3 PHE A 43 117.842 2.916 1.801 1.00 0.00 H new ATOM 0 HD1 PHE A 43 118.097 2.737 4.298 1.00 0.00 H new ATOM 0 HD2 PHE A 43 119.254 -0.452 1.664 1.00 0.00 H new ATOM 0 HE1 PHE A 43 119.436 1.719 6.120 1.00 0.00 H new ATOM 0 HE2 PHE A 43 120.591 -1.471 3.486 1.00 0.00 H new ATOM 0 HZ PHE A 43 120.683 -0.386 5.713 1.00 0.00 H new ATOM 559 N THR A 44 114.642 2.963 1.068 1.00 0.00 N ATOM 560 CA THR A 44 113.798 3.552 -0.007 1.00 0.00 C ATOM 561 C THR A 44 113.808 5.077 0.056 1.00 0.00 C ATOM 562 O THR A 44 113.842 5.669 1.119 1.00 0.00 O ATOM 563 CB THR A 44 112.389 3.005 0.249 1.00 0.00 C ATOM 564 OG1 THR A 44 111.518 3.445 -0.783 1.00 0.00 O ATOM 565 CG2 THR A 44 111.870 3.497 1.602 1.00 0.00 C ATOM 0 H THR A 44 114.521 3.368 1.996 1.00 0.00 H new ATOM 0 HA THR A 44 114.166 3.289 -0.999 1.00 0.00 H new ATOM 0 HB THR A 44 112.426 1.916 0.259 1.00 0.00 H new ATOM 0 HG1 THR A 44 111.669 2.908 -1.589 1.00 0.00 H new ATOM 0 HG21 THR A 44 110.869 3.102 1.773 1.00 0.00 H new ATOM 0 HG22 THR A 44 112.536 3.153 2.394 1.00 0.00 H new ATOM 0 HG23 THR A 44 111.836 4.586 1.604 1.00 0.00 H new ATOM 573 N TYR A 45 113.742 5.709 -1.084 1.00 0.00 N ATOM 574 CA TYR A 45 113.707 7.191 -1.129 1.00 0.00 C ATOM 575 C TYR A 45 112.514 7.611 -1.983 1.00 0.00 C ATOM 576 O TYR A 45 112.488 7.387 -3.179 1.00 0.00 O ATOM 577 CB TYR A 45 115.025 7.611 -1.780 1.00 0.00 C ATOM 578 CG TYR A 45 116.176 7.215 -0.886 1.00 0.00 C ATOM 579 CD1 TYR A 45 116.564 8.053 0.166 1.00 0.00 C ATOM 580 CD2 TYR A 45 116.856 6.012 -1.109 1.00 0.00 C ATOM 581 CE1 TYR A 45 117.630 7.687 0.996 1.00 0.00 C ATOM 582 CE2 TYR A 45 117.922 5.646 -0.279 1.00 0.00 C ATOM 583 CZ TYR A 45 118.309 6.484 0.773 1.00 0.00 C ATOM 584 OH TYR A 45 119.361 6.123 1.592 1.00 0.00 O ATOM 0 H TYR A 45 113.711 5.252 -1.995 1.00 0.00 H new ATOM 0 HA TYR A 45 113.600 7.653 -0.147 1.00 0.00 H new ATOM 0 HB2 TYR A 45 115.128 7.137 -2.756 1.00 0.00 H new ATOM 0 HB3 TYR A 45 115.034 8.688 -1.947 1.00 0.00 H new ATOM 0 HD1 TYR A 45 116.041 8.982 0.337 1.00 0.00 H new ATOM 0 HD2 TYR A 45 116.558 5.366 -1.922 1.00 0.00 H new ATOM 0 HE1 TYR A 45 117.928 8.333 1.808 1.00 0.00 H new ATOM 0 HE2 TYR A 45 118.446 4.717 -0.450 1.00 0.00 H new ATOM 0 HH TYR A 45 119.721 5.259 1.301 1.00 0.00 H new ATOM 593 N THR A 46 111.522 8.192 -1.375 1.00 0.00 N ATOM 594 CA THR A 46 110.311 8.606 -2.140 1.00 0.00 C ATOM 595 C THR A 46 110.105 10.119 -2.048 1.00 0.00 C ATOM 596 O THR A 46 110.330 10.722 -1.017 1.00 0.00 O ATOM 597 CB THR A 46 109.151 7.860 -1.473 1.00 0.00 C ATOM 598 OG1 THR A 46 109.399 6.462 -1.525 1.00 0.00 O ATOM 599 CG2 THR A 46 107.841 8.176 -2.197 1.00 0.00 C ATOM 0 H THR A 46 111.495 8.400 -0.377 1.00 0.00 H new ATOM 0 HA THR A 46 110.395 8.370 -3.201 1.00 0.00 H new ATOM 0 HB THR A 46 109.068 8.179 -0.434 1.00 0.00 H new ATOM 0 HG1 THR A 46 108.659 5.982 -1.098 1.00 0.00 H new ATOM 0 HG21 THR A 46 107.022 7.642 -1.716 1.00 0.00 H new ATOM 0 HG22 THR A 46 107.650 9.248 -2.153 1.00 0.00 H new ATOM 0 HG23 THR A 46 107.916 7.864 -3.239 1.00 0.00 H new ATOM 607 N GLU A 47 109.678 10.738 -3.120 1.00 0.00 N ATOM 608 CA GLU A 47 109.460 12.213 -3.092 1.00 0.00 C ATOM 609 C GLU A 47 108.318 12.594 -4.040 1.00 0.00 C ATOM 610 O GLU A 47 107.735 11.750 -4.691 1.00 0.00 O ATOM 611 CB GLU A 47 110.787 12.820 -3.559 1.00 0.00 C ATOM 612 CG GLU A 47 111.104 12.350 -4.984 1.00 0.00 C ATOM 613 CD GLU A 47 112.492 12.849 -5.407 1.00 0.00 C ATOM 614 OE1 GLU A 47 113.067 13.646 -4.681 1.00 0.00 O ATOM 615 OE2 GLU A 47 112.957 12.423 -6.451 1.00 0.00 O ATOM 0 H GLU A 47 109.472 10.285 -4.010 1.00 0.00 H new ATOM 0 HA GLU A 47 109.180 12.574 -2.103 1.00 0.00 H new ATOM 0 HB2 GLU A 47 110.729 13.908 -3.530 1.00 0.00 H new ATOM 0 HB3 GLU A 47 111.589 12.525 -2.883 1.00 0.00 H new ATOM 0 HG2 GLU A 47 111.070 11.262 -5.032 1.00 0.00 H new ATOM 0 HG3 GLU A 47 110.348 12.724 -5.675 1.00 0.00 H new ATOM 620 N LYS A 48 107.999 13.859 -4.122 1.00 0.00 N ATOM 621 CA LYS A 48 106.896 14.295 -5.030 1.00 0.00 C ATOM 622 C LYS A 48 107.354 14.209 -6.489 1.00 0.00 C ATOM 623 O LYS A 48 108.532 14.273 -6.783 1.00 0.00 O ATOM 624 CB LYS A 48 106.607 15.747 -4.645 1.00 0.00 C ATOM 625 CG LYS A 48 106.073 15.800 -3.212 1.00 0.00 C ATOM 626 CD LYS A 48 105.667 17.234 -2.871 1.00 0.00 C ATOM 627 CE LYS A 48 105.236 17.309 -1.404 1.00 0.00 C ATOM 628 NZ LYS A 48 106.454 17.752 -0.669 1.00 0.00 N ATOM 0 H LYS A 48 108.454 14.609 -3.600 1.00 0.00 H new ATOM 0 HA LYS A 48 106.010 13.667 -4.933 1.00 0.00 H new ATOM 0 HB2 LYS A 48 107.515 16.344 -4.728 1.00 0.00 H new ATOM 0 HB3 LYS A 48 105.879 16.178 -5.332 1.00 0.00 H new ATOM 0 HG2 LYS A 48 105.217 15.134 -3.107 1.00 0.00 H new ATOM 0 HG3 LYS A 48 106.835 15.451 -2.515 1.00 0.00 H new ATOM 0 HD2 LYS A 48 106.502 17.912 -3.051 1.00 0.00 H new ATOM 0 HD3 LYS A 48 104.850 17.555 -3.518 1.00 0.00 H new ATOM 0 HE2 LYS A 48 104.415 18.013 -1.269 1.00 0.00 H new ATOM 0 HE3 LYS A 48 104.888 16.341 -1.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 106.239 17.827 0.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 107.216 17.059 -0.811 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 106.758 18.679 -1.028 1.00 0.00 H new ATOM 638 N SER A 49 106.430 14.056 -7.402 1.00 0.00 N ATOM 639 CA SER A 49 106.807 13.958 -8.846 1.00 0.00 C ATOM 640 C SER A 49 107.586 15.202 -9.281 1.00 0.00 C ATOM 641 O SER A 49 107.485 16.252 -8.674 1.00 0.00 O ATOM 642 CB SER A 49 105.481 13.867 -9.602 1.00 0.00 C ATOM 643 OG SER A 49 104.734 12.764 -9.107 1.00 0.00 O ATOM 0 H SER A 49 105.430 13.995 -7.211 1.00 0.00 H new ATOM 0 HA SER A 49 107.448 13.098 -9.042 1.00 0.00 H new ATOM 0 HB2 SER A 49 104.914 14.790 -9.478 1.00 0.00 H new ATOM 0 HB3 SER A 49 105.665 13.747 -10.670 1.00 0.00 H new ATOM 0 HG SER A 49 103.863 13.077 -8.784 1.00 0.00 H new ATOM 648 N ARG A 50 108.367 15.089 -10.324 1.00 0.00 N ATOM 649 CA ARG A 50 109.164 16.261 -10.803 1.00 0.00 C ATOM 650 C ARG A 50 108.249 17.460 -11.085 1.00 0.00 C ATOM 651 O ARG A 50 107.103 17.305 -11.463 1.00 0.00 O ATOM 652 CB ARG A 50 109.850 15.781 -12.088 1.00 0.00 C ATOM 653 CG ARG A 50 108.796 15.418 -13.139 1.00 0.00 C ATOM 654 CD ARG A 50 109.474 14.710 -14.315 1.00 0.00 C ATOM 655 NE ARG A 50 108.396 14.514 -15.325 1.00 0.00 N ATOM 656 CZ ARG A 50 108.583 13.700 -16.327 1.00 0.00 C ATOM 657 NH1 ARG A 50 108.734 12.421 -16.110 1.00 0.00 N ATOM 658 NH2 ARG A 50 108.619 14.163 -17.547 1.00 0.00 N ATOM 0 H ARG A 50 108.488 14.234 -10.867 1.00 0.00 H new ATOM 0 HA ARG A 50 109.887 16.595 -10.059 1.00 0.00 H new ATOM 0 HB2 ARG A 50 110.506 16.561 -12.473 1.00 0.00 H new ATOM 0 HB3 ARG A 50 110.476 14.915 -11.874 1.00 0.00 H new ATOM 0 HG2 ARG A 50 108.036 14.771 -12.700 1.00 0.00 H new ATOM 0 HG3 ARG A 50 108.287 16.317 -13.486 1.00 0.00 H new ATOM 0 HD2 ARG A 50 110.289 15.310 -14.720 1.00 0.00 H new ATOM 0 HD3 ARG A 50 109.903 13.757 -14.007 1.00 0.00 H new ATOM 0 HE ARG A 50 107.513 15.016 -15.233 1.00 0.00 H new ATOM 0 HH11 ARG A 50 108.706 12.059 -15.157 1.00 0.00 H new ATOM 0 HH12 ARG A 50 108.880 11.785 -16.894 1.00 0.00 H new ATOM 0 HH21 ARG A 50 108.501 15.162 -17.717 1.00 0.00 H new ATOM 0 HH22 ARG A 50 108.765 13.526 -18.330 1.00 0.00 H new ATOM 669 N THR A 51 108.751 18.652 -10.898 1.00 0.00 N ATOM 670 CA THR A 51 107.923 19.868 -11.147 1.00 0.00 C ATOM 671 C THR A 51 108.504 20.670 -12.314 1.00 0.00 C ATOM 672 O THR A 51 109.602 20.413 -12.768 1.00 0.00 O ATOM 673 CB THR A 51 107.996 20.680 -9.850 1.00 0.00 C ATOM 674 OG1 THR A 51 109.343 21.069 -9.614 1.00 0.00 O ATOM 675 CG2 THR A 51 107.491 19.838 -8.673 1.00 0.00 C ATOM 0 H THR A 51 109.703 18.836 -10.582 1.00 0.00 H new ATOM 0 HA THR A 51 106.895 19.618 -11.410 1.00 0.00 H new ATOM 0 HB THR A 51 107.369 21.566 -9.946 1.00 0.00 H new ATOM 0 HG1 THR A 51 109.393 21.590 -8.786 1.00 0.00 H new ATOM 0 HG21 THR A 51 107.547 20.424 -7.756 1.00 0.00 H new ATOM 0 HG22 THR A 51 106.457 19.544 -8.853 1.00 0.00 H new ATOM 0 HG23 THR A 51 108.109 18.946 -8.572 1.00 0.00 H new ATOM 683 N ALA A 52 107.773 21.637 -12.803 1.00 0.00 N ATOM 684 CA ALA A 52 108.276 22.459 -13.946 1.00 0.00 C ATOM 685 C ALA A 52 109.597 23.138 -13.572 1.00 0.00 C ATOM 686 O ALA A 52 110.439 23.381 -14.416 1.00 0.00 O ATOM 687 CB ALA A 52 107.189 23.505 -14.197 1.00 0.00 C ATOM 0 H ALA A 52 106.847 21.894 -12.460 1.00 0.00 H new ATOM 0 HA ALA A 52 108.470 21.854 -14.831 1.00 0.00 H new ATOM 0 HB1 ALA A 52 107.487 24.148 -15.025 1.00 0.00 H new ATOM 0 HB2 ALA A 52 106.253 23.005 -14.445 1.00 0.00 H new ATOM 0 HB3 ALA A 52 107.051 24.109 -13.300 1.00 0.00 H new ATOM 693 N SER A 53 109.785 23.442 -12.313 1.00 0.00 N ATOM 694 CA SER A 53 111.055 24.104 -11.881 1.00 0.00 C ATOM 695 C SER A 53 112.259 23.233 -12.251 1.00 0.00 C ATOM 696 O SER A 53 113.310 23.731 -12.608 1.00 0.00 O ATOM 697 CB SER A 53 110.939 24.241 -10.363 1.00 0.00 C ATOM 698 OG SER A 53 112.033 25.005 -9.875 1.00 0.00 O ATOM 0 H SER A 53 109.115 23.261 -11.565 1.00 0.00 H new ATOM 0 HA SER A 53 111.200 25.069 -12.366 1.00 0.00 H new ATOM 0 HB2 SER A 53 109.998 24.724 -10.101 1.00 0.00 H new ATOM 0 HB3 SER A 53 110.932 23.256 -9.897 1.00 0.00 H new ATOM 0 HG SER A 53 111.960 25.096 -8.902 1.00 0.00 H new ATOM 703 N SER A 54 112.108 21.934 -12.169 1.00 0.00 N ATOM 704 CA SER A 54 113.230 21.002 -12.515 1.00 0.00 C ATOM 705 C SER A 54 114.541 21.442 -11.849 1.00 0.00 C ATOM 706 O SER A 54 115.600 21.389 -12.447 1.00 0.00 O ATOM 707 CB SER A 54 113.348 21.073 -14.039 1.00 0.00 C ATOM 708 OG SER A 54 114.093 22.227 -14.407 1.00 0.00 O ATOM 0 H SER A 54 111.247 21.473 -11.874 1.00 0.00 H new ATOM 0 HA SER A 54 113.036 19.989 -12.163 1.00 0.00 H new ATOM 0 HB2 SER A 54 113.837 20.176 -14.418 1.00 0.00 H new ATOM 0 HB3 SER A 54 112.356 21.109 -14.489 1.00 0.00 H new ATOM 0 HG SER A 54 113.600 23.032 -14.144 1.00 0.00 H new ATOM 713 N GLY A 55 114.477 21.873 -10.616 1.00 0.00 N ATOM 714 CA GLY A 55 115.715 22.315 -9.911 1.00 0.00 C ATOM 715 C GLY A 55 116.418 21.099 -9.304 1.00 0.00 C ATOM 716 O GLY A 55 115.945 19.984 -9.408 1.00 0.00 O ATOM 0 H GLY A 55 113.620 21.938 -10.067 1.00 0.00 H new ATOM 0 HA2 GLY A 55 116.381 22.823 -10.608 1.00 0.00 H new ATOM 0 HA3 GLY A 55 115.465 23.032 -9.129 1.00 0.00 H new ATOM 719 N ASP A 56 117.546 21.306 -8.675 1.00 0.00 N ATOM 720 CA ASP A 56 118.284 20.163 -8.061 1.00 0.00 C ATOM 721 C ASP A 56 117.851 19.944 -6.604 1.00 0.00 C ATOM 722 O ASP A 56 118.473 19.195 -5.873 1.00 0.00 O ATOM 723 CB ASP A 56 119.766 20.555 -8.141 1.00 0.00 C ATOM 724 CG ASP A 56 120.026 21.852 -7.359 1.00 0.00 C ATOM 725 OD1 ASP A 56 119.135 22.296 -6.652 1.00 0.00 O ATOM 726 OD2 ASP A 56 121.117 22.382 -7.488 1.00 0.00 O ATOM 0 H ASP A 56 117.988 22.218 -8.560 1.00 0.00 H new ATOM 0 HA ASP A 56 118.082 19.225 -8.579 1.00 0.00 H new ATOM 0 HB2 ASP A 56 120.382 19.751 -7.738 1.00 0.00 H new ATOM 0 HB3 ASP A 56 120.057 20.688 -9.183 1.00 0.00 H new ATOM 730 N TYR A 57 116.793 20.585 -6.175 1.00 0.00 N ATOM 731 CA TYR A 57 116.327 20.408 -4.767 1.00 0.00 C ATOM 732 C TYR A 57 114.974 19.693 -4.747 1.00 0.00 C ATOM 733 O TYR A 57 114.142 19.899 -5.610 1.00 0.00 O ATOM 734 CB TYR A 57 116.192 21.825 -4.205 1.00 0.00 C ATOM 735 CG TYR A 57 117.534 22.520 -4.242 1.00 0.00 C ATOM 736 CD1 TYR A 57 118.650 21.922 -3.645 1.00 0.00 C ATOM 737 CD2 TYR A 57 117.660 23.764 -4.875 1.00 0.00 C ATOM 738 CE1 TYR A 57 119.893 22.567 -3.679 1.00 0.00 C ATOM 739 CE2 TYR A 57 118.903 24.408 -4.909 1.00 0.00 C ATOM 740 CZ TYR A 57 120.019 23.809 -4.311 1.00 0.00 C ATOM 741 OH TYR A 57 121.244 24.445 -4.345 1.00 0.00 O ATOM 0 H TYR A 57 116.232 21.223 -6.739 1.00 0.00 H new ATOM 0 HA TYR A 57 117.018 19.804 -4.179 1.00 0.00 H new ATOM 0 HB2 TYR A 57 115.464 22.389 -4.787 1.00 0.00 H new ATOM 0 HB3 TYR A 57 115.820 21.786 -3.181 1.00 0.00 H new ATOM 0 HD1 TYR A 57 118.553 20.963 -3.158 1.00 0.00 H new ATOM 0 HD2 TYR A 57 116.799 24.226 -5.336 1.00 0.00 H new ATOM 0 HE1 TYR A 57 120.754 22.106 -3.218 1.00 0.00 H new ATOM 0 HE2 TYR A 57 119.001 25.367 -5.396 1.00 0.00 H new ATOM 0 HH TYR A 57 121.157 25.296 -4.823 1.00 0.00 H new ATOM 750 N ASN A 58 114.748 18.859 -3.766 1.00 0.00 N ATOM 751 CA ASN A 58 113.446 18.132 -3.680 1.00 0.00 C ATOM 752 C ASN A 58 112.667 18.573 -2.434 1.00 0.00 C ATOM 753 O ASN A 58 111.733 17.919 -2.018 1.00 0.00 O ATOM 754 CB ASN A 58 113.823 16.654 -3.581 1.00 0.00 C ATOM 755 CG ASN A 58 114.518 16.211 -4.871 1.00 0.00 C ATOM 756 OD1 ASN A 58 114.399 16.857 -5.894 1.00 0.00 O ATOM 757 ND2 ASN A 58 115.244 15.126 -4.867 1.00 0.00 N ATOM 0 H ASN A 58 115.410 18.649 -3.019 1.00 0.00 H new ATOM 0 HA ASN A 58 112.806 18.334 -4.539 1.00 0.00 H new ATOM 0 HB2 ASN A 58 114.482 16.493 -2.728 1.00 0.00 H new ATOM 0 HB3 ASN A 58 112.930 16.052 -3.412 1.00 0.00 H new ATOM 0 HD21 ASN A 58 115.710 14.821 -5.721 1.00 0.00 H new ATOM 0 HD22 ASN A 58 115.345 14.583 -4.009 1.00 0.00 H new ATOM 763 N LYS A 59 113.048 19.678 -1.838 1.00 0.00 N ATOM 764 CA LYS A 59 112.341 20.173 -0.614 1.00 0.00 C ATOM 765 C LYS A 59 112.271 19.075 0.465 1.00 0.00 C ATOM 766 O LYS A 59 113.141 18.981 1.309 1.00 0.00 O ATOM 767 CB LYS A 59 110.945 20.587 -1.096 1.00 0.00 C ATOM 768 CG LYS A 59 110.150 21.161 0.078 1.00 0.00 C ATOM 769 CD LYS A 59 108.739 21.523 -0.388 1.00 0.00 C ATOM 770 CE LYS A 59 107.999 22.246 0.740 1.00 0.00 C ATOM 771 NZ LYS A 59 108.370 23.679 0.586 1.00 0.00 N ATOM 0 H LYS A 59 113.824 20.262 -2.149 1.00 0.00 H new ATOM 0 HA LYS A 59 112.863 21.008 -0.148 1.00 0.00 H new ATOM 0 HB2 LYS A 59 111.028 21.329 -1.890 1.00 0.00 H new ATOM 0 HB3 LYS A 59 110.424 19.727 -1.516 1.00 0.00 H new ATOM 0 HG2 LYS A 59 110.101 20.433 0.888 1.00 0.00 H new ATOM 0 HG3 LYS A 59 110.652 22.044 0.473 1.00 0.00 H new ATOM 0 HD2 LYS A 59 108.788 22.159 -1.271 1.00 0.00 H new ATOM 0 HD3 LYS A 59 108.197 20.622 -0.674 1.00 0.00 H new ATOM 0 HE2 LYS A 59 106.921 22.106 0.658 1.00 0.00 H new ATOM 0 HE3 LYS A 59 108.297 21.864 1.716 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 108.262 24.166 1.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 109.359 23.750 0.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 107.749 24.124 -0.119 1.00 0.00 H new ATOM 781 N ASN A 60 111.250 18.250 0.454 1.00 0.00 N ATOM 782 CA ASN A 60 111.142 17.176 1.486 1.00 0.00 C ATOM 783 C ASN A 60 111.489 15.813 0.879 1.00 0.00 C ATOM 784 O ASN A 60 111.157 15.526 -0.255 1.00 0.00 O ATOM 785 CB ASN A 60 109.681 17.207 1.935 1.00 0.00 C ATOM 786 CG ASN A 60 109.522 16.376 3.210 1.00 0.00 C ATOM 787 OD1 ASN A 60 110.096 16.694 4.232 1.00 0.00 O ATOM 788 ND2 ASN A 60 108.759 15.317 3.193 1.00 0.00 N ATOM 0 H ASN A 60 110.489 18.276 -0.225 1.00 0.00 H new ATOM 0 HA ASN A 60 111.830 17.333 2.317 1.00 0.00 H new ATOM 0 HB2 ASN A 60 109.367 18.235 2.116 1.00 0.00 H new ATOM 0 HB3 ASN A 60 109.039 16.812 1.148 1.00 0.00 H new ATOM 0 HD21 ASN A 60 108.645 14.757 4.038 1.00 0.00 H new ATOM 0 HD22 ASN A 60 108.277 15.050 2.335 1.00 0.00 H new ATOM 794 N GLN A 61 112.145 14.969 1.633 1.00 0.00 N ATOM 795 CA GLN A 61 112.508 13.615 1.116 1.00 0.00 C ATOM 796 C GLN A 61 111.897 12.541 2.020 1.00 0.00 C ATOM 797 O GLN A 61 111.636 12.780 3.183 1.00 0.00 O ATOM 798 CB GLN A 61 114.035 13.563 1.172 1.00 0.00 C ATOM 799 CG GLN A 61 114.617 14.629 0.241 1.00 0.00 C ATOM 800 CD GLN A 61 116.146 14.612 0.332 1.00 0.00 C ATOM 801 OE1 GLN A 61 116.705 14.108 1.285 1.00 0.00 O ATOM 802 NE2 GLN A 61 116.848 15.146 -0.629 1.00 0.00 N ATOM 0 H GLN A 61 112.446 15.160 2.589 1.00 0.00 H new ATOM 0 HA GLN A 61 112.138 13.438 0.106 1.00 0.00 H new ATOM 0 HB2 GLN A 61 114.378 13.730 2.193 1.00 0.00 H new ATOM 0 HB3 GLN A 61 114.387 12.575 0.876 1.00 0.00 H new ATOM 0 HG2 GLN A 61 114.302 14.441 -0.785 1.00 0.00 H new ATOM 0 HG3 GLN A 61 114.237 15.613 0.516 1.00 0.00 H new ATOM 0 HE21 GLN A 61 116.378 15.569 -1.429 1.00 0.00 H new ATOM 0 HE22 GLN A 61 117.867 15.140 -0.580 1.00 0.00 H new ATOM 809 N TYR A 62 111.663 11.361 1.500 1.00 0.00 N ATOM 810 CA TYR A 62 111.064 10.287 2.347 1.00 0.00 C ATOM 811 C TYR A 62 112.088 9.182 2.627 1.00 0.00 C ATOM 812 O TYR A 62 112.587 8.530 1.731 1.00 0.00 O ATOM 813 CB TYR A 62 109.889 9.744 1.535 1.00 0.00 C ATOM 814 CG TYR A 62 109.125 8.739 2.365 1.00 0.00 C ATOM 815 CD1 TYR A 62 108.154 9.177 3.273 1.00 0.00 C ATOM 816 CD2 TYR A 62 109.388 7.372 2.226 1.00 0.00 C ATOM 817 CE1 TYR A 62 107.444 8.247 4.042 1.00 0.00 C ATOM 818 CE2 TYR A 62 108.679 6.441 2.995 1.00 0.00 C ATOM 819 CZ TYR A 62 107.706 6.879 3.903 1.00 0.00 C ATOM 820 OH TYR A 62 107.008 5.962 4.661 1.00 0.00 O ATOM 0 H TYR A 62 111.859 11.098 0.534 1.00 0.00 H new ATOM 0 HA TYR A 62 110.745 10.666 3.318 1.00 0.00 H new ATOM 0 HB2 TYR A 62 109.231 10.560 1.237 1.00 0.00 H new ATOM 0 HB3 TYR A 62 110.251 9.276 0.620 1.00 0.00 H new ATOM 0 HD1 TYR A 62 107.952 10.233 3.380 1.00 0.00 H new ATOM 0 HD2 TYR A 62 110.138 7.035 1.526 1.00 0.00 H new ATOM 0 HE1 TYR A 62 106.694 8.585 4.742 1.00 0.00 H new ATOM 0 HE2 TYR A 62 108.882 5.386 2.888 1.00 0.00 H new ATOM 0 HH TYR A 62 107.312 5.057 4.441 1.00 0.00 H new ATOM 829 N TYR A 63 112.400 8.987 3.878 1.00 0.00 N ATOM 830 CA TYR A 63 113.394 7.939 4.253 1.00 0.00 C ATOM 831 C TYR A 63 112.652 6.681 4.696 1.00 0.00 C ATOM 832 O TYR A 63 111.648 6.766 5.374 1.00 0.00 O ATOM 833 CB TYR A 63 114.190 8.543 5.407 1.00 0.00 C ATOM 834 CG TYR A 63 115.415 7.699 5.674 1.00 0.00 C ATOM 835 CD1 TYR A 63 116.556 7.855 4.878 1.00 0.00 C ATOM 836 CD2 TYR A 63 115.412 6.767 6.717 1.00 0.00 C ATOM 837 CE1 TYR A 63 117.694 7.079 5.124 1.00 0.00 C ATOM 838 CE2 TYR A 63 116.550 5.991 6.965 1.00 0.00 C ATOM 839 CZ TYR A 63 117.691 6.146 6.169 1.00 0.00 C ATOM 840 OH TYR A 63 118.813 5.380 6.413 1.00 0.00 O ATOM 0 H TYR A 63 112.008 9.510 4.661 1.00 0.00 H new ATOM 0 HA TYR A 63 114.048 7.655 3.429 1.00 0.00 H new ATOM 0 HB2 TYR A 63 114.485 9.564 5.164 1.00 0.00 H new ATOM 0 HB3 TYR A 63 113.570 8.595 6.302 1.00 0.00 H new ATOM 0 HD1 TYR A 63 116.558 8.575 4.073 1.00 0.00 H new ATOM 0 HD2 TYR A 63 114.532 6.646 7.331 1.00 0.00 H new ATOM 0 HE1 TYR A 63 118.574 7.199 4.509 1.00 0.00 H new ATOM 0 HE2 TYR A 63 116.548 5.272 7.771 1.00 0.00 H new ATOM 0 HH TYR A 63 118.644 4.785 7.173 1.00 0.00 H new ATOM 849 N GLY A 64 113.119 5.514 4.319 1.00 0.00 N ATOM 850 CA GLY A 64 112.398 4.279 4.737 1.00 0.00 C ATOM 851 C GLY A 64 113.367 3.104 4.891 1.00 0.00 C ATOM 852 O GLY A 64 114.044 2.707 3.962 1.00 0.00 O ATOM 0 H GLY A 64 113.953 5.368 3.750 1.00 0.00 H new ATOM 0 HA2 GLY A 64 111.883 4.456 5.681 1.00 0.00 H new ATOM 0 HA3 GLY A 64 111.635 4.032 3.999 1.00 0.00 H new ATOM 855 N ILE A 65 113.396 2.531 6.062 1.00 0.00 N ATOM 856 CA ILE A 65 114.278 1.352 6.299 1.00 0.00 C ATOM 857 C ILE A 65 113.389 0.138 6.532 1.00 0.00 C ATOM 858 O ILE A 65 112.391 0.234 7.209 1.00 0.00 O ATOM 859 CB ILE A 65 115.112 1.689 7.540 1.00 0.00 C ATOM 860 CG1 ILE A 65 114.198 1.928 8.747 1.00 0.00 C ATOM 861 CG2 ILE A 65 115.935 2.948 7.270 1.00 0.00 C ATOM 862 CD1 ILE A 65 115.048 2.127 10.005 1.00 0.00 C ATOM 0 H ILE A 65 112.846 2.829 6.868 1.00 0.00 H new ATOM 0 HA ILE A 65 114.937 1.129 5.460 1.00 0.00 H new ATOM 0 HB ILE A 65 115.775 0.852 7.759 1.00 0.00 H new ATOM 0 HG12 ILE A 65 113.574 2.805 8.575 1.00 0.00 H new ATOM 0 HG13 ILE A 65 113.526 1.080 8.880 1.00 0.00 H new ATOM 0 HG21 ILE A 65 116.529 3.190 8.151 1.00 0.00 H new ATOM 0 HG22 ILE A 65 116.597 2.775 6.422 1.00 0.00 H new ATOM 0 HG23 ILE A 65 115.266 3.778 7.044 1.00 0.00 H new ATOM 0 HD11 ILE A 65 114.396 2.297 10.862 1.00 0.00 H new ATOM 0 HD12 ILE A 65 115.653 1.237 10.180 1.00 0.00 H new ATOM 0 HD13 ILE A 65 115.701 2.989 9.870 1.00 0.00 H new ATOM 873 N THR A 66 113.721 -0.997 5.974 1.00 0.00 N ATOM 874 CA THR A 66 112.853 -2.189 6.187 1.00 0.00 C ATOM 875 C THR A 66 113.644 -3.491 6.058 1.00 0.00 C ATOM 876 O THR A 66 114.538 -3.610 5.242 1.00 0.00 O ATOM 877 CB THR A 66 111.771 -2.101 5.108 1.00 0.00 C ATOM 878 OG1 THR A 66 112.325 -1.567 3.914 1.00 0.00 O ATOM 879 CG2 THR A 66 110.636 -1.198 5.595 1.00 0.00 C ATOM 0 H THR A 66 114.543 -1.148 5.389 1.00 0.00 H new ATOM 0 HA THR A 66 112.430 -2.195 7.191 1.00 0.00 H new ATOM 0 HB THR A 66 111.381 -3.099 4.907 1.00 0.00 H new ATOM 0 HG1 THR A 66 111.629 -1.514 3.226 1.00 0.00 H new ATOM 0 HG21 THR A 66 109.866 -1.135 4.826 1.00 0.00 H new ATOM 0 HG22 THR A 66 110.206 -1.613 6.507 1.00 0.00 H new ATOM 0 HG23 THR A 66 111.026 -0.201 5.799 1.00 0.00 H new ATOM 887 N ALA A 67 113.306 -4.476 6.849 1.00 0.00 N ATOM 888 CA ALA A 67 114.011 -5.788 6.776 1.00 0.00 C ATOM 889 C ALA A 67 113.053 -6.901 7.208 1.00 0.00 C ATOM 890 O ALA A 67 112.128 -6.665 7.963 1.00 0.00 O ATOM 891 CB ALA A 67 115.182 -5.669 7.751 1.00 0.00 C ATOM 0 H ALA A 67 112.565 -4.426 7.548 1.00 0.00 H new ATOM 0 HA ALA A 67 114.356 -6.027 5.770 1.00 0.00 H new ATOM 0 HB1 ALA A 67 115.750 -6.599 7.753 1.00 0.00 H new ATOM 0 HB2 ALA A 67 115.830 -4.849 7.443 1.00 0.00 H new ATOM 0 HB3 ALA A 67 114.802 -5.474 8.754 1.00 0.00 H new ATOM 897 N GLY A 68 113.253 -8.109 6.742 1.00 0.00 N ATOM 898 CA GLY A 68 112.331 -9.216 7.142 1.00 0.00 C ATOM 899 C GLY A 68 112.903 -10.575 6.713 1.00 0.00 C ATOM 900 O GLY A 68 113.913 -10.638 6.041 1.00 0.00 O ATOM 0 H GLY A 68 114.007 -8.375 6.108 1.00 0.00 H new ATOM 0 HA2 GLY A 68 112.183 -9.202 8.222 1.00 0.00 H new ATOM 0 HA3 GLY A 68 111.353 -9.066 6.685 1.00 0.00 H new ATOM 903 N PRO A 69 112.227 -11.628 7.123 1.00 0.00 N ATOM 904 CA PRO A 69 112.670 -13.004 6.778 1.00 0.00 C ATOM 905 C PRO A 69 112.428 -13.299 5.292 1.00 0.00 C ATOM 906 O PRO A 69 111.736 -12.567 4.611 1.00 0.00 O ATOM 907 CB PRO A 69 111.796 -13.896 7.657 1.00 0.00 C ATOM 908 CG PRO A 69 110.576 -13.083 7.941 1.00 0.00 C ATOM 909 CD PRO A 69 110.999 -11.637 7.935 1.00 0.00 C ATOM 0 HA PRO A 69 113.736 -13.159 6.945 1.00 0.00 H new ATOM 0 HB2 PRO A 69 111.541 -14.825 7.147 1.00 0.00 H new ATOM 0 HB3 PRO A 69 112.311 -14.169 8.578 1.00 0.00 H new ATOM 0 HG2 PRO A 69 109.809 -13.263 7.188 1.00 0.00 H new ATOM 0 HG3 PRO A 69 110.147 -13.355 8.905 1.00 0.00 H new ATOM 0 HD2 PRO A 69 110.230 -10.998 7.502 1.00 0.00 H new ATOM 0 HD3 PRO A 69 111.186 -11.272 8.945 1.00 0.00 H new ATOM 914 N ALA A 70 112.989 -14.371 4.789 1.00 0.00 N ATOM 915 CA ALA A 70 112.784 -14.718 3.349 1.00 0.00 C ATOM 916 C ALA A 70 112.808 -16.239 3.157 1.00 0.00 C ATOM 917 O ALA A 70 113.582 -16.938 3.786 1.00 0.00 O ATOM 918 CB ALA A 70 113.958 -14.067 2.616 1.00 0.00 C ATOM 0 H ALA A 70 113.578 -15.019 5.312 1.00 0.00 H new ATOM 0 HA ALA A 70 111.822 -14.369 2.974 1.00 0.00 H new ATOM 0 HB1 ALA A 70 113.881 -14.275 1.549 1.00 0.00 H new ATOM 0 HB2 ALA A 70 113.935 -12.989 2.778 1.00 0.00 H new ATOM 0 HB3 ALA A 70 114.895 -14.472 2.998 1.00 0.00 H new ATOM 924 N TYR A 71 111.965 -16.755 2.292 1.00 0.00 N ATOM 925 CA TYR A 71 111.942 -18.231 2.060 1.00 0.00 C ATOM 926 C TYR A 71 112.242 -18.548 0.592 1.00 0.00 C ATOM 927 O TYR A 71 111.658 -17.975 -0.309 1.00 0.00 O ATOM 928 CB TYR A 71 110.522 -18.670 2.421 1.00 0.00 C ATOM 929 CG TYR A 71 110.245 -18.359 3.873 1.00 0.00 C ATOM 930 CD1 TYR A 71 110.785 -19.168 4.879 1.00 0.00 C ATOM 931 CD2 TYR A 71 109.449 -17.258 4.213 1.00 0.00 C ATOM 932 CE1 TYR A 71 110.528 -18.879 6.224 1.00 0.00 C ATOM 933 CE2 TYR A 71 109.191 -16.969 5.558 1.00 0.00 C ATOM 934 CZ TYR A 71 109.731 -17.780 6.564 1.00 0.00 C ATOM 935 OH TYR A 71 109.476 -17.495 7.890 1.00 0.00 O ATOM 0 H TYR A 71 111.296 -16.218 1.740 1.00 0.00 H new ATOM 0 HA TYR A 71 112.694 -18.749 2.655 1.00 0.00 H new ATOM 0 HB2 TYR A 71 109.800 -18.157 1.785 1.00 0.00 H new ATOM 0 HB3 TYR A 71 110.404 -19.738 2.239 1.00 0.00 H new ATOM 0 HD1 TYR A 71 111.401 -20.016 4.617 1.00 0.00 H new ATOM 0 HD2 TYR A 71 109.034 -16.632 3.437 1.00 0.00 H new ATOM 0 HE1 TYR A 71 110.945 -19.504 7.000 1.00 0.00 H new ATOM 0 HE2 TYR A 71 108.576 -16.121 5.820 1.00 0.00 H new ATOM 0 HH TYR A 71 108.907 -16.699 7.950 1.00 0.00 H new ATOM 944 N ARG A 72 113.140 -19.468 0.352 1.00 0.00 N ATOM 945 CA ARG A 72 113.477 -19.843 -1.055 1.00 0.00 C ATOM 946 C ARG A 72 112.990 -21.261 -1.360 1.00 0.00 C ATOM 947 O ARG A 72 113.039 -22.138 -0.519 1.00 0.00 O ATOM 948 CB ARG A 72 115.002 -19.775 -1.144 1.00 0.00 C ATOM 949 CG ARG A 72 115.468 -18.332 -0.938 1.00 0.00 C ATOM 950 CD ARG A 72 116.963 -18.224 -1.253 1.00 0.00 C ATOM 951 NE ARG A 72 117.627 -19.218 -0.362 1.00 0.00 N ATOM 952 CZ ARG A 72 118.850 -19.600 -0.608 1.00 0.00 C ATOM 953 NH1 ARG A 72 119.846 -18.792 -0.364 1.00 0.00 N ATOM 954 NH2 ARG A 72 119.077 -20.788 -1.097 1.00 0.00 N ATOM 0 H ARG A 72 113.656 -19.977 1.070 1.00 0.00 H new ATOM 0 HA ARG A 72 113.000 -19.178 -1.775 1.00 0.00 H new ATOM 0 HB2 ARG A 72 115.449 -20.423 -0.390 1.00 0.00 H new ATOM 0 HB3 ARG A 72 115.336 -20.140 -2.115 1.00 0.00 H new ATOM 0 HG2 ARG A 72 114.901 -17.661 -1.583 1.00 0.00 H new ATOM 0 HG3 ARG A 72 115.279 -18.022 0.090 1.00 0.00 H new ATOM 0 HD2 ARG A 72 117.160 -18.443 -2.302 1.00 0.00 H new ATOM 0 HD3 ARG A 72 117.333 -17.217 -1.063 1.00 0.00 H new ATOM 0 HE ARG A 72 117.125 -19.599 0.440 1.00 0.00 H new ATOM 0 HH11 ARG A 72 119.667 -17.863 0.018 1.00 0.00 H new ATOM 0 HH12 ARG A 72 120.803 -19.089 -0.556 1.00 0.00 H new ATOM 0 HH21 ARG A 72 118.298 -21.419 -1.287 1.00 0.00 H new ATOM 0 HH22 ARG A 72 120.033 -21.086 -1.289 1.00 0.00 H new ATOM 965 N ILE A 73 112.530 -21.495 -2.564 1.00 0.00 N ATOM 966 CA ILE A 73 112.046 -22.862 -2.946 1.00 0.00 C ATOM 967 C ILE A 73 110.982 -23.356 -1.955 1.00 0.00 C ATOM 968 O ILE A 73 110.755 -24.543 -1.817 1.00 0.00 O ATOM 969 CB ILE A 73 113.292 -23.757 -2.905 1.00 0.00 C ATOM 970 CG1 ILE A 73 114.342 -23.215 -3.879 1.00 0.00 C ATOM 971 CG2 ILE A 73 112.916 -25.183 -3.316 1.00 0.00 C ATOM 972 CD1 ILE A 73 115.641 -24.009 -3.728 1.00 0.00 C ATOM 0 H ILE A 73 112.468 -20.796 -3.304 1.00 0.00 H new ATOM 0 HA ILE A 73 111.577 -22.869 -3.930 1.00 0.00 H new ATOM 0 HB ILE A 73 113.696 -23.763 -1.893 1.00 0.00 H new ATOM 0 HG12 ILE A 73 113.976 -23.289 -4.903 1.00 0.00 H new ATOM 0 HG13 ILE A 73 114.525 -22.159 -3.682 1.00 0.00 H new ATOM 0 HG21 ILE A 73 113.803 -25.816 -3.286 1.00 0.00 H new ATOM 0 HG22 ILE A 73 112.167 -25.575 -2.628 1.00 0.00 H new ATOM 0 HG23 ILE A 73 112.510 -25.175 -4.328 1.00 0.00 H new ATOM 0 HD11 ILE A 73 116.387 -23.622 -4.422 1.00 0.00 H new ATOM 0 HD12 ILE A 73 116.010 -23.912 -2.707 1.00 0.00 H new ATOM 0 HD13 ILE A 73 115.453 -25.060 -3.947 1.00 0.00 H new ATOM 983 N ASN A 74 110.327 -22.457 -1.266 1.00 0.00 N ATOM 984 CA ASN A 74 109.281 -22.881 -0.290 1.00 0.00 C ATOM 985 C ASN A 74 107.919 -22.969 -0.984 1.00 0.00 C ATOM 986 O ASN A 74 107.391 -21.984 -1.459 1.00 0.00 O ATOM 987 CB ASN A 74 109.270 -21.789 0.780 1.00 0.00 C ATOM 988 CG ASN A 74 108.316 -22.192 1.906 1.00 0.00 C ATOM 989 OD1 ASN A 74 107.230 -21.660 2.018 1.00 0.00 O ATOM 990 ND2 ASN A 74 108.679 -23.118 2.751 1.00 0.00 N ATOM 0 H ASN A 74 110.471 -21.450 -1.337 1.00 0.00 H new ATOM 0 HA ASN A 74 109.485 -23.863 0.135 1.00 0.00 H new ATOM 0 HB2 ASN A 74 110.275 -21.641 1.175 1.00 0.00 H new ATOM 0 HB3 ASN A 74 108.956 -20.840 0.344 1.00 0.00 H new ATOM 0 HD21 ASN A 74 108.051 -23.395 3.505 1.00 0.00 H new ATOM 0 HD22 ASN A 74 109.591 -23.565 2.657 1.00 0.00 H new ATOM 996 N ASP A 75 107.353 -24.148 -1.047 1.00 0.00 N ATOM 997 CA ASP A 75 106.025 -24.325 -1.713 1.00 0.00 C ATOM 998 C ASP A 75 106.040 -23.711 -3.126 1.00 0.00 C ATOM 999 O ASP A 75 106.419 -24.362 -4.081 1.00 0.00 O ATOM 1000 CB ASP A 75 105.019 -23.613 -0.798 1.00 0.00 C ATOM 1001 CG ASP A 75 104.925 -24.345 0.547 1.00 0.00 C ATOM 1002 OD1 ASP A 75 105.351 -25.488 0.615 1.00 0.00 O ATOM 1003 OD2 ASP A 75 104.427 -23.748 1.487 1.00 0.00 O ATOM 0 H ASP A 75 107.757 -25.002 -0.663 1.00 0.00 H new ATOM 0 HA ASP A 75 105.766 -25.375 -1.846 1.00 0.00 H new ATOM 0 HB2 ASP A 75 105.328 -22.580 -0.638 1.00 0.00 H new ATOM 0 HB3 ASP A 75 104.039 -23.583 -1.275 1.00 0.00 H new ATOM 1007 N TRP A 76 105.639 -22.469 -3.275 1.00 0.00 N ATOM 1008 CA TRP A 76 105.645 -21.837 -4.627 1.00 0.00 C ATOM 1009 C TRP A 76 106.340 -20.474 -4.576 1.00 0.00 C ATOM 1010 O TRP A 76 106.158 -19.711 -3.646 1.00 0.00 O ATOM 1011 CB TRP A 76 104.171 -21.674 -4.994 1.00 0.00 C ATOM 1012 CG TRP A 76 103.552 -23.020 -5.186 1.00 0.00 C ATOM 1013 CD1 TRP A 76 102.755 -23.646 -4.289 1.00 0.00 C ATOM 1014 CD2 TRP A 76 103.662 -23.917 -6.330 1.00 0.00 C ATOM 1015 NE1 TRP A 76 102.372 -24.869 -4.808 1.00 0.00 N ATOM 1016 CE2 TRP A 76 102.905 -25.081 -6.064 1.00 0.00 C ATOM 1017 CE3 TRP A 76 104.339 -23.832 -7.560 1.00 0.00 C ATOM 1018 CZ2 TRP A 76 102.822 -26.126 -6.986 1.00 0.00 C ATOM 1019 CZ3 TRP A 76 104.259 -24.882 -8.490 1.00 0.00 C ATOM 1020 CH2 TRP A 76 103.501 -26.026 -8.202 1.00 0.00 C ATOM 0 H TRP A 76 105.309 -21.870 -2.518 1.00 0.00 H new ATOM 0 HA TRP A 76 106.184 -22.438 -5.359 1.00 0.00 H new ATOM 0 HB2 TRP A 76 103.648 -21.130 -4.207 1.00 0.00 H new ATOM 0 HB3 TRP A 76 104.076 -21.085 -5.906 1.00 0.00 H new ATOM 0 HD1 TRP A 76 102.465 -23.254 -3.325 1.00 0.00 H new ATOM 0 HE1 TRP A 76 101.769 -25.533 -4.322 1.00 0.00 H new ATOM 0 HE3 TRP A 76 104.924 -22.954 -7.791 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 102.237 -27.005 -6.760 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 104.784 -24.808 -9.431 1.00 0.00 H new ATOM 0 HH2 TRP A 76 103.442 -26.830 -8.921 1.00 0.00 H new ATOM 1030 N ALA A 77 107.127 -20.157 -5.575 1.00 0.00 N ATOM 1031 CA ALA A 77 107.834 -18.836 -5.605 1.00 0.00 C ATOM 1032 C ALA A 77 108.536 -18.554 -4.271 1.00 0.00 C ATOM 1033 O ALA A 77 108.678 -19.428 -3.439 1.00 0.00 O ATOM 1034 CB ALA A 77 106.725 -17.812 -5.851 1.00 0.00 C ATOM 0 H ALA A 77 107.312 -20.760 -6.377 1.00 0.00 H new ATOM 0 HA ALA A 77 108.610 -18.807 -6.370 1.00 0.00 H new ATOM 0 HB1 ALA A 77 107.155 -16.811 -5.888 1.00 0.00 H new ATOM 0 HB2 ALA A 77 106.232 -18.030 -6.798 1.00 0.00 H new ATOM 0 HB3 ALA A 77 105.996 -17.864 -5.042 1.00 0.00 H new ATOM 1040 N SER A 78 108.968 -17.335 -4.060 1.00 0.00 N ATOM 1041 CA SER A 78 109.655 -16.995 -2.771 1.00 0.00 C ATOM 1042 C SER A 78 108.811 -15.978 -1.999 1.00 0.00 C ATOM 1043 O SER A 78 108.152 -15.150 -2.591 1.00 0.00 O ATOM 1044 CB SER A 78 110.995 -16.385 -3.176 1.00 0.00 C ATOM 1045 OG SER A 78 111.690 -17.294 -4.018 1.00 0.00 O ATOM 0 H SER A 78 108.876 -16.563 -4.720 1.00 0.00 H new ATOM 0 HA SER A 78 109.792 -17.864 -2.127 1.00 0.00 H new ATOM 0 HB2 SER A 78 110.835 -15.440 -3.695 1.00 0.00 H new ATOM 0 HB3 SER A 78 111.590 -16.165 -2.290 1.00 0.00 H new ATOM 0 HG SER A 78 112.001 -16.825 -4.820 1.00 0.00 H new ATOM 1050 N ILE A 79 108.807 -16.038 -0.688 1.00 0.00 N ATOM 1051 CA ILE A 79 107.978 -15.064 0.094 1.00 0.00 C ATOM 1052 C ILE A 79 108.793 -14.421 1.221 1.00 0.00 C ATOM 1053 O ILE A 79 109.548 -15.082 1.907 1.00 0.00 O ATOM 1054 CB ILE A 79 106.830 -15.897 0.675 1.00 0.00 C ATOM 1055 CG1 ILE A 79 106.056 -16.573 -0.461 1.00 0.00 C ATOM 1056 CG2 ILE A 79 105.882 -14.987 1.459 1.00 0.00 C ATOM 1057 CD1 ILE A 79 105.013 -17.526 0.127 1.00 0.00 C ATOM 0 H ILE A 79 109.335 -16.710 -0.131 1.00 0.00 H new ATOM 0 HA ILE A 79 107.623 -14.246 -0.533 1.00 0.00 H new ATOM 0 HB ILE A 79 107.240 -16.658 1.339 1.00 0.00 H new ATOM 0 HG12 ILE A 79 105.568 -15.821 -1.081 1.00 0.00 H new ATOM 0 HG13 ILE A 79 106.742 -17.121 -1.106 1.00 0.00 H new ATOM 0 HG21 ILE A 79 105.066 -15.581 1.872 1.00 0.00 H new ATOM 0 HG22 ILE A 79 106.428 -14.506 2.271 1.00 0.00 H new ATOM 0 HG23 ILE A 79 105.476 -14.225 0.794 1.00 0.00 H new ATOM 0 HD11 ILE A 79 104.463 -18.007 -0.682 1.00 0.00 H new ATOM 0 HD12 ILE A 79 105.512 -18.286 0.728 1.00 0.00 H new ATOM 0 HD13 ILE A 79 104.320 -16.965 0.754 1.00 0.00 H new ATOM 1068 N TYR A 80 108.631 -13.136 1.424 1.00 0.00 N ATOM 1069 CA TYR A 80 109.385 -12.454 2.518 1.00 0.00 C ATOM 1070 C TYR A 80 108.506 -11.393 3.195 1.00 0.00 C ATOM 1071 O TYR A 80 107.556 -10.900 2.618 1.00 0.00 O ATOM 1072 CB TYR A 80 110.603 -11.823 1.829 1.00 0.00 C ATOM 1073 CG TYR A 80 110.170 -10.705 0.907 1.00 0.00 C ATOM 1074 CD1 TYR A 80 109.752 -10.995 -0.396 1.00 0.00 C ATOM 1075 CD2 TYR A 80 110.192 -9.379 1.357 1.00 0.00 C ATOM 1076 CE1 TYR A 80 109.355 -9.959 -1.251 1.00 0.00 C ATOM 1077 CE2 TYR A 80 109.796 -8.343 0.502 1.00 0.00 C ATOM 1078 CZ TYR A 80 109.378 -8.634 -0.801 1.00 0.00 C ATOM 1079 OH TYR A 80 108.989 -7.612 -1.644 1.00 0.00 O ATOM 0 H TYR A 80 108.012 -12.534 0.881 1.00 0.00 H new ATOM 0 HA TYR A 80 109.688 -13.142 3.307 1.00 0.00 H new ATOM 0 HB2 TYR A 80 111.293 -11.437 2.579 1.00 0.00 H new ATOM 0 HB3 TYR A 80 111.141 -12.582 1.262 1.00 0.00 H new ATOM 0 HD1 TYR A 80 109.735 -12.018 -0.743 1.00 0.00 H new ATOM 0 HD2 TYR A 80 110.514 -9.155 2.363 1.00 0.00 H new ATOM 0 HE1 TYR A 80 109.031 -10.183 -2.257 1.00 0.00 H new ATOM 0 HE2 TYR A 80 109.813 -7.320 0.848 1.00 0.00 H new ATOM 0 HH TYR A 80 108.670 -7.990 -2.490 1.00 0.00 H new ATOM 1088 N GLY A 81 108.822 -11.040 4.415 1.00 0.00 N ATOM 1089 CA GLY A 81 108.013 -10.011 5.136 1.00 0.00 C ATOM 1090 C GLY A 81 108.804 -8.706 5.206 1.00 0.00 C ATOM 1091 O GLY A 81 109.998 -8.685 4.979 1.00 0.00 O ATOM 0 H GLY A 81 109.607 -11.421 4.944 1.00 0.00 H new ATOM 0 HA2 GLY A 81 107.067 -9.849 4.620 1.00 0.00 H new ATOM 0 HA3 GLY A 81 107.773 -10.359 6.141 1.00 0.00 H new ATOM 1094 N VAL A 82 108.152 -7.613 5.512 1.00 0.00 N ATOM 1095 CA VAL A 82 108.879 -6.312 5.589 1.00 0.00 C ATOM 1096 C VAL A 82 108.396 -5.480 6.783 1.00 0.00 C ATOM 1097 O VAL A 82 107.212 -5.301 6.992 1.00 0.00 O ATOM 1098 CB VAL A 82 108.554 -5.599 4.273 1.00 0.00 C ATOM 1099 CG1 VAL A 82 109.304 -4.266 4.209 1.00 0.00 C ATOM 1100 CG2 VAL A 82 108.983 -6.474 3.091 1.00 0.00 C ATOM 0 H VAL A 82 107.153 -7.566 5.711 1.00 0.00 H new ATOM 0 HA VAL A 82 109.950 -6.456 5.729 1.00 0.00 H new ATOM 0 HB VAL A 82 107.480 -5.418 4.223 1.00 0.00 H new ATOM 0 HG11 VAL A 82 109.070 -3.762 3.271 1.00 0.00 H new ATOM 0 HG12 VAL A 82 108.999 -3.637 5.045 1.00 0.00 H new ATOM 0 HG13 VAL A 82 110.377 -4.449 4.265 1.00 0.00 H new ATOM 0 HG21 VAL A 82 108.750 -5.963 2.157 1.00 0.00 H new ATOM 0 HG22 VAL A 82 110.056 -6.659 3.146 1.00 0.00 H new ATOM 0 HG23 VAL A 82 108.449 -7.423 3.128 1.00 0.00 H new ATOM 1110 N VAL A 83 109.314 -4.948 7.543 1.00 0.00 N ATOM 1111 CA VAL A 83 108.949 -4.090 8.710 1.00 0.00 C ATOM 1112 C VAL A 83 109.958 -2.943 8.793 1.00 0.00 C ATOM 1113 O VAL A 83 111.087 -3.099 8.382 1.00 0.00 O ATOM 1114 CB VAL A 83 109.040 -4.999 9.940 1.00 0.00 C ATOM 1115 CG1 VAL A 83 108.004 -6.119 9.824 1.00 0.00 C ATOM 1116 CG2 VAL A 83 110.440 -5.617 10.037 1.00 0.00 C ATOM 0 H VAL A 83 110.317 -5.073 7.404 1.00 0.00 H new ATOM 0 HA VAL A 83 107.952 -3.657 8.632 1.00 0.00 H new ATOM 0 HB VAL A 83 108.847 -4.405 10.833 1.00 0.00 H new ATOM 0 HG11 VAL A 83 108.068 -6.766 10.699 1.00 0.00 H new ATOM 0 HG12 VAL A 83 107.005 -5.686 9.765 1.00 0.00 H new ATOM 0 HG13 VAL A 83 108.199 -6.704 8.925 1.00 0.00 H new ATOM 0 HG21 VAL A 83 110.493 -6.261 10.915 1.00 0.00 H new ATOM 0 HG22 VAL A 83 110.641 -6.206 9.142 1.00 0.00 H new ATOM 0 HG23 VAL A 83 111.183 -4.824 10.123 1.00 0.00 H new ATOM 1126 N GLY A 84 109.587 -1.802 9.322 1.00 0.00 N ATOM 1127 CA GLY A 84 110.565 -0.695 9.407 1.00 0.00 C ATOM 1128 C GLY A 84 109.860 0.629 9.679 1.00 0.00 C ATOM 1129 O GLY A 84 108.742 0.674 10.154 1.00 0.00 O ATOM 0 H GLY A 84 108.658 -1.599 9.692 1.00 0.00 H new ATOM 0 HA2 GLY A 84 111.284 -0.899 10.200 1.00 0.00 H new ATOM 0 HA3 GLY A 84 111.128 -0.628 8.476 1.00 0.00 H new ATOM 1132 N VAL A 85 110.539 1.705 9.408 1.00 0.00 N ATOM 1133 CA VAL A 85 109.954 3.055 9.677 1.00 0.00 C ATOM 1134 C VAL A 85 110.062 3.998 8.469 1.00 0.00 C ATOM 1135 O VAL A 85 110.830 3.789 7.550 1.00 0.00 O ATOM 1136 CB VAL A 85 110.755 3.608 10.859 1.00 0.00 C ATOM 1137 CG1 VAL A 85 110.588 2.687 12.068 1.00 0.00 C ATOM 1138 CG2 VAL A 85 112.239 3.690 10.487 1.00 0.00 C ATOM 0 H VAL A 85 111.478 1.713 9.010 1.00 0.00 H new ATOM 0 HA VAL A 85 108.887 2.977 9.887 1.00 0.00 H new ATOM 0 HB VAL A 85 110.387 4.604 11.104 1.00 0.00 H new ATOM 0 HG11 VAL A 85 111.159 3.082 12.908 1.00 0.00 H new ATOM 0 HG12 VAL A 85 109.534 2.631 12.340 1.00 0.00 H new ATOM 0 HG13 VAL A 85 110.952 1.690 11.819 1.00 0.00 H new ATOM 0 HG21 VAL A 85 112.805 4.084 11.331 1.00 0.00 H new ATOM 0 HG22 VAL A 85 112.607 2.695 10.237 1.00 0.00 H new ATOM 0 HG23 VAL A 85 112.363 4.349 9.628 1.00 0.00 H new ATOM 1148 N GLY A 86 109.282 5.045 8.503 1.00 0.00 N ATOM 1149 CA GLY A 86 109.295 6.052 7.399 1.00 0.00 C ATOM 1150 C GLY A 86 109.107 7.456 7.976 1.00 0.00 C ATOM 1151 O GLY A 86 108.282 7.665 8.845 1.00 0.00 O ATOM 0 H GLY A 86 108.627 5.249 9.258 1.00 0.00 H new ATOM 0 HA2 GLY A 86 110.238 5.996 6.854 1.00 0.00 H new ATOM 0 HA3 GLY A 86 108.501 5.833 6.685 1.00 0.00 H new ATOM 1154 N TYR A 87 109.848 8.431 7.494 1.00 0.00 N ATOM 1155 CA TYR A 87 109.670 9.815 8.025 1.00 0.00 C ATOM 1156 C TYR A 87 110.014 10.855 6.953 1.00 0.00 C ATOM 1157 O TYR A 87 110.637 10.549 5.954 1.00 0.00 O ATOM 1158 CB TYR A 87 110.595 9.921 9.251 1.00 0.00 C ATOM 1159 CG TYR A 87 112.056 9.957 8.849 1.00 0.00 C ATOM 1160 CD1 TYR A 87 112.616 11.133 8.335 1.00 0.00 C ATOM 1161 CD2 TYR A 87 112.851 8.816 9.010 1.00 0.00 C ATOM 1162 CE1 TYR A 87 113.969 11.168 7.980 1.00 0.00 C ATOM 1163 CE2 TYR A 87 114.206 8.852 8.659 1.00 0.00 C ATOM 1164 CZ TYR A 87 114.764 10.027 8.143 1.00 0.00 C ATOM 1165 OH TYR A 87 116.100 10.063 7.798 1.00 0.00 O ATOM 0 H TYR A 87 110.556 8.327 6.767 1.00 0.00 H new ATOM 0 HA TYR A 87 108.636 10.012 8.308 1.00 0.00 H new ATOM 0 HB2 TYR A 87 110.350 10.821 9.815 1.00 0.00 H new ATOM 0 HB3 TYR A 87 110.420 9.073 9.913 1.00 0.00 H new ATOM 0 HD1 TYR A 87 112.003 12.014 8.212 1.00 0.00 H new ATOM 0 HD2 TYR A 87 112.419 7.908 9.405 1.00 0.00 H new ATOM 0 HE1 TYR A 87 114.400 12.074 7.581 1.00 0.00 H new ATOM 0 HE2 TYR A 87 114.820 7.973 8.786 1.00 0.00 H new ATOM 0 HH TYR A 87 116.275 9.400 7.098 1.00 0.00 H new ATOM 1174 N GLY A 88 109.605 12.080 7.156 1.00 0.00 N ATOM 1175 CA GLY A 88 109.898 13.144 6.154 1.00 0.00 C ATOM 1176 C GLY A 88 110.739 14.246 6.802 1.00 0.00 C ATOM 1177 O GLY A 88 110.532 14.610 7.945 1.00 0.00 O ATOM 0 H GLY A 88 109.080 12.389 7.974 1.00 0.00 H new ATOM 0 HA2 GLY A 88 110.431 12.719 5.304 1.00 0.00 H new ATOM 0 HA3 GLY A 88 108.967 13.562 5.770 1.00 0.00 H new ATOM 1180 N LYS A 89 111.684 14.776 6.070 1.00 0.00 N ATOM 1181 CA LYS A 89 112.553 15.859 6.619 1.00 0.00 C ATOM 1182 C LYS A 89 112.685 16.991 5.597 1.00 0.00 C ATOM 1183 O LYS A 89 112.792 16.755 4.409 1.00 0.00 O ATOM 1184 CB LYS A 89 113.909 15.195 6.860 1.00 0.00 C ATOM 1185 CG LYS A 89 114.847 16.186 7.554 1.00 0.00 C ATOM 1186 CD LYS A 89 116.227 15.549 7.727 1.00 0.00 C ATOM 1187 CE LYS A 89 117.125 16.488 8.536 1.00 0.00 C ATOM 1188 NZ LYS A 89 118.194 15.612 9.090 1.00 0.00 N ATOM 0 H LYS A 89 111.892 14.503 5.109 1.00 0.00 H new ATOM 0 HA LYS A 89 112.146 16.296 7.531 1.00 0.00 H new ATOM 0 HB2 LYS A 89 113.785 14.304 7.475 1.00 0.00 H new ATOM 0 HB3 LYS A 89 114.341 14.871 5.913 1.00 0.00 H new ATOM 0 HG2 LYS A 89 114.928 17.100 6.965 1.00 0.00 H new ATOM 0 HG3 LYS A 89 114.441 16.468 8.525 1.00 0.00 H new ATOM 0 HD2 LYS A 89 116.135 14.589 8.235 1.00 0.00 H new ATOM 0 HD3 LYS A 89 116.673 15.352 6.752 1.00 0.00 H new ATOM 0 HE2 LYS A 89 117.544 17.273 7.907 1.00 0.00 H new ATOM 0 HE3 LYS A 89 116.566 16.981 9.332 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 118.851 16.183 9.658 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 117.765 14.878 9.690 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 118.713 15.162 8.309 1.00 0.00 H new ATOM 1198 N PHE A 90 112.678 18.219 6.048 1.00 0.00 N ATOM 1199 CA PHE A 90 112.804 19.366 5.101 1.00 0.00 C ATOM 1200 C PHE A 90 114.246 19.883 5.088 1.00 0.00 C ATOM 1201 O PHE A 90 114.845 20.098 6.125 1.00 0.00 O ATOM 1202 CB PHE A 90 111.855 20.436 5.645 1.00 0.00 C ATOM 1203 CG PHE A 90 110.437 19.917 5.609 1.00 0.00 C ATOM 1204 CD1 PHE A 90 109.679 20.029 4.437 1.00 0.00 C ATOM 1205 CD2 PHE A 90 109.880 19.325 6.749 1.00 0.00 C ATOM 1206 CE1 PHE A 90 108.364 19.549 4.405 1.00 0.00 C ATOM 1207 CE2 PHE A 90 108.565 18.844 6.716 1.00 0.00 C ATOM 1208 CZ PHE A 90 107.808 18.956 5.545 1.00 0.00 C ATOM 0 H PHE A 90 112.590 18.477 7.031 1.00 0.00 H new ATOM 0 HA PHE A 90 112.557 19.086 4.077 1.00 0.00 H new ATOM 0 HB2 PHE A 90 112.132 20.698 6.666 1.00 0.00 H new ATOM 0 HB3 PHE A 90 111.936 21.346 5.050 1.00 0.00 H new ATOM 0 HD1 PHE A 90 110.109 20.486 3.558 1.00 0.00 H new ATOM 0 HD2 PHE A 90 110.464 19.239 7.653 1.00 0.00 H new ATOM 0 HE1 PHE A 90 107.779 19.636 3.501 1.00 0.00 H new ATOM 0 HE2 PHE A 90 108.135 18.386 7.595 1.00 0.00 H new ATOM 0 HZ PHE A 90 106.794 18.585 5.520 1.00 0.00 H new ATOM 1217 N GLN A 91 114.807 20.078 3.923 1.00 0.00 N ATOM 1218 CA GLN A 91 116.213 20.576 3.838 1.00 0.00 C ATOM 1219 C GLN A 91 116.244 22.108 3.722 1.00 0.00 C ATOM 1220 O GLN A 91 117.227 22.681 3.294 1.00 0.00 O ATOM 1221 CB GLN A 91 116.801 19.920 2.580 1.00 0.00 C ATOM 1222 CG GLN A 91 116.098 20.447 1.322 1.00 0.00 C ATOM 1223 CD GLN A 91 116.711 19.792 0.083 1.00 0.00 C ATOM 1224 OE1 GLN A 91 116.361 18.684 -0.270 1.00 0.00 O ATOM 1225 NE2 GLN A 91 117.618 20.437 -0.598 1.00 0.00 N ATOM 0 H GLN A 91 114.352 19.914 3.025 1.00 0.00 H new ATOM 0 HA GLN A 91 116.786 20.324 4.730 1.00 0.00 H new ATOM 0 HB2 GLN A 91 117.870 20.127 2.520 1.00 0.00 H new ATOM 0 HB3 GLN A 91 116.688 18.838 2.640 1.00 0.00 H new ATOM 0 HG2 GLN A 91 115.031 20.230 1.371 1.00 0.00 H new ATOM 0 HG3 GLN A 91 116.201 21.531 1.262 1.00 0.00 H new ATOM 0 HE21 GLN A 91 117.912 21.368 -0.302 1.00 0.00 H new ATOM 0 HE22 GLN A 91 118.033 20.011 -1.427 1.00 0.00 H new ATOM 1232 N THR A 92 115.179 22.771 4.093 1.00 0.00 N ATOM 1233 CA THR A 92 115.156 24.263 3.993 1.00 0.00 C ATOM 1234 C THR A 92 116.075 24.875 5.055 1.00 0.00 C ATOM 1235 O THR A 92 116.393 24.249 6.048 1.00 0.00 O ATOM 1236 CB THR A 92 113.702 24.671 4.249 1.00 0.00 C ATOM 1237 OG1 THR A 92 113.343 24.335 5.582 1.00 0.00 O ATOM 1238 CG2 THR A 92 112.776 23.948 3.267 1.00 0.00 C ATOM 0 H THR A 92 114.327 22.347 4.460 1.00 0.00 H new ATOM 0 HA THR A 92 115.506 24.611 3.021 1.00 0.00 H new ATOM 0 HB THR A 92 113.601 25.747 4.106 1.00 0.00 H new ATOM 0 HG1 THR A 92 112.413 24.598 5.746 1.00 0.00 H new ATOM 0 HG21 THR A 92 111.744 24.243 3.455 1.00 0.00 H new ATOM 0 HG22 THR A 92 113.049 24.215 2.246 1.00 0.00 H new ATOM 0 HG23 THR A 92 112.875 22.871 3.400 1.00 0.00 H new ATOM 1246 N THR A 93 116.506 26.093 4.849 1.00 0.00 N ATOM 1247 CA THR A 93 117.409 26.750 5.843 1.00 0.00 C ATOM 1248 C THR A 93 116.743 26.798 7.221 1.00 0.00 C ATOM 1249 O THR A 93 117.380 26.579 8.233 1.00 0.00 O ATOM 1250 CB THR A 93 117.631 28.167 5.309 1.00 0.00 C ATOM 1251 OG1 THR A 93 118.118 28.098 3.976 1.00 0.00 O ATOM 1252 CG2 THR A 93 118.648 28.893 6.190 1.00 0.00 C ATOM 0 H THR A 93 116.272 26.662 4.035 1.00 0.00 H new ATOM 0 HA THR A 93 118.347 26.207 5.962 1.00 0.00 H new ATOM 0 HB THR A 93 116.688 28.713 5.323 1.00 0.00 H new ATOM 0 HG1 THR A 93 118.259 29.005 3.632 1.00 0.00 H new ATOM 0 HG21 THR A 93 118.805 29.902 5.809 1.00 0.00 H new ATOM 0 HG22 THR A 93 118.272 28.946 7.212 1.00 0.00 H new ATOM 0 HG23 THR A 93 119.593 28.350 6.179 1.00 0.00 H new ATOM 1260 N GLU A 94 115.461 27.075 7.263 1.00 0.00 N ATOM 1261 CA GLU A 94 114.731 27.139 8.569 1.00 0.00 C ATOM 1262 C GLU A 94 115.399 28.149 9.515 1.00 0.00 C ATOM 1263 O GLU A 94 116.518 28.573 9.301 1.00 0.00 O ATOM 1264 CB GLU A 94 114.807 25.717 9.142 1.00 0.00 C ATOM 1265 CG GLU A 94 113.930 25.612 10.395 1.00 0.00 C ATOM 1266 CD GLU A 94 114.037 24.204 10.994 1.00 0.00 C ATOM 1267 OE1 GLU A 94 114.792 23.402 10.466 1.00 0.00 O ATOM 1268 OE2 GLU A 94 113.359 23.950 11.977 1.00 0.00 O ATOM 0 H GLU A 94 114.885 27.261 6.442 1.00 0.00 H new ATOM 0 HA GLU A 94 113.700 27.470 8.445 1.00 0.00 H new ATOM 0 HB2 GLU A 94 114.476 24.996 8.394 1.00 0.00 H new ATOM 0 HB3 GLU A 94 115.840 25.469 9.388 1.00 0.00 H new ATOM 0 HG2 GLU A 94 114.242 26.354 11.130 1.00 0.00 H new ATOM 0 HG3 GLU A 94 112.893 25.831 10.142 1.00 0.00 H new ATOM 1273 N TYR A 95 114.713 28.539 10.558 1.00 0.00 N ATOM 1274 CA TYR A 95 115.297 29.522 11.524 1.00 0.00 C ATOM 1275 C TYR A 95 116.612 28.980 12.103 1.00 0.00 C ATOM 1276 O TYR A 95 116.912 27.812 11.955 1.00 0.00 O ATOM 1277 CB TYR A 95 114.247 29.671 12.630 1.00 0.00 C ATOM 1278 CG TYR A 95 113.528 30.991 12.475 1.00 0.00 C ATOM 1279 CD1 TYR A 95 112.888 31.302 11.270 1.00 0.00 C ATOM 1280 CD2 TYR A 95 113.504 31.904 13.537 1.00 0.00 C ATOM 1281 CE1 TYR A 95 112.224 32.527 11.126 1.00 0.00 C ATOM 1282 CE2 TYR A 95 112.839 33.127 13.393 1.00 0.00 C ATOM 1283 CZ TYR A 95 112.198 33.439 12.188 1.00 0.00 C ATOM 1284 OH TYR A 95 111.543 34.644 12.046 1.00 0.00 O ATOM 0 H TYR A 95 113.771 28.219 10.784 1.00 0.00 H new ATOM 0 HA TYR A 95 115.526 30.476 11.050 1.00 0.00 H new ATOM 0 HB2 TYR A 95 113.533 28.849 12.580 1.00 0.00 H new ATOM 0 HB3 TYR A 95 114.725 29.619 13.608 1.00 0.00 H new ATOM 0 HD1 TYR A 95 112.906 30.598 10.451 1.00 0.00 H new ATOM 0 HD2 TYR A 95 113.999 31.664 14.467 1.00 0.00 H new ATOM 0 HE1 TYR A 95 111.732 32.768 10.195 1.00 0.00 H new ATOM 0 HE2 TYR A 95 112.820 33.831 14.212 1.00 0.00 H new ATOM 0 HH TYR A 95 111.620 35.158 12.877 1.00 0.00 H new ATOM 1293 N PRO A 96 117.360 29.847 12.744 1.00 0.00 N ATOM 1294 CA PRO A 96 118.657 29.433 13.343 1.00 0.00 C ATOM 1295 C PRO A 96 118.431 28.413 14.467 1.00 0.00 C ATOM 1296 O PRO A 96 119.346 27.731 14.887 1.00 0.00 O ATOM 1297 CB PRO A 96 119.239 30.741 13.878 1.00 0.00 C ATOM 1298 CG PRO A 96 118.054 31.627 14.079 1.00 0.00 C ATOM 1299 CD PRO A 96 117.080 31.270 12.990 1.00 0.00 C ATOM 0 HA PRO A 96 119.324 28.943 12.633 1.00 0.00 H new ATOM 0 HB2 PRO A 96 119.778 30.582 14.812 1.00 0.00 H new ATOM 0 HB3 PRO A 96 119.946 31.178 13.173 1.00 0.00 H new ATOM 0 HG2 PRO A 96 117.613 31.471 15.063 1.00 0.00 H new ATOM 0 HG3 PRO A 96 118.338 32.678 14.020 1.00 0.00 H new ATOM 0 HD2 PRO A 96 116.048 31.429 13.304 1.00 0.00 H new ATOM 0 HD3 PRO A 96 117.237 31.872 12.095 1.00 0.00 H new ATOM 1304 N THR A 97 117.219 28.297 14.947 1.00 0.00 N ATOM 1305 CA THR A 97 116.931 27.314 16.033 1.00 0.00 C ATOM 1306 C THR A 97 115.736 26.440 15.636 1.00 0.00 C ATOM 1307 O THR A 97 114.911 26.835 14.833 1.00 0.00 O ATOM 1308 CB THR A 97 116.614 28.168 17.268 1.00 0.00 C ATOM 1309 OG1 THR A 97 116.478 27.323 18.401 1.00 0.00 O ATOM 1310 CG2 THR A 97 115.316 28.954 17.051 1.00 0.00 C ATOM 0 H THR A 97 116.416 28.842 14.633 1.00 0.00 H new ATOM 0 HA THR A 97 117.764 26.637 16.224 1.00 0.00 H new ATOM 0 HB THR A 97 117.428 28.874 17.432 1.00 0.00 H new ATOM 0 HG1 THR A 97 116.277 27.866 19.192 1.00 0.00 H new ATOM 0 HG21 THR A 97 115.103 29.556 17.935 1.00 0.00 H new ATOM 0 HG22 THR A 97 115.427 29.607 16.185 1.00 0.00 H new ATOM 0 HG23 THR A 97 114.494 28.259 16.878 1.00 0.00 H new ATOM 1318 N TYR A 98 115.638 25.259 16.184 1.00 0.00 N ATOM 1319 CA TYR A 98 114.497 24.364 15.828 1.00 0.00 C ATOM 1320 C TYR A 98 113.928 23.680 17.076 1.00 0.00 C ATOM 1321 O TYR A 98 114.634 23.411 18.028 1.00 0.00 O ATOM 1322 CB TYR A 98 115.094 23.341 14.849 1.00 0.00 C ATOM 1323 CG TYR A 98 116.150 22.506 15.541 1.00 0.00 C ATOM 1324 CD1 TYR A 98 117.429 23.034 15.755 1.00 0.00 C ATOM 1325 CD2 TYR A 98 115.854 21.202 15.960 1.00 0.00 C ATOM 1326 CE1 TYR A 98 118.409 22.261 16.390 1.00 0.00 C ATOM 1327 CE2 TYR A 98 116.834 20.430 16.595 1.00 0.00 C ATOM 1328 CZ TYR A 98 118.112 20.960 16.810 1.00 0.00 C ATOM 1329 OH TYR A 98 119.078 20.199 17.436 1.00 0.00 O ATOM 0 H TYR A 98 116.297 24.875 16.862 1.00 0.00 H new ATOM 0 HA TYR A 98 113.664 24.910 15.385 1.00 0.00 H new ATOM 0 HB2 TYR A 98 114.306 22.695 14.462 1.00 0.00 H new ATOM 0 HB3 TYR A 98 115.531 23.857 13.995 1.00 0.00 H new ATOM 0 HD1 TYR A 98 117.660 24.038 15.430 1.00 0.00 H new ATOM 0 HD2 TYR A 98 114.869 20.792 15.793 1.00 0.00 H new ATOM 0 HE1 TYR A 98 119.395 22.670 16.556 1.00 0.00 H new ATOM 0 HE2 TYR A 98 116.604 19.426 16.919 1.00 0.00 H new ATOM 0 HH TYR A 98 118.706 19.321 17.663 1.00 0.00 H new ATOM 1338 N LYS A 99 112.649 23.400 17.070 1.00 0.00 N ATOM 1339 CA LYS A 99 112.012 22.734 18.245 1.00 0.00 C ATOM 1340 C LYS A 99 112.073 21.206 18.098 1.00 0.00 C ATOM 1341 O LYS A 99 111.531 20.476 18.905 1.00 0.00 O ATOM 1342 CB LYS A 99 110.561 23.215 18.226 1.00 0.00 C ATOM 1343 CG LYS A 99 110.523 24.735 18.396 1.00 0.00 C ATOM 1344 CD LYS A 99 109.069 25.206 18.476 1.00 0.00 C ATOM 1345 CE LYS A 99 109.028 26.737 18.496 1.00 0.00 C ATOM 1346 NZ LYS A 99 107.591 27.081 18.675 1.00 0.00 N ATOM 0 H LYS A 99 112.016 23.606 16.297 1.00 0.00 H new ATOM 0 HA LYS A 99 112.516 22.978 19.180 1.00 0.00 H new ATOM 0 HB2 LYS A 99 110.085 22.932 17.287 1.00 0.00 H new ATOM 0 HB3 LYS A 99 109.997 22.735 19.026 1.00 0.00 H new ATOM 0 HG2 LYS A 99 111.060 25.024 19.300 1.00 0.00 H new ATOM 0 HG3 LYS A 99 111.027 25.218 17.558 1.00 0.00 H new ATOM 0 HD2 LYS A 99 108.506 24.828 17.623 1.00 0.00 H new ATOM 0 HD3 LYS A 99 108.595 24.807 19.373 1.00 0.00 H new ATOM 0 HE2 LYS A 99 109.634 27.138 19.309 1.00 0.00 H new ATOM 0 HE3 LYS A 99 109.421 27.155 17.569 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 107.482 28.115 18.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 107.040 26.693 17.883 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 107.246 26.676 19.569 1.00 0.00 H new ATOM 1356 N ASN A 100 112.725 20.718 17.068 1.00 0.00 N ATOM 1357 CA ASN A 100 112.823 19.239 16.853 1.00 0.00 C ATOM 1358 C ASN A 100 111.426 18.629 16.718 1.00 0.00 C ATOM 1359 O ASN A 100 111.175 17.525 17.163 1.00 0.00 O ATOM 1360 CB ASN A 100 113.537 18.687 18.092 1.00 0.00 C ATOM 1361 CG ASN A 100 114.060 17.280 17.795 1.00 0.00 C ATOM 1362 OD1 ASN A 100 114.871 17.095 16.910 1.00 0.00 O ATOM 1363 ND2 ASN A 100 113.628 16.274 18.506 1.00 0.00 N ATOM 0 H ASN A 100 113.196 21.285 16.363 1.00 0.00 H new ATOM 0 HA ASN A 100 113.365 18.997 15.939 1.00 0.00 H new ATOM 0 HB2 ASN A 100 114.362 19.342 18.371 1.00 0.00 H new ATOM 0 HB3 ASN A 100 112.851 18.660 18.939 1.00 0.00 H new ATOM 0 HD21 ASN A 100 113.972 15.332 18.318 1.00 0.00 H new ATOM 0 HD22 ASN A 100 112.947 16.430 19.249 1.00 0.00 H new ATOM 1369 N ASP A 101 110.519 19.338 16.099 1.00 0.00 N ATOM 1370 CA ASP A 101 109.137 18.804 15.920 1.00 0.00 C ATOM 1371 C ASP A 101 108.672 18.967 14.464 1.00 0.00 C ATOM 1372 O ASP A 101 107.546 18.653 14.131 1.00 0.00 O ATOM 1373 CB ASP A 101 108.266 19.646 16.855 1.00 0.00 C ATOM 1374 CG ASP A 101 108.669 19.394 18.313 1.00 0.00 C ATOM 1375 OD1 ASP A 101 109.300 18.380 18.572 1.00 0.00 O ATOM 1376 OD2 ASP A 101 108.340 20.220 19.147 1.00 0.00 O ATOM 0 H ASP A 101 110.677 20.267 15.708 1.00 0.00 H new ATOM 0 HA ASP A 101 109.080 17.739 16.147 1.00 0.00 H new ATOM 0 HB2 ASP A 101 108.377 20.704 16.616 1.00 0.00 H new ATOM 0 HB3 ASP A 101 107.215 19.395 16.711 1.00 0.00 H new ATOM 1380 N THR A 102 109.525 19.457 13.596 1.00 0.00 N ATOM 1381 CA THR A 102 109.121 19.639 12.169 1.00 0.00 C ATOM 1382 C THR A 102 109.153 18.300 11.425 1.00 0.00 C ATOM 1383 O THR A 102 108.427 18.096 10.470 1.00 0.00 O ATOM 1384 CB THR A 102 110.155 20.602 11.579 1.00 0.00 C ATOM 1385 OG1 THR A 102 111.445 20.011 11.650 1.00 0.00 O ATOM 1386 CG2 THR A 102 110.148 21.916 12.364 1.00 0.00 C ATOM 0 H THR A 102 110.481 19.738 13.815 1.00 0.00 H new ATOM 0 HA THR A 102 108.105 20.024 12.081 1.00 0.00 H new ATOM 0 HB THR A 102 109.905 20.807 10.538 1.00 0.00 H new ATOM 0 HG1 THR A 102 112.108 20.626 11.271 1.00 0.00 H new ATOM 0 HG21 THR A 102 110.886 22.597 11.940 1.00 0.00 H new ATOM 0 HG22 THR A 102 109.159 22.370 12.305 1.00 0.00 H new ATOM 0 HG23 THR A 102 110.395 21.718 13.407 1.00 0.00 H new ATOM 1394 N SER A 103 109.990 17.391 11.851 1.00 0.00 N ATOM 1395 CA SER A 103 110.075 16.069 11.163 1.00 0.00 C ATOM 1396 C SER A 103 108.989 15.124 11.683 1.00 0.00 C ATOM 1397 O SER A 103 108.567 15.214 12.820 1.00 0.00 O ATOM 1398 CB SER A 103 111.462 15.528 11.511 1.00 0.00 C ATOM 1399 OG SER A 103 112.451 16.423 11.020 1.00 0.00 O ATOM 0 H SER A 103 110.619 17.507 12.646 1.00 0.00 H new ATOM 0 HA SER A 103 109.928 16.159 10.087 1.00 0.00 H new ATOM 0 HB2 SER A 103 111.561 15.415 12.591 1.00 0.00 H new ATOM 0 HB3 SER A 103 111.600 14.539 11.073 1.00 0.00 H new ATOM 0 HG SER A 103 113.342 16.080 11.243 1.00 0.00 H new ATOM 1404 N ASP A 104 108.543 14.212 10.858 1.00 0.00 N ATOM 1405 CA ASP A 104 107.490 13.247 11.297 1.00 0.00 C ATOM 1406 C ASP A 104 107.868 11.833 10.853 1.00 0.00 C ATOM 1407 O ASP A 104 108.316 11.630 9.743 1.00 0.00 O ATOM 1408 CB ASP A 104 106.210 13.706 10.594 1.00 0.00 C ATOM 1409 CG ASP A 104 105.810 15.098 11.093 1.00 0.00 C ATOM 1410 OD1 ASP A 104 106.178 15.440 12.205 1.00 0.00 O ATOM 1411 OD2 ASP A 104 105.133 15.795 10.355 1.00 0.00 O ATOM 0 H ASP A 104 108.863 14.094 9.897 1.00 0.00 H new ATOM 0 HA ASP A 104 107.370 13.225 12.380 1.00 0.00 H new ATOM 0 HB2 ASP A 104 106.365 13.728 9.515 1.00 0.00 H new ATOM 0 HB3 ASP A 104 105.405 12.996 10.786 1.00 0.00 H new ATOM 1415 N TYR A 105 107.698 10.854 11.707 1.00 0.00 N ATOM 1416 CA TYR A 105 108.061 9.456 11.325 1.00 0.00 C ATOM 1417 C TYR A 105 106.940 8.477 11.700 1.00 0.00 C ATOM 1418 O TYR A 105 106.011 8.821 12.404 1.00 0.00 O ATOM 1419 CB TYR A 105 109.346 9.157 12.110 1.00 0.00 C ATOM 1420 CG TYR A 105 109.046 9.057 13.590 1.00 0.00 C ATOM 1421 CD1 TYR A 105 109.013 10.213 14.376 1.00 0.00 C ATOM 1422 CD2 TYR A 105 108.801 7.807 14.171 1.00 0.00 C ATOM 1423 CE1 TYR A 105 108.735 10.121 15.745 1.00 0.00 C ATOM 1424 CE2 TYR A 105 108.523 7.714 15.539 1.00 0.00 C ATOM 1425 CZ TYR A 105 108.490 8.871 16.327 1.00 0.00 C ATOM 1426 OH TYR A 105 108.216 8.779 17.676 1.00 0.00 O ATOM 0 H TYR A 105 107.324 10.963 12.650 1.00 0.00 H new ATOM 0 HA TYR A 105 108.206 9.346 10.250 1.00 0.00 H new ATOM 0 HB2 TYR A 105 109.787 8.225 11.758 1.00 0.00 H new ATOM 0 HB3 TYR A 105 110.080 9.943 11.933 1.00 0.00 H new ATOM 0 HD1 TYR A 105 109.202 11.177 13.927 1.00 0.00 H new ATOM 0 HD2 TYR A 105 108.827 6.915 13.563 1.00 0.00 H new ATOM 0 HE1 TYR A 105 108.709 11.014 16.352 1.00 0.00 H new ATOM 0 HE2 TYR A 105 108.334 6.750 15.987 1.00 0.00 H new ATOM 0 HH TYR A 105 108.069 7.840 17.917 1.00 0.00 H new ATOM 1435 N GLY A 106 107.030 7.257 11.235 1.00 0.00 N ATOM 1436 CA GLY A 106 105.982 6.244 11.558 1.00 0.00 C ATOM 1437 C GLY A 106 106.530 4.846 11.263 1.00 0.00 C ATOM 1438 O GLY A 106 107.686 4.687 10.919 1.00 0.00 O ATOM 0 H GLY A 106 107.788 6.918 10.643 1.00 0.00 H new ATOM 0 HA2 GLY A 106 105.694 6.322 12.606 1.00 0.00 H new ATOM 0 HA3 GLY A 106 105.085 6.429 10.967 1.00 0.00 H new ATOM 1441 N PHE A 107 105.719 3.828 11.406 1.00 0.00 N ATOM 1442 CA PHE A 107 106.207 2.438 11.144 1.00 0.00 C ATOM 1443 C PHE A 107 105.532 1.854 9.899 1.00 0.00 C ATOM 1444 O PHE A 107 104.449 2.261 9.522 1.00 0.00 O ATOM 1445 CB PHE A 107 105.818 1.641 12.388 1.00 0.00 C ATOM 1446 CG PHE A 107 106.541 2.197 13.591 1.00 0.00 C ATOM 1447 CD1 PHE A 107 107.828 1.745 13.903 1.00 0.00 C ATOM 1448 CD2 PHE A 107 105.925 3.166 14.393 1.00 0.00 C ATOM 1449 CE1 PHE A 107 108.500 2.261 15.018 1.00 0.00 C ATOM 1450 CE2 PHE A 107 106.597 3.683 15.507 1.00 0.00 C ATOM 1451 CZ PHE A 107 107.884 3.230 15.820 1.00 0.00 C ATOM 0 H PHE A 107 104.742 3.898 11.692 1.00 0.00 H new ATOM 0 HA PHE A 107 107.281 2.411 10.958 1.00 0.00 H new ATOM 0 HB2 PHE A 107 104.740 1.692 12.543 1.00 0.00 H new ATOM 0 HB3 PHE A 107 106.071 0.589 12.253 1.00 0.00 H new ATOM 0 HD1 PHE A 107 108.303 0.998 13.284 1.00 0.00 H new ATOM 0 HD2 PHE A 107 104.932 3.514 14.152 1.00 0.00 H new ATOM 0 HE1 PHE A 107 109.493 1.912 15.259 1.00 0.00 H new ATOM 0 HE2 PHE A 107 106.123 4.431 16.125 1.00 0.00 H new ATOM 0 HZ PHE A 107 108.402 3.628 16.680 1.00 0.00 H new ATOM 1460 N SER A 108 106.167 0.906 9.258 1.00 0.00 N ATOM 1461 CA SER A 108 105.569 0.296 8.033 1.00 0.00 C ATOM 1462 C SER A 108 105.581 -1.234 8.130 1.00 0.00 C ATOM 1463 O SER A 108 106.324 -1.812 8.899 1.00 0.00 O ATOM 1464 CB SER A 108 106.459 0.767 6.884 1.00 0.00 C ATOM 1465 OG SER A 108 107.751 0.190 7.024 1.00 0.00 O ATOM 0 H SER A 108 107.074 0.528 9.531 1.00 0.00 H new ATOM 0 HA SER A 108 104.529 0.591 7.895 1.00 0.00 H new ATOM 0 HB2 SER A 108 106.021 0.479 5.928 1.00 0.00 H new ATOM 0 HB3 SER A 108 106.531 1.855 6.887 1.00 0.00 H new ATOM 0 HG SER A 108 108.039 -0.181 6.164 1.00 0.00 H new ATOM 1470 N TYR A 109 104.769 -1.891 7.342 1.00 0.00 N ATOM 1471 CA TYR A 109 104.730 -3.385 7.364 1.00 0.00 C ATOM 1472 C TYR A 109 104.219 -3.908 6.016 1.00 0.00 C ATOM 1473 O TYR A 109 103.410 -3.270 5.369 1.00 0.00 O ATOM 1474 CB TYR A 109 103.752 -3.740 8.484 1.00 0.00 C ATOM 1475 CG TYR A 109 103.735 -5.236 8.684 1.00 0.00 C ATOM 1476 CD1 TYR A 109 104.676 -5.840 9.527 1.00 0.00 C ATOM 1477 CD2 TYR A 109 102.780 -6.019 8.026 1.00 0.00 C ATOM 1478 CE1 TYR A 109 104.660 -7.228 9.712 1.00 0.00 C ATOM 1479 CE2 TYR A 109 102.765 -7.407 8.211 1.00 0.00 C ATOM 1480 CZ TYR A 109 103.705 -8.011 9.054 1.00 0.00 C ATOM 1481 OH TYR A 109 103.689 -9.379 9.237 1.00 0.00 O ATOM 0 H TYR A 109 104.127 -1.454 6.680 1.00 0.00 H new ATOM 0 HA TYR A 109 105.712 -3.827 7.531 1.00 0.00 H new ATOM 0 HB2 TYR A 109 104.045 -3.242 9.408 1.00 0.00 H new ATOM 0 HB3 TYR A 109 102.752 -3.385 8.234 1.00 0.00 H new ATOM 0 HD1 TYR A 109 105.414 -5.236 10.034 1.00 0.00 H new ATOM 0 HD2 TYR A 109 102.055 -5.553 7.376 1.00 0.00 H new ATOM 0 HE1 TYR A 109 105.385 -7.694 10.363 1.00 0.00 H new ATOM 0 HE2 TYR A 109 102.028 -8.011 7.703 1.00 0.00 H new ATOM 0 HH TYR A 109 102.963 -9.771 8.709 1.00 0.00 H new ATOM 1490 N GLY A 110 104.676 -5.059 5.583 1.00 0.00 N ATOM 1491 CA GLY A 110 104.195 -5.597 4.274 1.00 0.00 C ATOM 1492 C GLY A 110 104.932 -6.891 3.920 1.00 0.00 C ATOM 1493 O GLY A 110 105.736 -7.390 4.677 1.00 0.00 O ATOM 0 H GLY A 110 105.354 -5.642 6.074 1.00 0.00 H new ATOM 0 HA2 GLY A 110 103.122 -5.785 4.324 1.00 0.00 H new ATOM 0 HA3 GLY A 110 104.353 -4.856 3.490 1.00 0.00 H new ATOM 1496 N ALA A 111 104.650 -7.431 2.764 1.00 0.00 N ATOM 1497 CA ALA A 111 105.319 -8.695 2.318 1.00 0.00 C ATOM 1498 C ALA A 111 105.001 -8.923 0.838 1.00 0.00 C ATOM 1499 O ALA A 111 104.048 -8.368 0.326 1.00 0.00 O ATOM 1500 CB ALA A 111 104.707 -9.799 3.180 1.00 0.00 C ATOM 0 H ALA A 111 103.977 -7.048 2.100 1.00 0.00 H new ATOM 0 HA ALA A 111 106.403 -8.667 2.426 1.00 0.00 H new ATOM 0 HB1 ALA A 111 105.149 -10.758 2.910 1.00 0.00 H new ATOM 0 HB2 ALA A 111 104.905 -9.591 4.232 1.00 0.00 H new ATOM 0 HB3 ALA A 111 103.630 -9.836 3.014 1.00 0.00 H new ATOM 1506 N GLY A 112 105.771 -9.720 0.131 1.00 0.00 N ATOM 1507 CA GLY A 112 105.467 -9.940 -1.313 1.00 0.00 C ATOM 1508 C GLY A 112 105.981 -11.318 -1.742 1.00 0.00 C ATOM 1509 O GLY A 112 106.526 -12.059 -0.948 1.00 0.00 O ATOM 0 H GLY A 112 106.585 -10.219 0.489 1.00 0.00 H new ATOM 0 HA2 GLY A 112 104.393 -9.872 -1.483 1.00 0.00 H new ATOM 0 HA3 GLY A 112 105.935 -9.162 -1.916 1.00 0.00 H new ATOM 1512 N LEU A 113 105.810 -11.664 -2.993 1.00 0.00 N ATOM 1513 CA LEU A 113 106.287 -12.995 -3.477 1.00 0.00 C ATOM 1514 C LEU A 113 107.186 -12.815 -4.702 1.00 0.00 C ATOM 1515 O LEU A 113 107.123 -11.800 -5.371 1.00 0.00 O ATOM 1516 CB LEU A 113 105.018 -13.763 -3.851 1.00 0.00 C ATOM 1517 CG LEU A 113 104.137 -13.936 -2.613 1.00 0.00 C ATOM 1518 CD1 LEU A 113 103.199 -12.734 -2.476 1.00 0.00 C ATOM 1519 CD2 LEU A 113 103.310 -15.217 -2.755 1.00 0.00 C ATOM 0 H LEU A 113 105.361 -11.082 -3.700 1.00 0.00 H new ATOM 0 HA LEU A 113 106.873 -13.523 -2.724 1.00 0.00 H new ATOM 0 HB2 LEU A 113 104.471 -13.226 -4.626 1.00 0.00 H new ATOM 0 HB3 LEU A 113 105.279 -14.738 -4.263 1.00 0.00 H new ATOM 0 HG LEU A 113 104.767 -14.003 -1.726 1.00 0.00 H new ATOM 0 HD11 LEU A 113 102.573 -12.860 -1.593 1.00 0.00 H new ATOM 0 HD12 LEU A 113 103.788 -11.822 -2.376 1.00 0.00 H new ATOM 0 HD13 LEU A 113 102.568 -12.662 -3.362 1.00 0.00 H new ATOM 0 HD21 LEU A 113 102.681 -15.343 -1.874 1.00 0.00 H new ATOM 0 HD22 LEU A 113 102.682 -15.148 -3.643 1.00 0.00 H new ATOM 0 HD23 LEU A 113 103.978 -16.073 -2.849 1.00 0.00 H new ATOM 1530 N GLN A 114 108.006 -13.787 -5.030 1.00 0.00 N ATOM 1531 CA GLN A 114 108.881 -13.664 -6.233 1.00 0.00 C ATOM 1532 C GLN A 114 108.319 -14.581 -7.325 1.00 0.00 C ATOM 1533 O GLN A 114 107.857 -15.668 -7.034 1.00 0.00 O ATOM 1534 CB GLN A 114 110.249 -14.161 -5.763 1.00 0.00 C ATOM 1535 CG GLN A 114 111.296 -13.924 -6.849 1.00 0.00 C ATOM 1536 CD GLN A 114 112.595 -14.630 -6.454 1.00 0.00 C ATOM 1537 OE1 GLN A 114 112.755 -15.810 -6.695 1.00 0.00 O ATOM 1538 NE2 GLN A 114 113.531 -13.957 -5.843 1.00 0.00 N ATOM 0 H GLN A 114 108.104 -14.661 -4.513 1.00 0.00 H new ATOM 0 HA GLN A 114 108.940 -12.653 -6.636 1.00 0.00 H new ATOM 0 HB2 GLN A 114 110.538 -13.643 -4.849 1.00 0.00 H new ATOM 0 HB3 GLN A 114 110.196 -15.223 -5.524 1.00 0.00 H new ATOM 0 HG2 GLN A 114 110.938 -14.303 -7.806 1.00 0.00 H new ATOM 0 HG3 GLN A 114 111.472 -12.856 -6.975 1.00 0.00 H new ATOM 0 HE21 GLN A 114 113.397 -12.966 -5.640 1.00 0.00 H new ATOM 0 HE22 GLN A 114 114.396 -14.422 -5.568 1.00 0.00 H new ATOM 1545 N PHE A 115 108.331 -14.154 -8.565 1.00 0.00 N ATOM 1546 CA PHE A 115 107.762 -15.006 -9.654 1.00 0.00 C ATOM 1547 C PHE A 115 108.783 -15.251 -10.766 1.00 0.00 C ATOM 1548 O PHE A 115 109.799 -14.590 -10.852 1.00 0.00 O ATOM 1549 CB PHE A 115 106.572 -14.211 -10.191 1.00 0.00 C ATOM 1550 CG PHE A 115 105.537 -14.052 -9.103 1.00 0.00 C ATOM 1551 CD1 PHE A 115 104.596 -15.063 -8.879 1.00 0.00 C ATOM 1552 CD2 PHE A 115 105.519 -12.893 -8.320 1.00 0.00 C ATOM 1553 CE1 PHE A 115 103.636 -14.915 -7.871 1.00 0.00 C ATOM 1554 CE2 PHE A 115 104.560 -12.744 -7.311 1.00 0.00 C ATOM 1555 CZ PHE A 115 103.618 -13.756 -7.086 1.00 0.00 C ATOM 0 H PHE A 115 108.709 -13.256 -8.868 1.00 0.00 H new ATOM 0 HA PHE A 115 107.476 -15.990 -9.283 1.00 0.00 H new ATOM 0 HB2 PHE A 115 106.903 -13.232 -10.538 1.00 0.00 H new ATOM 0 HB3 PHE A 115 106.137 -14.723 -11.049 1.00 0.00 H new ATOM 0 HD1 PHE A 115 104.610 -15.958 -9.484 1.00 0.00 H new ATOM 0 HD2 PHE A 115 106.245 -12.113 -8.494 1.00 0.00 H new ATOM 0 HE1 PHE A 115 102.909 -15.695 -7.699 1.00 0.00 H new ATOM 0 HE2 PHE A 115 104.546 -11.849 -6.706 1.00 0.00 H new ATOM 0 HZ PHE A 115 102.878 -13.642 -6.307 1.00 0.00 H new ATOM 1564 N ASN A 116 108.509 -16.215 -11.615 1.00 0.00 N ATOM 1565 CA ASN A 116 109.436 -16.551 -12.745 1.00 0.00 C ATOM 1566 C ASN A 116 110.726 -17.169 -12.196 1.00 0.00 C ATOM 1567 O ASN A 116 111.680 -16.468 -11.924 1.00 0.00 O ATOM 1568 CB ASN A 116 109.730 -15.229 -13.472 1.00 0.00 C ATOM 1569 CG ASN A 116 109.627 -15.439 -14.984 1.00 0.00 C ATOM 1570 OD1 ASN A 116 109.075 -14.615 -15.686 1.00 0.00 O ATOM 1571 ND2 ASN A 116 110.137 -16.514 -15.518 1.00 0.00 N ATOM 0 H ASN A 116 107.669 -16.792 -11.572 1.00 0.00 H new ATOM 0 HA ASN A 116 108.993 -17.277 -13.427 1.00 0.00 H new ATOM 0 HB2 ASN A 116 109.024 -14.462 -13.153 1.00 0.00 H new ATOM 0 HB3 ASN A 116 110.727 -14.873 -13.211 1.00 0.00 H new ATOM 0 HD21 ASN A 116 110.073 -16.663 -16.525 1.00 0.00 H new ATOM 0 HD22 ASN A 116 110.600 -17.206 -14.929 1.00 0.00 H new ATOM 1577 N PRO A 117 110.714 -18.474 -12.048 1.00 0.00 N ATOM 1578 CA PRO A 117 111.904 -19.185 -11.522 1.00 0.00 C ATOM 1579 C PRO A 117 113.046 -19.138 -12.539 1.00 0.00 C ATOM 1580 O PRO A 117 112.896 -19.537 -13.677 1.00 0.00 O ATOM 1581 CB PRO A 117 111.409 -20.615 -11.314 1.00 0.00 C ATOM 1582 CG PRO A 117 110.256 -20.761 -12.251 1.00 0.00 C ATOM 1583 CD PRO A 117 109.614 -19.402 -12.355 1.00 0.00 C ATOM 0 HA PRO A 117 112.298 -18.744 -10.607 1.00 0.00 H new ATOM 0 HB2 PRO A 117 112.192 -21.340 -11.535 1.00 0.00 H new ATOM 0 HB3 PRO A 117 111.103 -20.781 -10.281 1.00 0.00 H new ATOM 0 HG2 PRO A 117 110.592 -21.107 -13.228 1.00 0.00 H new ATOM 0 HG3 PRO A 117 109.545 -21.498 -11.879 1.00 0.00 H new ATOM 0 HD2 PRO A 117 109.207 -19.226 -13.351 1.00 0.00 H new ATOM 0 HD3 PRO A 117 108.790 -19.293 -11.650 1.00 0.00 H new ATOM 1588 N MET A 118 114.190 -18.667 -12.126 1.00 0.00 N ATOM 1589 CA MET A 118 115.358 -18.596 -13.025 1.00 0.00 C ATOM 1590 C MET A 118 116.608 -18.864 -12.199 1.00 0.00 C ATOM 1591 O MET A 118 116.590 -18.795 -10.985 1.00 0.00 O ATOM 1592 CB MET A 118 115.376 -17.169 -13.580 1.00 0.00 C ATOM 1593 CG MET A 118 114.127 -16.910 -14.431 1.00 0.00 C ATOM 1594 SD MET A 118 114.113 -18.024 -15.859 1.00 0.00 S ATOM 1595 CE MET A 118 115.625 -17.408 -16.641 1.00 0.00 C ATOM 0 H MET A 118 114.360 -18.323 -11.181 1.00 0.00 H new ATOM 0 HA MET A 118 115.315 -19.323 -13.836 1.00 0.00 H new ATOM 0 HB2 MET A 118 115.419 -16.453 -12.759 1.00 0.00 H new ATOM 0 HB3 MET A 118 116.272 -17.018 -14.182 1.00 0.00 H new ATOM 0 HG2 MET A 118 113.230 -17.062 -13.831 1.00 0.00 H new ATOM 0 HG3 MET A 118 114.114 -15.873 -14.767 1.00 0.00 H new ATOM 0 HE1 MET A 118 115.510 -17.432 -17.725 1.00 0.00 H new ATOM 0 HE2 MET A 118 115.810 -16.383 -16.318 1.00 0.00 H new ATOM 0 HE3 MET A 118 116.467 -18.037 -16.351 1.00 0.00 H new ATOM 1603 N GLU A 119 117.681 -19.172 -12.844 1.00 0.00 N ATOM 1604 CA GLU A 119 118.945 -19.454 -12.104 1.00 0.00 C ATOM 1605 C GLU A 119 119.395 -18.214 -11.323 1.00 0.00 C ATOM 1606 O GLU A 119 119.714 -18.295 -10.152 1.00 0.00 O ATOM 1607 CB GLU A 119 119.970 -19.806 -13.184 1.00 0.00 C ATOM 1608 CG GLU A 119 119.536 -21.087 -13.901 1.00 0.00 C ATOM 1609 CD GLU A 119 120.585 -21.486 -14.947 1.00 0.00 C ATOM 1610 OE1 GLU A 119 121.455 -20.678 -15.233 1.00 0.00 O ATOM 1611 OE2 GLU A 119 120.500 -22.596 -15.444 1.00 0.00 O ATOM 0 H GLU A 119 117.748 -19.244 -13.859 1.00 0.00 H new ATOM 0 HA GLU A 119 118.823 -20.258 -11.379 1.00 0.00 H new ATOM 0 HB2 GLU A 119 120.056 -18.988 -13.899 1.00 0.00 H new ATOM 0 HB3 GLU A 119 120.954 -19.943 -12.736 1.00 0.00 H new ATOM 0 HG2 GLU A 119 119.408 -21.892 -13.178 1.00 0.00 H new ATOM 0 HG3 GLU A 119 118.570 -20.934 -14.383 1.00 0.00 H new ATOM 1616 N ASN A 120 119.436 -17.070 -11.962 1.00 0.00 N ATOM 1617 CA ASN A 120 119.883 -15.833 -11.252 1.00 0.00 C ATOM 1618 C ASN A 120 118.946 -14.653 -11.542 1.00 0.00 C ATOM 1619 O ASN A 120 119.345 -13.509 -11.450 1.00 0.00 O ATOM 1620 CB ASN A 120 121.281 -15.549 -11.804 1.00 0.00 C ATOM 1621 CG ASN A 120 122.233 -16.679 -11.403 1.00 0.00 C ATOM 1622 OD1 ASN A 120 121.996 -17.374 -10.435 1.00 0.00 O ATOM 1623 ND2 ASN A 120 123.307 -16.893 -12.113 1.00 0.00 N ATOM 0 H ASN A 120 119.180 -16.940 -12.941 1.00 0.00 H new ATOM 0 HA ASN A 120 119.879 -15.967 -10.170 1.00 0.00 H new ATOM 0 HB2 ASN A 120 121.243 -15.461 -12.890 1.00 0.00 H new ATOM 0 HB3 ASN A 120 121.648 -14.597 -11.419 1.00 0.00 H new ATOM 0 HD21 ASN A 120 123.948 -17.644 -11.855 1.00 0.00 H new ATOM 0 HD22 ASN A 120 123.506 -16.309 -12.926 1.00 0.00 H new ATOM 1629 N VAL A 121 117.707 -14.909 -11.880 1.00 0.00 N ATOM 1630 CA VAL A 121 116.762 -13.780 -12.158 1.00 0.00 C ATOM 1631 C VAL A 121 115.493 -13.940 -11.314 1.00 0.00 C ATOM 1632 O VAL A 121 114.985 -15.031 -11.143 1.00 0.00 O ATOM 1633 CB VAL A 121 116.438 -13.871 -13.652 1.00 0.00 C ATOM 1634 CG1 VAL A 121 115.527 -12.707 -14.046 1.00 0.00 C ATOM 1635 CG2 VAL A 121 117.735 -13.795 -14.464 1.00 0.00 C ATOM 0 H VAL A 121 117.309 -15.843 -11.975 1.00 0.00 H new ATOM 0 HA VAL A 121 117.194 -12.812 -11.905 1.00 0.00 H new ATOM 0 HB VAL A 121 115.935 -14.816 -13.856 1.00 0.00 H new ATOM 0 HG11 VAL A 121 115.295 -12.770 -15.109 1.00 0.00 H new ATOM 0 HG12 VAL A 121 114.603 -12.757 -13.470 1.00 0.00 H new ATOM 0 HG13 VAL A 121 116.033 -11.764 -13.840 1.00 0.00 H new ATOM 0 HG21 VAL A 121 117.503 -13.860 -15.527 1.00 0.00 H new ATOM 0 HG22 VAL A 121 118.238 -12.850 -14.259 1.00 0.00 H new ATOM 0 HG23 VAL A 121 118.388 -14.621 -14.184 1.00 0.00 H new ATOM 1645 N ALA A 122 114.982 -12.860 -10.782 1.00 0.00 N ATOM 1646 CA ALA A 122 113.747 -12.963 -9.945 1.00 0.00 C ATOM 1647 C ALA A 122 112.961 -11.648 -9.927 1.00 0.00 C ATOM 1648 O ALA A 122 113.520 -10.583 -9.789 1.00 0.00 O ATOM 1649 CB ALA A 122 114.259 -13.292 -8.544 1.00 0.00 C ATOM 0 H ALA A 122 115.361 -11.919 -10.889 1.00 0.00 H new ATOM 0 HA ALA A 122 113.062 -13.716 -10.335 1.00 0.00 H new ATOM 0 HB1 ALA A 122 113.415 -13.386 -7.861 1.00 0.00 H new ATOM 0 HB2 ALA A 122 114.811 -14.231 -8.570 1.00 0.00 H new ATOM 0 HB3 ALA A 122 114.917 -12.494 -8.200 1.00 0.00 H new ATOM 1655 N LEU A 123 111.659 -11.730 -10.033 1.00 0.00 N ATOM 1656 CA LEU A 123 110.815 -10.499 -9.989 1.00 0.00 C ATOM 1657 C LEU A 123 109.832 -10.647 -8.833 1.00 0.00 C ATOM 1658 O LEU A 123 109.367 -11.735 -8.568 1.00 0.00 O ATOM 1659 CB LEU A 123 110.075 -10.458 -11.330 1.00 0.00 C ATOM 1660 CG LEU A 123 111.079 -10.484 -12.487 1.00 0.00 C ATOM 1661 CD1 LEU A 123 110.322 -10.465 -13.817 1.00 0.00 C ATOM 1662 CD2 LEU A 123 111.990 -9.255 -12.408 1.00 0.00 C ATOM 0 H LEU A 123 111.142 -12.602 -10.149 1.00 0.00 H new ATOM 0 HA LEU A 123 111.390 -9.585 -9.839 1.00 0.00 H new ATOM 0 HB2 LEU A 123 109.398 -11.309 -11.407 1.00 0.00 H new ATOM 0 HB3 LEU A 123 109.463 -9.558 -11.389 1.00 0.00 H new ATOM 0 HG LEU A 123 111.683 -11.389 -12.419 1.00 0.00 H new ATOM 0 HD11 LEU A 123 111.035 -10.483 -14.642 1.00 0.00 H new ATOM 0 HD12 LEU A 123 109.673 -11.339 -13.879 1.00 0.00 H new ATOM 0 HD13 LEU A 123 109.718 -9.559 -13.879 1.00 0.00 H new ATOM 0 HD21 LEU A 123 112.703 -9.277 -13.232 1.00 0.00 H new ATOM 0 HD22 LEU A 123 111.386 -8.350 -12.474 1.00 0.00 H new ATOM 0 HD23 LEU A 123 112.530 -9.263 -11.461 1.00 0.00 H new ATOM 1673 N ASP A 124 109.509 -9.596 -8.125 1.00 0.00 N ATOM 1674 CA ASP A 124 108.555 -9.775 -6.987 1.00 0.00 C ATOM 1675 C ASP A 124 107.706 -8.525 -6.735 1.00 0.00 C ATOM 1676 O ASP A 124 108.101 -7.409 -7.020 1.00 0.00 O ATOM 1677 CB ASP A 124 109.440 -10.084 -5.773 1.00 0.00 C ATOM 1678 CG ASP A 124 110.443 -8.947 -5.530 1.00 0.00 C ATOM 1679 OD1 ASP A 124 110.319 -7.914 -6.169 1.00 0.00 O ATOM 1680 OD2 ASP A 124 111.327 -9.134 -4.710 1.00 0.00 O ATOM 0 H ASP A 124 109.852 -8.647 -8.277 1.00 0.00 H new ATOM 0 HA ASP A 124 107.840 -10.570 -7.198 1.00 0.00 H new ATOM 0 HB2 ASP A 124 108.818 -10.222 -4.889 1.00 0.00 H new ATOM 0 HB3 ASP A 124 109.975 -11.020 -5.935 1.00 0.00 H new ATOM 1684 N PHE A 125 106.538 -8.729 -6.184 1.00 0.00 N ATOM 1685 CA PHE A 125 105.629 -7.590 -5.871 1.00 0.00 C ATOM 1686 C PHE A 125 105.253 -7.655 -4.391 1.00 0.00 C ATOM 1687 O PHE A 125 105.027 -8.724 -3.855 1.00 0.00 O ATOM 1688 CB PHE A 125 104.396 -7.803 -6.751 1.00 0.00 C ATOM 1689 CG PHE A 125 104.798 -7.766 -8.206 1.00 0.00 C ATOM 1690 CD1 PHE A 125 104.883 -6.540 -8.877 1.00 0.00 C ATOM 1691 CD2 PHE A 125 105.085 -8.957 -8.883 1.00 0.00 C ATOM 1692 CE1 PHE A 125 105.256 -6.506 -10.226 1.00 0.00 C ATOM 1693 CE2 PHE A 125 105.458 -8.923 -10.233 1.00 0.00 C ATOM 1694 CZ PHE A 125 105.543 -7.698 -10.905 1.00 0.00 C ATOM 0 H PHE A 125 106.172 -9.648 -5.935 1.00 0.00 H new ATOM 0 HA PHE A 125 106.084 -6.617 -6.059 1.00 0.00 H new ATOM 0 HB2 PHE A 125 103.931 -8.760 -6.516 1.00 0.00 H new ATOM 0 HB3 PHE A 125 103.655 -7.030 -6.549 1.00 0.00 H new ATOM 0 HD1 PHE A 125 104.661 -5.621 -8.354 1.00 0.00 H new ATOM 0 HD2 PHE A 125 105.019 -9.902 -8.365 1.00 0.00 H new ATOM 0 HE1 PHE A 125 105.323 -5.561 -10.744 1.00 0.00 H new ATOM 0 HE2 PHE A 125 105.680 -9.842 -10.755 1.00 0.00 H new ATOM 0 HZ PHE A 125 105.830 -7.671 -11.946 1.00 0.00 H new ATOM 1703 N SER A 126 105.189 -6.536 -3.720 1.00 0.00 N ATOM 1704 CA SER A 126 104.836 -6.566 -2.271 1.00 0.00 C ATOM 1705 C SER A 126 103.976 -5.362 -1.887 1.00 0.00 C ATOM 1706 O SER A 126 104.099 -4.290 -2.447 1.00 0.00 O ATOM 1707 CB SER A 126 106.178 -6.513 -1.543 1.00 0.00 C ATOM 1708 OG SER A 126 105.952 -6.548 -0.139 1.00 0.00 O ATOM 0 H SER A 126 105.364 -5.609 -4.109 1.00 0.00 H new ATOM 0 HA SER A 126 104.255 -7.452 -2.015 1.00 0.00 H new ATOM 0 HB2 SER A 126 106.802 -7.355 -1.844 1.00 0.00 H new ATOM 0 HB3 SER A 126 106.716 -5.605 -1.814 1.00 0.00 H new ATOM 0 HG SER A 126 106.811 -6.516 0.332 1.00 0.00 H new ATOM 1713 N TYR A 127 103.115 -5.535 -0.919 1.00 0.00 N ATOM 1714 CA TYR A 127 102.251 -4.409 -0.468 1.00 0.00 C ATOM 1715 C TYR A 127 102.770 -3.875 0.868 1.00 0.00 C ATOM 1716 O TYR A 127 102.901 -4.610 1.830 1.00 0.00 O ATOM 1717 CB TYR A 127 100.856 -5.020 -0.305 1.00 0.00 C ATOM 1718 CG TYR A 127 99.887 -3.958 0.158 1.00 0.00 C ATOM 1719 CD1 TYR A 127 99.290 -3.097 -0.770 1.00 0.00 C ATOM 1720 CD2 TYR A 127 99.583 -3.837 1.519 1.00 0.00 C ATOM 1721 CE1 TYR A 127 98.392 -2.113 -0.337 1.00 0.00 C ATOM 1722 CE2 TYR A 127 98.684 -2.855 1.953 1.00 0.00 C ATOM 1723 CZ TYR A 127 98.089 -1.993 1.024 1.00 0.00 C ATOM 1724 OH TYR A 127 97.203 -1.025 1.450 1.00 0.00 O ATOM 0 H TYR A 127 102.974 -6.413 -0.420 1.00 0.00 H new ATOM 0 HA TYR A 127 102.242 -3.574 -1.169 1.00 0.00 H new ATOM 0 HB2 TYR A 127 100.521 -5.444 -1.252 1.00 0.00 H new ATOM 0 HB3 TYR A 127 100.888 -5.837 0.416 1.00 0.00 H new ATOM 0 HD1 TYR A 127 99.522 -3.191 -1.821 1.00 0.00 H new ATOM 0 HD2 TYR A 127 100.042 -4.502 2.235 1.00 0.00 H new ATOM 0 HE1 TYR A 127 97.934 -1.447 -1.053 1.00 0.00 H new ATOM 0 HE2 TYR A 127 98.450 -2.763 3.003 1.00 0.00 H new ATOM 0 HH TYR A 127 97.342 -0.852 2.405 1.00 0.00 H new ATOM 1733 N GLU A 128 103.074 -2.605 0.929 1.00 0.00 N ATOM 1734 CA GLU A 128 103.593 -2.019 2.198 1.00 0.00 C ATOM 1735 C GLU A 128 102.942 -0.661 2.466 1.00 0.00 C ATOM 1736 O GLU A 128 102.705 0.114 1.559 1.00 0.00 O ATOM 1737 CB GLU A 128 105.097 -1.856 1.972 1.00 0.00 C ATOM 1738 CG GLU A 128 105.759 -1.370 3.265 1.00 0.00 C ATOM 1739 CD GLU A 128 107.250 -1.101 3.023 1.00 0.00 C ATOM 1740 OE1 GLU A 128 107.699 -1.282 1.902 1.00 0.00 O ATOM 1741 OE2 GLU A 128 107.919 -0.714 3.968 1.00 0.00 O ATOM 0 H GLU A 128 102.985 -1.948 0.154 1.00 0.00 H new ATOM 0 HA GLU A 128 103.374 -2.649 3.060 1.00 0.00 H new ATOM 0 HB2 GLU A 128 105.534 -2.805 1.662 1.00 0.00 H new ATOM 0 HB3 GLU A 128 105.279 -1.143 1.168 1.00 0.00 H new ATOM 0 HG2 GLU A 128 105.269 -0.461 3.614 1.00 0.00 H new ATOM 0 HG3 GLU A 128 105.639 -2.118 4.048 1.00 0.00 H new ATOM 1746 N GLN A 129 102.664 -0.365 3.707 1.00 0.00 N ATOM 1747 CA GLN A 129 102.040 0.946 4.048 1.00 0.00 C ATOM 1748 C GLN A 129 102.689 1.515 5.313 1.00 0.00 C ATOM 1749 O GLN A 129 103.250 0.787 6.108 1.00 0.00 O ATOM 1750 CB GLN A 129 100.556 0.636 4.277 1.00 0.00 C ATOM 1751 CG GLN A 129 100.397 -0.311 5.471 1.00 0.00 C ATOM 1752 CD GLN A 129 98.951 -0.806 5.540 1.00 0.00 C ATOM 1753 OE1 GLN A 129 98.358 -1.127 4.530 1.00 0.00 O ATOM 1754 NE2 GLN A 129 98.356 -0.882 6.699 1.00 0.00 N ATOM 0 H GLN A 129 102.843 -0.977 4.503 1.00 0.00 H new ATOM 0 HA GLN A 129 102.172 1.691 3.264 1.00 0.00 H new ATOM 0 HB2 GLN A 129 100.007 1.560 4.459 1.00 0.00 H new ATOM 0 HB3 GLN A 129 100.129 0.182 3.383 1.00 0.00 H new ATOM 0 HG2 GLN A 129 101.078 -1.156 5.371 1.00 0.00 H new ATOM 0 HG3 GLN A 129 100.661 0.204 6.395 1.00 0.00 H new ATOM 0 HE21 GLN A 129 98.855 -0.612 7.547 1.00 0.00 H new ATOM 0 HE22 GLN A 129 97.392 -1.211 6.757 1.00 0.00 H new ATOM 1761 N SER A 130 102.621 2.806 5.503 1.00 0.00 N ATOM 1762 CA SER A 130 103.242 3.414 6.718 1.00 0.00 C ATOM 1763 C SER A 130 102.275 4.400 7.379 1.00 0.00 C ATOM 1764 O SER A 130 101.543 5.107 6.714 1.00 0.00 O ATOM 1765 CB SER A 130 104.481 4.145 6.201 1.00 0.00 C ATOM 1766 OG SER A 130 105.210 4.668 7.303 1.00 0.00 O ATOM 0 H SER A 130 102.164 3.465 4.872 1.00 0.00 H new ATOM 0 HA SER A 130 103.490 2.666 7.471 1.00 0.00 H new ATOM 0 HB2 SER A 130 105.107 3.462 5.627 1.00 0.00 H new ATOM 0 HB3 SER A 130 104.188 4.951 5.528 1.00 0.00 H new ATOM 0 HG SER A 130 106.006 5.136 6.976 1.00 0.00 H new ATOM 1771 N ARG A 131 102.277 4.454 8.685 1.00 0.00 N ATOM 1772 CA ARG A 131 101.369 5.396 9.399 1.00 0.00 C ATOM 1773 C ARG A 131 102.186 6.298 10.329 1.00 0.00 C ATOM 1774 O ARG A 131 102.972 5.825 11.130 1.00 0.00 O ATOM 1775 CB ARG A 131 100.427 4.501 10.206 1.00 0.00 C ATOM 1776 CG ARG A 131 99.345 5.360 10.866 1.00 0.00 C ATOM 1777 CD ARG A 131 98.448 4.474 11.733 1.00 0.00 C ATOM 1778 NE ARG A 131 97.365 5.375 12.217 1.00 0.00 N ATOM 1779 CZ ARG A 131 96.258 4.869 12.690 1.00 0.00 C ATOM 1780 NH1 ARG A 131 96.261 4.258 13.842 1.00 0.00 N ATOM 1781 NH2 ARG A 131 95.150 4.975 12.010 1.00 0.00 N ATOM 0 H ARG A 131 102.870 3.884 9.288 1.00 0.00 H new ATOM 0 HA ARG A 131 100.822 6.048 8.718 1.00 0.00 H new ATOM 0 HB2 ARG A 131 99.968 3.757 9.555 1.00 0.00 H new ATOM 0 HB3 ARG A 131 100.988 3.957 10.966 1.00 0.00 H new ATOM 0 HG2 ARG A 131 99.805 6.138 11.476 1.00 0.00 H new ATOM 0 HG3 ARG A 131 98.750 5.863 10.104 1.00 0.00 H new ATOM 0 HD2 ARG A 131 98.041 3.642 11.158 1.00 0.00 H new ATOM 0 HD3 ARG A 131 99.005 4.044 12.566 1.00 0.00 H new ATOM 0 HE ARG A 131 97.488 6.387 12.179 1.00 0.00 H new ATOM 0 HH11 ARG A 131 97.128 4.175 14.373 1.00 0.00 H new ATOM 0 HH12 ARG A 131 95.397 3.863 14.212 1.00 0.00 H new ATOM 0 HH21 ARG A 131 95.148 5.453 11.109 1.00 0.00 H new ATOM 0 HH22 ARG A 131 94.285 4.580 12.379 1.00 0.00 H new ATOM 1792 N ILE A 132 102.009 7.590 10.221 1.00 0.00 N ATOM 1793 CA ILE A 132 102.772 8.528 11.082 1.00 0.00 C ATOM 1794 C ILE A 132 101.791 9.368 11.893 1.00 0.00 C ATOM 1795 O ILE A 132 101.985 10.551 12.070 1.00 0.00 O ATOM 1796 CB ILE A 132 103.566 9.407 10.107 1.00 0.00 C ATOM 1797 CG1 ILE A 132 104.493 8.524 9.263 1.00 0.00 C ATOM 1798 CG2 ILE A 132 104.405 10.428 10.886 1.00 0.00 C ATOM 1799 CD1 ILE A 132 105.159 9.375 8.180 1.00 0.00 C ATOM 0 H ILE A 132 101.363 8.033 9.568 1.00 0.00 H new ATOM 0 HA ILE A 132 103.431 8.021 11.787 1.00 0.00 H new ATOM 0 HB ILE A 132 102.870 9.937 9.456 1.00 0.00 H new ATOM 0 HG12 ILE A 132 105.251 8.064 9.897 1.00 0.00 H new ATOM 0 HG13 ILE A 132 103.925 7.714 8.806 1.00 0.00 H new ATOM 0 HG21 ILE A 132 104.966 11.048 10.186 1.00 0.00 H new ATOM 0 HG22 ILE A 132 103.747 11.059 11.484 1.00 0.00 H new ATOM 0 HG23 ILE A 132 105.099 9.903 11.542 1.00 0.00 H new ATOM 0 HD11 ILE A 132 105.818 8.749 7.579 1.00 0.00 H new ATOM 0 HD12 ILE A 132 104.393 9.814 7.540 1.00 0.00 H new ATOM 0 HD13 ILE A 132 105.740 10.169 8.648 1.00 0.00 H new ATOM 1810 N ARG A 133 100.726 8.758 12.364 1.00 0.00 N ATOM 1811 CA ARG A 133 99.683 9.486 13.165 1.00 0.00 C ATOM 1812 C ARG A 133 98.989 10.572 12.333 1.00 0.00 C ATOM 1813 O ARG A 133 97.779 10.591 12.216 1.00 0.00 O ATOM 1814 CB ARG A 133 100.413 10.104 14.367 1.00 0.00 C ATOM 1815 CG ARG A 133 100.998 8.990 15.237 1.00 0.00 C ATOM 1816 CD ARG A 133 101.623 9.600 16.494 1.00 0.00 C ATOM 1817 NE ARG A 133 102.308 8.465 17.172 1.00 0.00 N ATOM 1818 CZ ARG A 133 102.364 8.423 18.476 1.00 0.00 C ATOM 1819 NH1 ARG A 133 103.111 9.274 19.126 1.00 0.00 N ATOM 1820 NH2 ARG A 133 101.674 7.530 19.131 1.00 0.00 N ATOM 0 H ARG A 133 100.531 7.766 12.224 1.00 0.00 H new ATOM 0 HA ARG A 133 98.898 8.801 13.486 1.00 0.00 H new ATOM 0 HB2 ARG A 133 101.208 10.766 14.022 1.00 0.00 H new ATOM 0 HB3 ARG A 133 99.723 10.712 14.952 1.00 0.00 H new ATOM 0 HG2 ARG A 133 100.217 8.282 15.513 1.00 0.00 H new ATOM 0 HG3 ARG A 133 101.750 8.434 14.677 1.00 0.00 H new ATOM 0 HD2 ARG A 133 102.328 10.392 16.240 1.00 0.00 H new ATOM 0 HD3 ARG A 133 100.863 10.044 17.137 1.00 0.00 H new ATOM 0 HE ARG A 133 102.733 7.721 16.619 1.00 0.00 H new ATOM 0 HH11 ARG A 133 103.651 9.972 18.615 1.00 0.00 H new ATOM 0 HH12 ARG A 133 103.154 9.241 20.145 1.00 0.00 H new ATOM 0 HH21 ARG A 133 101.090 6.864 18.624 1.00 0.00 H new ATOM 0 HH22 ARG A 133 101.718 7.498 20.150 1.00 0.00 H new ATOM 1831 N SER A 134 99.736 11.474 11.759 1.00 0.00 N ATOM 1832 CA SER A 134 99.118 12.553 10.943 1.00 0.00 C ATOM 1833 C SER A 134 99.219 12.220 9.456 1.00 0.00 C ATOM 1834 O SER A 134 98.444 12.704 8.654 1.00 0.00 O ATOM 1835 CB SER A 134 99.929 13.807 11.267 1.00 0.00 C ATOM 1836 OG SER A 134 101.220 13.695 10.685 1.00 0.00 O ATOM 0 H SER A 134 100.753 11.509 11.821 1.00 0.00 H new ATOM 0 HA SER A 134 98.059 12.682 11.166 1.00 0.00 H new ATOM 0 HB2 SER A 134 99.420 14.692 10.884 1.00 0.00 H new ATOM 0 HB3 SER A 134 100.014 13.930 12.347 1.00 0.00 H new ATOM 0 HG SER A 134 101.742 14.499 10.890 1.00 0.00 H new ATOM 1841 N VAL A 135 100.172 11.405 9.074 1.00 0.00 N ATOM 1842 CA VAL A 135 100.309 11.062 7.625 1.00 0.00 C ATOM 1843 C VAL A 135 100.318 9.545 7.426 1.00 0.00 C ATOM 1844 O VAL A 135 101.025 8.828 8.102 1.00 0.00 O ATOM 1845 CB VAL A 135 101.651 11.666 7.195 1.00 0.00 C ATOM 1846 CG1 VAL A 135 101.872 11.414 5.702 1.00 0.00 C ATOM 1847 CG2 VAL A 135 101.642 13.174 7.455 1.00 0.00 C ATOM 0 H VAL A 135 100.853 10.967 9.695 1.00 0.00 H new ATOM 0 HA VAL A 135 99.477 11.450 7.037 1.00 0.00 H new ATOM 0 HB VAL A 135 102.454 11.201 7.767 1.00 0.00 H new ATOM 0 HG11 VAL A 135 102.826 11.844 5.398 1.00 0.00 H new ATOM 0 HG12 VAL A 135 101.880 10.341 5.511 1.00 0.00 H new ATOM 0 HG13 VAL A 135 101.067 11.878 5.132 1.00 0.00 H new ATOM 0 HG21 VAL A 135 102.597 13.602 7.149 1.00 0.00 H new ATOM 0 HG22 VAL A 135 100.837 13.637 6.884 1.00 0.00 H new ATOM 0 HG23 VAL A 135 101.486 13.359 8.518 1.00 0.00 H new ATOM 1857 N ASP A 136 99.543 9.054 6.493 1.00 0.00 N ATOM 1858 CA ASP A 136 99.512 7.583 6.241 1.00 0.00 C ATOM 1859 C ASP A 136 99.631 7.333 4.741 1.00 0.00 C ATOM 1860 O ASP A 136 98.756 7.689 3.978 1.00 0.00 O ATOM 1861 CB ASP A 136 98.151 7.115 6.764 1.00 0.00 C ATOM 1862 CG ASP A 136 98.052 5.587 6.677 1.00 0.00 C ATOM 1863 OD1 ASP A 136 99.072 4.951 6.460 1.00 0.00 O ATOM 1864 OD2 ASP A 136 96.955 5.078 6.828 1.00 0.00 O ATOM 0 H ASP A 136 98.931 9.609 5.895 1.00 0.00 H new ATOM 0 HA ASP A 136 100.328 7.050 6.730 1.00 0.00 H new ATOM 0 HB2 ASP A 136 98.019 7.438 7.797 1.00 0.00 H new ATOM 0 HB3 ASP A 136 97.351 7.573 6.182 1.00 0.00 H new ATOM 1868 N VAL A 137 100.713 6.747 4.303 1.00 0.00 N ATOM 1869 CA VAL A 137 100.904 6.503 2.843 1.00 0.00 C ATOM 1870 C VAL A 137 100.995 4.998 2.545 1.00 0.00 C ATOM 1871 O VAL A 137 101.525 4.233 3.327 1.00 0.00 O ATOM 1872 CB VAL A 137 102.238 7.192 2.525 1.00 0.00 C ATOM 1873 CG1 VAL A 137 102.555 7.053 1.039 1.00 0.00 C ATOM 1874 CG2 VAL A 137 102.156 8.678 2.890 1.00 0.00 C ATOM 0 H VAL A 137 101.477 6.425 4.897 1.00 0.00 H new ATOM 0 HA VAL A 137 100.075 6.883 2.245 1.00 0.00 H new ATOM 0 HB VAL A 137 103.027 6.718 3.108 1.00 0.00 H new ATOM 0 HG11 VAL A 137 103.503 7.545 0.822 1.00 0.00 H new ATOM 0 HG12 VAL A 137 102.626 5.997 0.779 1.00 0.00 H new ATOM 0 HG13 VAL A 137 101.762 7.518 0.453 1.00 0.00 H new ATOM 0 HG21 VAL A 137 103.106 9.162 2.662 1.00 0.00 H new ATOM 0 HG22 VAL A 137 101.361 9.151 2.314 1.00 0.00 H new ATOM 0 HG23 VAL A 137 101.943 8.780 3.954 1.00 0.00 H new ATOM 1884 N GLY A 138 100.503 4.575 1.404 1.00 0.00 N ATOM 1885 CA GLY A 138 100.582 3.128 1.034 1.00 0.00 C ATOM 1886 C GLY A 138 101.469 3.004 -0.206 1.00 0.00 C ATOM 1887 O GLY A 138 101.140 3.511 -1.262 1.00 0.00 O ATOM 0 H GLY A 138 100.049 5.172 0.713 1.00 0.00 H new ATOM 0 HA2 GLY A 138 100.995 2.546 1.858 1.00 0.00 H new ATOM 0 HA3 GLY A 138 99.587 2.732 0.832 1.00 0.00 H new ATOM 1890 N THR A 139 102.606 2.365 -0.085 1.00 0.00 N ATOM 1891 CA THR A 139 103.526 2.257 -1.258 1.00 0.00 C ATOM 1892 C THR A 139 103.582 0.836 -1.824 1.00 0.00 C ATOM 1893 O THR A 139 103.619 -0.140 -1.100 1.00 0.00 O ATOM 1894 CB THR A 139 104.901 2.648 -0.707 1.00 0.00 C ATOM 1895 OG1 THR A 139 104.808 3.895 -0.036 1.00 0.00 O ATOM 1896 CG2 THR A 139 105.906 2.759 -1.857 1.00 0.00 C ATOM 0 H THR A 139 102.935 1.916 0.770 1.00 0.00 H new ATOM 0 HA THR A 139 103.189 2.892 -2.077 1.00 0.00 H new ATOM 0 HB THR A 139 105.238 1.884 -0.007 1.00 0.00 H new ATOM 0 HG1 THR A 139 103.909 4.266 -0.158 1.00 0.00 H new ATOM 0 HG21 THR A 139 106.883 3.037 -1.461 1.00 0.00 H new ATOM 0 HG22 THR A 139 105.982 1.799 -2.368 1.00 0.00 H new ATOM 0 HG23 THR A 139 105.570 3.520 -2.562 1.00 0.00 H new ATOM 1904 N TRP A 140 103.627 0.730 -3.128 1.00 0.00 N ATOM 1905 CA TRP A 140 103.727 -0.605 -3.785 1.00 0.00 C ATOM 1906 C TRP A 140 105.130 -0.744 -4.381 1.00 0.00 C ATOM 1907 O TRP A 140 105.647 0.188 -4.965 1.00 0.00 O ATOM 1908 CB TRP A 140 102.676 -0.583 -4.897 1.00 0.00 C ATOM 1909 CG TRP A 140 101.306 -0.540 -4.298 1.00 0.00 C ATOM 1910 CD1 TRP A 140 100.790 0.505 -3.612 1.00 0.00 C ATOM 1911 CD2 TRP A 140 100.268 -1.562 -4.332 1.00 0.00 C ATOM 1912 NE1 TRP A 140 99.503 0.187 -3.217 1.00 0.00 N ATOM 1913 CE2 TRP A 140 99.135 -1.076 -3.638 1.00 0.00 C ATOM 1914 CE3 TRP A 140 100.200 -2.850 -4.892 1.00 0.00 C ATOM 1915 CZ2 TRP A 140 97.977 -1.841 -3.504 1.00 0.00 C ATOM 1916 CZ3 TRP A 140 99.035 -3.624 -4.759 1.00 0.00 C ATOM 1917 CH2 TRP A 140 97.925 -3.120 -4.066 1.00 0.00 C ATOM 0 H TRP A 140 103.598 1.521 -3.771 1.00 0.00 H new ATOM 0 HA TRP A 140 103.562 -1.436 -3.099 1.00 0.00 H new ATOM 0 HB2 TRP A 140 102.830 0.285 -5.538 1.00 0.00 H new ATOM 0 HB3 TRP A 140 102.780 -1.467 -5.526 1.00 0.00 H new ATOM 0 HD1 TRP A 140 101.299 1.435 -3.406 1.00 0.00 H new ATOM 0 HE1 TRP A 140 98.899 0.810 -2.680 1.00 0.00 H new ATOM 0 HE3 TRP A 140 101.049 -3.247 -5.428 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 97.125 -1.448 -2.969 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 98.994 -4.612 -5.193 1.00 0.00 H new ATOM 0 HH2 TRP A 140 97.032 -3.719 -3.967 1.00 0.00 H new ATOM 1927 N ILE A 141 105.764 -1.879 -4.229 1.00 0.00 N ATOM 1928 CA ILE A 141 107.146 -2.025 -4.783 1.00 0.00 C ATOM 1929 C ILE A 141 107.249 -3.219 -5.739 1.00 0.00 C ATOM 1930 O ILE A 141 106.605 -4.234 -5.560 1.00 0.00 O ATOM 1931 CB ILE A 141 108.043 -2.238 -3.557 1.00 0.00 C ATOM 1932 CG1 ILE A 141 107.639 -3.530 -2.837 1.00 0.00 C ATOM 1933 CG2 ILE A 141 107.895 -1.054 -2.598 1.00 0.00 C ATOM 1934 CD1 ILE A 141 108.624 -3.816 -1.701 1.00 0.00 C ATOM 0 H ILE A 141 105.392 -2.701 -3.753 1.00 0.00 H new ATOM 0 HA ILE A 141 107.436 -1.150 -5.365 1.00 0.00 H new ATOM 0 HB ILE A 141 109.080 -2.314 -3.883 1.00 0.00 H new ATOM 0 HG12 ILE A 141 106.628 -3.436 -2.440 1.00 0.00 H new ATOM 0 HG13 ILE A 141 107.629 -4.362 -3.541 1.00 0.00 H new ATOM 0 HG21 ILE A 141 108.533 -1.208 -1.728 1.00 0.00 H new ATOM 0 HG22 ILE A 141 108.189 -0.136 -3.106 1.00 0.00 H new ATOM 0 HG23 ILE A 141 106.857 -0.974 -2.276 1.00 0.00 H new ATOM 0 HD11 ILE A 141 108.334 -4.735 -1.191 1.00 0.00 H new ATOM 0 HD12 ILE A 141 109.628 -3.929 -2.110 1.00 0.00 H new ATOM 0 HD13 ILE A 141 108.612 -2.988 -0.992 1.00 0.00 H new ATOM 1945 N ALA A 142 108.081 -3.102 -6.742 1.00 0.00 N ATOM 1946 CA ALA A 142 108.270 -4.219 -7.711 1.00 0.00 C ATOM 1947 C ALA A 142 109.660 -4.093 -8.331 1.00 0.00 C ATOM 1948 O ALA A 142 110.107 -2.998 -8.623 1.00 0.00 O ATOM 1949 CB ALA A 142 107.183 -4.024 -8.769 1.00 0.00 C ATOM 0 H ALA A 142 108.642 -2.271 -6.931 1.00 0.00 H new ATOM 0 HA ALA A 142 108.195 -5.204 -7.251 1.00 0.00 H new ATOM 0 HB1 ALA A 142 107.259 -4.812 -9.519 1.00 0.00 H new ATOM 0 HB2 ALA A 142 106.202 -4.068 -8.295 1.00 0.00 H new ATOM 0 HB3 ALA A 142 107.312 -3.053 -9.248 1.00 0.00 H new ATOM 1955 N GLY A 143 110.363 -5.181 -8.523 1.00 0.00 N ATOM 1956 CA GLY A 143 111.728 -5.057 -9.108 1.00 0.00 C ATOM 1957 C GLY A 143 112.300 -6.413 -9.525 1.00 0.00 C ATOM 1958 O GLY A 143 111.585 -7.344 -9.845 1.00 0.00 O ATOM 0 H GLY A 143 110.058 -6.129 -8.305 1.00 0.00 H new ATOM 0 HA2 GLY A 143 111.692 -4.397 -9.975 1.00 0.00 H new ATOM 0 HA3 GLY A 143 112.393 -4.592 -8.380 1.00 0.00 H new ATOM 1961 N VAL A 144 113.605 -6.503 -9.526 1.00 0.00 N ATOM 1962 CA VAL A 144 114.289 -7.765 -9.934 1.00 0.00 C ATOM 1963 C VAL A 144 115.089 -8.352 -8.764 1.00 0.00 C ATOM 1964 O VAL A 144 115.146 -7.782 -7.691 1.00 0.00 O ATOM 1965 CB VAL A 144 115.226 -7.361 -11.078 1.00 0.00 C ATOM 1966 CG1 VAL A 144 114.404 -6.797 -12.240 1.00 0.00 C ATOM 1967 CG2 VAL A 144 116.213 -6.295 -10.592 1.00 0.00 C ATOM 0 H VAL A 144 114.233 -5.745 -9.258 1.00 0.00 H new ATOM 0 HA VAL A 144 113.577 -8.532 -10.240 1.00 0.00 H new ATOM 0 HB VAL A 144 115.779 -8.239 -11.412 1.00 0.00 H new ATOM 0 HG11 VAL A 144 115.072 -6.510 -13.052 1.00 0.00 H new ATOM 0 HG12 VAL A 144 113.706 -7.556 -12.594 1.00 0.00 H new ATOM 0 HG13 VAL A 144 113.848 -5.923 -11.902 1.00 0.00 H new ATOM 0 HG21 VAL A 144 116.876 -6.013 -11.410 1.00 0.00 H new ATOM 0 HG22 VAL A 144 115.663 -5.418 -10.252 1.00 0.00 H new ATOM 0 HG23 VAL A 144 116.804 -6.695 -9.768 1.00 0.00 H new ATOM 1977 N GLY A 145 115.704 -9.490 -8.968 1.00 0.00 N ATOM 1978 CA GLY A 145 116.496 -10.118 -7.872 1.00 0.00 C ATOM 1979 C GLY A 145 117.557 -11.059 -8.449 1.00 0.00 C ATOM 1980 O GLY A 145 117.313 -11.784 -9.394 1.00 0.00 O ATOM 0 H GLY A 145 115.691 -10.009 -9.846 1.00 0.00 H new ATOM 0 HA2 GLY A 145 116.975 -9.344 -7.272 1.00 0.00 H new ATOM 0 HA3 GLY A 145 115.833 -10.672 -7.207 1.00 0.00 H new ATOM 1983 N TYR A 146 118.732 -11.057 -7.872 1.00 0.00 N ATOM 1984 CA TYR A 146 119.823 -11.954 -8.360 1.00 0.00 C ATOM 1985 C TYR A 146 120.432 -12.716 -7.177 1.00 0.00 C ATOM 1986 O TYR A 146 120.414 -12.244 -6.057 1.00 0.00 O ATOM 1987 CB TYR A 146 120.858 -11.019 -8.990 1.00 0.00 C ATOM 1988 CG TYR A 146 120.232 -10.278 -10.148 1.00 0.00 C ATOM 1989 CD1 TYR A 146 120.273 -10.827 -11.435 1.00 0.00 C ATOM 1990 CD2 TYR A 146 119.614 -9.039 -9.936 1.00 0.00 C ATOM 1991 CE1 TYR A 146 119.694 -10.139 -12.509 1.00 0.00 C ATOM 1992 CE2 TYR A 146 119.037 -8.351 -11.010 1.00 0.00 C ATOM 1993 CZ TYR A 146 119.077 -8.901 -12.296 1.00 0.00 C ATOM 1994 OH TYR A 146 118.507 -8.223 -13.355 1.00 0.00 O ATOM 0 H TYR A 146 118.984 -10.468 -7.078 1.00 0.00 H new ATOM 0 HA TYR A 146 119.466 -12.697 -9.074 1.00 0.00 H new ATOM 0 HB2 TYR A 146 121.223 -10.311 -8.247 1.00 0.00 H new ATOM 0 HB3 TYR A 146 121.719 -11.592 -9.334 1.00 0.00 H new ATOM 0 HD1 TYR A 146 120.751 -11.781 -11.600 1.00 0.00 H new ATOM 0 HD2 TYR A 146 119.583 -8.614 -8.944 1.00 0.00 H new ATOM 0 HE1 TYR A 146 119.724 -10.564 -13.501 1.00 0.00 H new ATOM 0 HE2 TYR A 146 118.561 -7.396 -10.846 1.00 0.00 H new ATOM 0 HH TYR A 146 118.121 -7.381 -13.035 1.00 0.00 H new ATOM 2003 N ARG A 147 120.968 -13.888 -7.411 1.00 0.00 N ATOM 2004 CA ARG A 147 121.571 -14.667 -6.287 1.00 0.00 C ATOM 2005 C ARG A 147 123.000 -15.104 -6.632 1.00 0.00 C ATOM 2006 O ARG A 147 123.229 -15.803 -7.599 1.00 0.00 O ATOM 2007 CB ARG A 147 120.667 -15.891 -6.127 1.00 0.00 C ATOM 2008 CG ARG A 147 121.117 -16.703 -4.910 1.00 0.00 C ATOM 2009 CD ARG A 147 120.299 -17.994 -4.823 1.00 0.00 C ATOM 2010 NE ARG A 147 118.889 -17.547 -4.653 1.00 0.00 N ATOM 2011 CZ ARG A 147 117.916 -18.251 -5.166 1.00 0.00 C ATOM 2012 NH1 ARG A 147 117.528 -19.352 -4.582 1.00 0.00 N ATOM 2013 NH2 ARG A 147 117.330 -17.852 -6.262 1.00 0.00 N ATOM 0 H ARG A 147 121.014 -14.337 -8.326 1.00 0.00 H new ATOM 0 HA ARG A 147 121.636 -14.077 -5.373 1.00 0.00 H new ATOM 0 HB2 ARG A 147 119.630 -15.577 -6.005 1.00 0.00 H new ATOM 0 HB3 ARG A 147 120.710 -16.508 -7.025 1.00 0.00 H new ATOM 0 HG2 ARG A 147 122.178 -16.938 -4.989 1.00 0.00 H new ATOM 0 HG3 ARG A 147 120.987 -16.116 -4.001 1.00 0.00 H new ATOM 0 HD2 ARG A 147 120.416 -18.597 -5.724 1.00 0.00 H new ATOM 0 HD3 ARG A 147 120.622 -18.610 -3.983 1.00 0.00 H new ATOM 0 HE ARG A 147 118.683 -16.692 -4.136 1.00 0.00 H new ATOM 0 HH11 ARG A 147 117.985 -19.663 -3.725 1.00 0.00 H new ATOM 0 HH12 ARG A 147 116.768 -19.902 -4.983 1.00 0.00 H new ATOM 0 HH21 ARG A 147 117.632 -16.991 -6.717 1.00 0.00 H new ATOM 0 HH22 ARG A 147 116.570 -18.402 -6.663 1.00 0.00 H new ATOM 2024 N PHE A 148 123.961 -14.694 -5.841 1.00 0.00 N ATOM 2025 CA PHE A 148 125.376 -15.082 -6.115 1.00 0.00 C ATOM 2026 C PHE A 148 126.013 -15.681 -4.858 1.00 0.00 C ATOM 2027 CB PHE A 148 126.077 -13.780 -6.502 1.00 0.00 C ATOM 2028 CG PHE A 148 127.490 -14.082 -6.939 1.00 0.00 C ATOM 2029 CD1 PHE A 148 127.751 -14.435 -8.268 1.00 0.00 C ATOM 2030 CD2 PHE A 148 128.540 -14.010 -6.016 1.00 0.00 C ATOM 2031 CE1 PHE A 148 129.062 -14.715 -8.674 1.00 0.00 C ATOM 2032 CE2 PHE A 148 129.850 -14.290 -6.421 1.00 0.00 C ATOM 2033 CZ PHE A 148 130.111 -14.643 -7.751 1.00 0.00 C ATOM 0 H PHE A 148 123.825 -14.107 -5.018 1.00 0.00 H new ATOM 0 HA PHE A 148 125.453 -15.835 -6.900 1.00 0.00 H new ATOM 0 HB2 PHE A 148 125.533 -13.287 -7.308 1.00 0.00 H new ATOM 0 HB3 PHE A 148 126.085 -13.093 -5.656 1.00 0.00 H new ATOM 0 HD1 PHE A 148 126.941 -14.492 -8.981 1.00 0.00 H new ATOM 0 HD2 PHE A 148 128.339 -13.738 -4.990 1.00 0.00 H new ATOM 0 HE1 PHE A 148 129.263 -14.987 -9.700 1.00 0.00 H new ATOM 0 HE2 PHE A 148 130.659 -14.234 -5.708 1.00 0.00 H new ATOM 0 HZ PHE A 148 131.122 -14.860 -8.064 1.00 0.00 H new TER 2042 PHE A 148