USER MOD reduce.3.24.130724 H: found=0, std=0, add=1070, rem=0, adj=48 USER MOD reduce.3.24.130724 removed 1069 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 108 SER OG : rot 180:sc= 0.59 USER MOD Set 1.2: A 130 SER OG : rot 109:sc= 1.05 USER MOD Set 2.1: A 61 GLN : amide:sc= -0.0324 X(o=0.14,f=0.34) USER MOD Set 2.2: A 63 TYR OH : rot -107:sc= 0.174 USER MOD Set 3.1: A 46 THR OG1 : rot 175:sc= 0 USER MOD Set 3.2: A 62 TYR OH : rot 180:sc= -0.147 USER MOD Set 4.1: A 53 SER OG : rot 180:sc= 0.168 USER MOD Set 4.2: A 54 SER OG : rot 180:sc= 0 USER MOD Set 5.1: A 25 ASN : amide:sc= 1.21 K(o=2.1,f=0.82) USER MOD Set 5.2: A 42 SER OG : rot -105:sc= -0.0729 USER MOD Set 5.3: A 44 THR OG1 : rot -41:sc= 0.92 USER MOD Single : A 1 ALA N :NH3+ 142:sc= 0.687 (180deg=0.0576) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 THR OG1 : rot -110:sc= 0.406 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 12 SER OG : rot -160:sc= -1.36 USER MOD Single : A 15 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 17 GLN : amide:sc= 0 X(o=0,f=-0.027) USER MOD Single : A 18 MET CE :methyl -154:sc= -0.197 (180deg=-1.18!) USER MOD Single : A 19 ASN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : A 20 LYS NZ :NH3+ 153:sc= -0.168 (180deg=-0.988) USER MOD Single : A 21 MET CE :methyl -117:sc= -1.28 (180deg=-2.38) USER MOD Single : A 27 LYS NZ :NH3+ -163:sc= -2.16 (180deg=-2.98!) USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 ASN : amide:sc= -0.11 K(o=-0.11,f=-1.9!) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 45 TYR OH : rot -140:sc= 1.31 USER MOD Single : A 48 LYS NZ :NH3+ -169:sc= 0.261 (180deg=0.21) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 TYR OH : rot 130:sc= -0.739 USER MOD Single : A 58 ASN : amide:sc= -1.96 K(o=-2,f=-2.8!) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 ASN : amide:sc= -2.24 K(o=-2.2,f=-3.4) USER MOD Single : A 66 THR OG1 : rot 16:sc= -0.863 USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= -0.28 X(o=-0.28,f=-0.0085) USER MOD Single : A 78 SER OG : rot 180:sc= -0.106 USER MOD Single : A 80 TYR OH : rot 21:sc= 0.27 USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 GLN : amide:sc= -1.31 K(o=-1.3,f=-5.2!) USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.203 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 HIS : no HD1:sc= 0 X(o=0,f=-0.082) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 GLN : amide:sc= -1.04 K(o=-1,f=-5.5!) USER MOD Single : A 116 ASN : amide:sc= 0 X(o=0,f=0.024) USER MOD Single : A 118 MET CE :methyl -154:sc= -0.246 (180deg=-1.43!) USER MOD Single : A 120 ASN : amide:sc= -0.199 X(o=-0.2,f=0) USER MOD Single : A 126 SER OG : rot 23:sc= 1.25 USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 134 SER OG : rot -32:sc= 0.533 USER MOD Single : A 139 THR OG1 : rot -168:sc= -0.703 USER MOD Single : A 146 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 116.631 -24.698 8.608 1.00 0.00 N ATOM 2 CA ALA A 1 116.673 -23.218 8.783 1.00 0.00 C ATOM 3 C ALA A 1 117.434 -22.594 7.618 1.00 0.00 C ATOM 4 O ALA A 1 118.651 -22.744 7.508 1.00 0.00 O ATOM 5 CB ALA A 1 117.370 -22.882 10.103 1.00 0.00 C ATOM 0 H1 ALA A 1 116.736 -25.160 9.534 1.00 0.00 H new ATOM 0 H2 ALA A 1 115.721 -24.972 8.186 1.00 0.00 H new ATOM 0 H3 ALA A 1 117.407 -24.996 7.982 1.00 0.00 H new ATOM 0 HA ALA A 1 115.659 -22.820 8.803 1.00 0.00 H new ATOM 0 HB1 ALA A 1 117.402 -21.800 10.233 1.00 0.00 H new ATOM 0 HB2 ALA A 1 116.819 -23.331 10.930 1.00 0.00 H new ATOM 0 HB3 ALA A 1 118.386 -23.276 10.088 1.00 0.00 H new ATOM 13 N THR A 2 116.709 -21.891 6.751 1.00 0.00 N ATOM 14 CA THR A 2 117.318 -21.239 5.594 1.00 0.00 C ATOM 15 C THR A 2 117.029 -19.742 5.615 1.00 0.00 C ATOM 16 O THR A 2 115.930 -19.318 5.976 1.00 0.00 O ATOM 17 CB THR A 2 116.769 -21.846 4.300 1.00 0.00 C ATOM 18 OG1 THR A 2 115.372 -21.606 4.222 1.00 0.00 O ATOM 19 CG2 THR A 2 117.034 -23.353 4.281 1.00 0.00 C ATOM 0 H THR A 2 115.701 -21.758 6.827 1.00 0.00 H new ATOM 0 HA THR A 2 118.396 -21.394 5.638 1.00 0.00 H new ATOM 0 HB THR A 2 117.266 -21.386 3.446 1.00 0.00 H new ATOM 0 HG1 THR A 2 115.019 -21.992 3.393 1.00 0.00 H new ATOM 0 HG21 THR A 2 116.641 -23.780 3.358 1.00 0.00 H new ATOM 0 HG22 THR A 2 118.107 -23.534 4.337 1.00 0.00 H new ATOM 0 HG23 THR A 2 116.542 -23.820 5.135 1.00 0.00 H new ATOM 27 N SER A 3 118.021 -18.945 5.228 1.00 0.00 N ATOM 28 CA SER A 3 117.868 -17.492 5.212 1.00 0.00 C ATOM 29 C SER A 3 118.256 -16.933 3.848 1.00 0.00 C ATOM 30 O SER A 3 119.198 -17.412 3.218 1.00 0.00 O ATOM 31 CB SER A 3 118.754 -16.866 6.291 1.00 0.00 C ATOM 32 OG SER A 3 118.509 -15.467 6.340 1.00 0.00 O ATOM 0 H SER A 3 118.935 -19.278 4.923 1.00 0.00 H new ATOM 0 HA SER A 3 116.824 -17.249 5.411 1.00 0.00 H new ATOM 0 HB2 SER A 3 118.543 -17.319 7.260 1.00 0.00 H new ATOM 0 HB3 SER A 3 119.805 -17.056 6.072 1.00 0.00 H new ATOM 0 HG SER A 3 119.073 -15.060 7.031 1.00 0.00 H new ATOM 38 N THR A 4 117.517 -15.924 3.395 1.00 0.00 N ATOM 39 CA THR A 4 117.792 -15.293 2.107 1.00 0.00 C ATOM 40 C THR A 4 117.892 -13.781 2.274 1.00 0.00 C ATOM 41 O THR A 4 117.048 -13.164 2.923 1.00 0.00 O ATOM 42 CB THR A 4 116.677 -15.625 1.113 1.00 0.00 C ATOM 43 OG1 THR A 4 116.513 -17.034 1.041 1.00 0.00 O ATOM 44 CG2 THR A 4 117.042 -15.081 -0.270 1.00 0.00 C ATOM 0 H THR A 4 116.725 -15.526 3.899 1.00 0.00 H new ATOM 0 HA THR A 4 118.740 -15.674 1.726 1.00 0.00 H new ATOM 0 HB THR A 4 115.746 -15.166 1.446 1.00 0.00 H new ATOM 0 HG1 THR A 4 116.825 -17.356 0.170 1.00 0.00 H new ATOM 0 HG21 THR A 4 116.246 -15.319 -0.976 1.00 0.00 H new ATOM 0 HG22 THR A 4 117.167 -14.000 -0.214 1.00 0.00 H new ATOM 0 HG23 THR A 4 117.973 -15.537 -0.606 1.00 0.00 H new ATOM 52 N VAL A 5 118.928 -13.183 1.688 1.00 0.00 N ATOM 53 CA VAL A 5 119.121 -11.737 1.783 1.00 0.00 C ATOM 54 C VAL A 5 119.265 -11.141 0.387 1.00 0.00 C ATOM 55 O VAL A 5 119.989 -11.678 -0.447 1.00 0.00 O ATOM 56 CB VAL A 5 120.363 -11.435 2.634 1.00 0.00 C ATOM 57 CG1 VAL A 5 121.615 -12.024 1.976 1.00 0.00 C ATOM 58 CG2 VAL A 5 120.532 -9.920 2.785 1.00 0.00 C ATOM 0 H VAL A 5 119.641 -13.672 1.147 1.00 0.00 H new ATOM 0 HA VAL A 5 118.253 -11.285 2.263 1.00 0.00 H new ATOM 0 HB VAL A 5 120.231 -11.888 3.617 1.00 0.00 H new ATOM 0 HG11 VAL A 5 122.488 -11.802 2.590 1.00 0.00 H new ATOM 0 HG12 VAL A 5 121.503 -13.104 1.882 1.00 0.00 H new ATOM 0 HG13 VAL A 5 121.747 -11.585 0.987 1.00 0.00 H new ATOM 0 HG21 VAL A 5 121.415 -9.711 3.390 1.00 0.00 H new ATOM 0 HG22 VAL A 5 120.651 -9.467 1.801 1.00 0.00 H new ATOM 0 HG23 VAL A 5 119.651 -9.502 3.272 1.00 0.00 H new ATOM 68 N THR A 6 118.567 -10.035 0.142 1.00 0.00 N ATOM 69 CA THR A 6 118.595 -9.395 -1.171 1.00 0.00 C ATOM 70 C THR A 6 118.785 -7.889 -1.027 1.00 0.00 C ATOM 71 O THR A 6 118.320 -7.287 -0.060 1.00 0.00 O ATOM 72 CB THR A 6 117.280 -9.672 -1.911 1.00 0.00 C ATOM 73 OG1 THR A 6 116.895 -11.025 -1.708 1.00 0.00 O ATOM 74 CG2 THR A 6 117.456 -9.417 -3.411 1.00 0.00 C ATOM 0 H THR A 6 117.979 -9.566 0.830 1.00 0.00 H new ATOM 0 HA THR A 6 119.430 -9.805 -1.739 1.00 0.00 H new ATOM 0 HB THR A 6 116.509 -9.007 -1.522 1.00 0.00 H new ATOM 0 HG1 THR A 6 116.054 -11.200 -2.180 1.00 0.00 H new ATOM 0 HG21 THR A 6 116.517 -9.617 -3.927 1.00 0.00 H new ATOM 0 HG22 THR A 6 117.745 -8.378 -3.572 1.00 0.00 H new ATOM 0 HG23 THR A 6 118.232 -10.074 -3.803 1.00 0.00 H new ATOM 82 N GLY A 7 119.468 -7.284 -1.992 1.00 0.00 N ATOM 83 CA GLY A 7 119.637 -5.834 -2.003 1.00 0.00 C ATOM 84 C GLY A 7 119.400 -5.307 -3.410 1.00 0.00 C ATOM 85 O GLY A 7 119.647 -6.021 -4.382 1.00 0.00 O ATOM 0 H GLY A 7 119.911 -7.770 -2.772 1.00 0.00 H new ATOM 0 HA2 GLY A 7 118.938 -5.370 -1.307 1.00 0.00 H new ATOM 0 HA3 GLY A 7 120.641 -5.572 -1.669 1.00 0.00 H new ATOM 89 N GLY A 8 118.930 -4.068 -3.519 1.00 0.00 N ATOM 90 CA GLY A 8 118.608 -3.518 -4.831 1.00 0.00 C ATOM 91 C GLY A 8 118.623 -1.995 -4.837 1.00 0.00 C ATOM 92 O GLY A 8 118.693 -1.356 -3.787 1.00 0.00 O ATOM 0 H GLY A 8 118.766 -3.438 -2.734 1.00 0.00 H new ATOM 0 HA2 GLY A 8 119.324 -3.889 -5.564 1.00 0.00 H new ATOM 0 HA3 GLY A 8 117.624 -3.871 -5.139 1.00 0.00 H new ATOM 96 N TYR A 9 118.540 -1.433 -6.038 1.00 0.00 N ATOM 97 CA TYR A 9 118.514 0.016 -6.213 1.00 0.00 C ATOM 98 C TYR A 9 117.234 0.422 -6.937 1.00 0.00 C ATOM 99 O TYR A 9 116.736 -0.322 -7.784 1.00 0.00 O ATOM 100 CB TYR A 9 119.729 0.465 -7.028 1.00 0.00 C ATOM 101 CG TYR A 9 119.827 1.965 -7.180 1.00 0.00 C ATOM 102 CD1 TYR A 9 120.532 2.720 -6.234 1.00 0.00 C ATOM 103 CD2 TYR A 9 119.215 2.600 -8.267 1.00 0.00 C ATOM 104 CE1 TYR A 9 120.624 4.109 -6.376 1.00 0.00 C ATOM 105 CE2 TYR A 9 119.307 3.990 -8.409 1.00 0.00 C ATOM 106 CZ TYR A 9 120.012 4.745 -7.464 1.00 0.00 C ATOM 107 OH TYR A 9 120.103 6.114 -7.603 1.00 0.00 O ATOM 0 H TYR A 9 118.489 -1.961 -6.909 1.00 0.00 H new ATOM 0 HA TYR A 9 118.544 0.494 -5.234 1.00 0.00 H new ATOM 0 HB2 TYR A 9 120.636 0.096 -6.549 1.00 0.00 H new ATOM 0 HB3 TYR A 9 119.683 0.009 -8.017 1.00 0.00 H new ATOM 0 HD1 TYR A 9 121.004 2.230 -5.395 1.00 0.00 H new ATOM 0 HD2 TYR A 9 118.672 2.018 -8.996 1.00 0.00 H new ATOM 0 HE1 TYR A 9 121.167 4.691 -5.646 1.00 0.00 H new ATOM 0 HE2 TYR A 9 118.834 4.480 -9.247 1.00 0.00 H new ATOM 0 HH TYR A 9 119.624 6.393 -8.411 1.00 0.00 H new ATOM 117 N ALA A 10 116.675 1.569 -6.556 1.00 0.00 N ATOM 118 CA ALA A 10 115.455 2.058 -7.192 1.00 0.00 C ATOM 119 C ALA A 10 115.515 3.566 -7.422 1.00 0.00 C ATOM 120 O ALA A 10 116.150 4.295 -6.661 1.00 0.00 O ATOM 121 CB ALA A 10 114.245 1.724 -6.318 1.00 0.00 C ATOM 0 H ALA A 10 117.043 2.171 -5.819 1.00 0.00 H new ATOM 0 HA ALA A 10 115.360 1.567 -8.160 1.00 0.00 H new ATOM 0 HB1 ALA A 10 113.338 2.091 -6.797 1.00 0.00 H new ATOM 0 HB2 ALA A 10 114.176 0.644 -6.190 1.00 0.00 H new ATOM 0 HB3 ALA A 10 114.358 2.199 -5.343 1.00 0.00 H new ATOM 127 N GLN A 11 114.839 4.020 -8.474 1.00 0.00 N ATOM 128 CA GLN A 11 114.716 5.447 -8.760 1.00 0.00 C ATOM 129 C GLN A 11 113.248 5.854 -8.690 1.00 0.00 C ATOM 130 O GLN A 11 112.376 5.111 -9.142 1.00 0.00 O ATOM 131 CB GLN A 11 115.269 5.755 -10.153 1.00 0.00 C ATOM 132 CG GLN A 11 116.769 5.450 -10.190 1.00 0.00 C ATOM 133 CD GLN A 11 117.327 5.670 -11.595 1.00 0.00 C ATOM 134 OE1 GLN A 11 116.577 5.708 -12.572 1.00 0.00 O ATOM 135 NE2 GLN A 11 118.613 5.819 -11.757 1.00 0.00 N ATOM 0 H GLN A 11 114.365 3.416 -9.146 1.00 0.00 H new ATOM 0 HA GLN A 11 115.287 6.009 -8.021 1.00 0.00 H new ATOM 0 HB2 GLN A 11 114.748 5.159 -10.902 1.00 0.00 H new ATOM 0 HB3 GLN A 11 115.094 6.802 -10.401 1.00 0.00 H new ATOM 0 HG2 GLN A 11 117.293 6.090 -9.480 1.00 0.00 H new ATOM 0 HG3 GLN A 11 116.944 4.420 -9.880 1.00 0.00 H new ATOM 0 HE21 GLN A 11 119.236 5.788 -10.950 1.00 0.00 H new ATOM 0 HE22 GLN A 11 118.996 5.967 -12.691 1.00 0.00 H new ATOM 144 N SER A 12 112.967 7.028 -8.126 1.00 0.00 N ATOM 145 CA SER A 12 111.585 7.449 -7.915 1.00 0.00 C ATOM 146 C SER A 12 111.272 8.703 -8.722 1.00 0.00 C ATOM 147 O SER A 12 112.019 9.680 -8.672 1.00 0.00 O ATOM 148 CB SER A 12 111.362 7.736 -6.430 1.00 0.00 C ATOM 149 OG SER A 12 110.019 8.151 -6.232 1.00 0.00 O ATOM 0 H SER A 12 113.670 7.697 -7.811 1.00 0.00 H new ATOM 0 HA SER A 12 110.924 6.647 -8.245 1.00 0.00 H new ATOM 0 HB2 SER A 12 111.570 6.844 -5.839 1.00 0.00 H new ATOM 0 HB3 SER A 12 112.049 8.511 -6.090 1.00 0.00 H new ATOM 0 HG SER A 12 109.947 8.630 -5.380 1.00 0.00 H new ATOM 155 N ASP A 13 110.154 8.665 -9.444 1.00 0.00 N ATOM 156 CA ASP A 13 109.700 9.813 -10.216 1.00 0.00 C ATOM 157 C ASP A 13 108.468 10.399 -9.542 1.00 0.00 C ATOM 158 O ASP A 13 107.600 9.656 -9.086 1.00 0.00 O ATOM 159 CB ASP A 13 109.357 9.386 -11.645 1.00 0.00 C ATOM 160 CG ASP A 13 110.576 8.753 -12.306 1.00 0.00 C ATOM 161 OD1 ASP A 13 111.341 9.482 -12.917 1.00 0.00 O ATOM 162 OD2 ASP A 13 110.728 7.548 -12.192 1.00 0.00 O ATOM 0 H ASP A 13 109.547 7.848 -9.509 1.00 0.00 H new ATOM 0 HA ASP A 13 110.492 10.561 -10.259 1.00 0.00 H new ATOM 0 HB2 ASP A 13 108.530 8.676 -11.633 1.00 0.00 H new ATOM 0 HB3 ASP A 13 109.027 10.250 -12.222 1.00 0.00 H new ATOM 167 N ALA A 14 108.388 11.724 -9.487 1.00 0.00 N ATOM 168 CA ALA A 14 107.326 12.389 -8.743 1.00 0.00 C ATOM 169 C ALA A 14 106.480 13.256 -9.668 1.00 0.00 C ATOM 170 O ALA A 14 106.921 14.307 -10.135 1.00 0.00 O ATOM 171 CB ALA A 14 107.947 13.244 -7.635 1.00 0.00 C ATOM 0 H ALA A 14 109.043 12.356 -9.947 1.00 0.00 H new ATOM 0 HA ALA A 14 106.675 11.635 -8.300 1.00 0.00 H new ATOM 0 HB1 ALA A 14 107.157 13.744 -7.075 1.00 0.00 H new ATOM 0 HB2 ALA A 14 108.521 12.607 -6.962 1.00 0.00 H new ATOM 0 HB3 ALA A 14 108.606 13.991 -8.078 1.00 0.00 H new ATOM 177 N GLN A 15 105.263 12.799 -9.924 1.00 0.00 N ATOM 178 CA GLN A 15 104.317 13.567 -10.721 1.00 0.00 C ATOM 179 C GLN A 15 103.587 14.566 -9.832 1.00 0.00 C ATOM 180 O GLN A 15 102.919 14.184 -8.869 1.00 0.00 O ATOM 181 CB GLN A 15 103.304 12.634 -11.387 1.00 0.00 C ATOM 182 CG GLN A 15 104.022 11.735 -12.397 1.00 0.00 C ATOM 183 CD GLN A 15 103.045 10.735 -13.014 1.00 0.00 C ATOM 184 OE1 GLN A 15 101.967 10.490 -12.470 1.00 0.00 O ATOM 185 NE2 GLN A 15 103.363 10.137 -14.129 1.00 0.00 N ATOM 0 H GLN A 15 104.908 11.902 -9.592 1.00 0.00 H new ATOM 0 HA GLN A 15 104.865 14.104 -11.496 1.00 0.00 H new ATOM 0 HB2 GLN A 15 102.805 12.025 -10.633 1.00 0.00 H new ATOM 0 HB3 GLN A 15 102.532 13.217 -11.888 1.00 0.00 H new ATOM 0 HG2 GLN A 15 104.470 12.345 -13.181 1.00 0.00 H new ATOM 0 HG3 GLN A 15 104.835 11.201 -11.904 1.00 0.00 H new ATOM 0 HE21 GLN A 15 104.255 10.339 -14.580 1.00 0.00 H new ATOM 0 HE22 GLN A 15 102.719 9.467 -14.550 1.00 0.00 H new ATOM 194 N GLY A 16 103.712 15.840 -10.193 1.00 0.00 N ATOM 195 CA GLY A 16 103.175 16.939 -9.390 1.00 0.00 C ATOM 196 C GLY A 16 104.169 17.438 -8.329 1.00 0.00 C ATOM 197 O GLY A 16 103.980 18.514 -7.764 1.00 0.00 O ATOM 0 H GLY A 16 104.185 16.141 -11.045 1.00 0.00 H new ATOM 0 HA2 GLY A 16 102.905 17.766 -10.047 1.00 0.00 H new ATOM 0 HA3 GLY A 16 102.259 16.611 -8.898 1.00 0.00 H new ATOM 201 N GLN A 17 105.224 16.665 -8.055 1.00 0.00 N ATOM 202 CA GLN A 17 106.326 17.123 -7.215 1.00 0.00 C ATOM 203 C GLN A 17 107.605 17.172 -8.045 1.00 0.00 C ATOM 204 O GLN A 17 107.784 16.365 -8.958 1.00 0.00 O ATOM 205 CB GLN A 17 106.494 16.189 -6.014 1.00 0.00 C ATOM 206 CG GLN A 17 107.560 16.743 -5.064 1.00 0.00 C ATOM 207 CD GLN A 17 107.826 15.745 -3.942 1.00 0.00 C ATOM 208 OE1 GLN A 17 108.216 14.608 -4.201 1.00 0.00 O ATOM 209 NE2 GLN A 17 107.640 16.107 -2.702 1.00 0.00 N ATOM 0 H GLN A 17 105.335 15.714 -8.407 1.00 0.00 H new ATOM 0 HA GLN A 17 106.110 18.123 -6.839 1.00 0.00 H new ATOM 0 HB2 GLN A 17 105.545 16.085 -5.488 1.00 0.00 H new ATOM 0 HB3 GLN A 17 106.780 15.194 -6.354 1.00 0.00 H new ATOM 0 HG2 GLN A 17 108.481 16.940 -5.613 1.00 0.00 H new ATOM 0 HG3 GLN A 17 107.228 17.693 -4.646 1.00 0.00 H new ATOM 0 HE21 GLN A 17 107.316 17.051 -2.489 1.00 0.00 H new ATOM 0 HE22 GLN A 17 107.818 15.446 -1.946 1.00 0.00 H new ATOM 218 N MET A 18 108.492 18.112 -7.734 1.00 0.00 N ATOM 219 CA MET A 18 109.724 18.266 -8.503 1.00 0.00 C ATOM 220 C MET A 18 110.844 17.405 -7.925 1.00 0.00 C ATOM 221 O MET A 18 110.742 16.900 -6.807 1.00 0.00 O ATOM 222 CB MET A 18 110.163 19.735 -8.495 1.00 0.00 C ATOM 223 CG MET A 18 109.060 20.629 -9.074 1.00 0.00 C ATOM 224 SD MET A 18 108.656 20.127 -10.768 1.00 0.00 S ATOM 225 CE MET A 18 110.273 20.469 -11.507 1.00 0.00 C ATOM 0 H MET A 18 108.384 18.772 -6.964 1.00 0.00 H new ATOM 0 HA MET A 18 109.526 17.942 -9.525 1.00 0.00 H new ATOM 0 HB2 MET A 18 110.394 20.046 -7.476 1.00 0.00 H new ATOM 0 HB3 MET A 18 111.077 19.851 -9.078 1.00 0.00 H new ATOM 0 HG2 MET A 18 108.169 20.568 -8.449 1.00 0.00 H new ATOM 0 HG3 MET A 18 109.385 21.669 -9.065 1.00 0.00 H new ATOM 0 HE1 MET A 18 110.151 20.678 -12.570 1.00 0.00 H new ATOM 0 HE2 MET A 18 110.722 21.333 -11.017 1.00 0.00 H new ATOM 0 HE3 MET A 18 110.922 19.602 -11.380 1.00 0.00 H new ATOM 235 N ASN A 19 111.901 17.228 -8.718 1.00 0.00 N ATOM 236 CA ASN A 19 113.106 16.522 -8.282 1.00 0.00 C ATOM 237 C ASN A 19 112.857 15.031 -8.059 1.00 0.00 C ATOM 238 O ASN A 19 112.078 14.640 -7.190 1.00 0.00 O ATOM 239 CB ASN A 19 113.661 17.145 -6.997 1.00 0.00 C ATOM 240 CG ASN A 19 113.913 18.634 -7.206 1.00 0.00 C ATOM 241 OD1 ASN A 19 114.410 19.039 -8.257 1.00 0.00 O ATOM 242 ND2 ASN A 19 113.596 19.478 -6.262 1.00 0.00 N ATOM 0 H ASN A 19 111.946 17.569 -9.678 1.00 0.00 H new ATOM 0 HA ASN A 19 113.836 16.623 -9.085 1.00 0.00 H new ATOM 0 HB2 ASN A 19 112.956 16.998 -6.178 1.00 0.00 H new ATOM 0 HB3 ASN A 19 114.588 16.647 -6.713 1.00 0.00 H new ATOM 0 HD21 ASN A 19 113.760 20.476 -6.394 1.00 0.00 H new ATOM 0 HD22 ASN A 19 113.184 19.139 -5.392 1.00 0.00 H new ATOM 249 N LYS A 20 113.531 14.210 -8.861 1.00 0.00 N ATOM 250 CA LYS A 20 113.509 12.761 -8.677 1.00 0.00 C ATOM 251 C LYS A 20 114.487 12.358 -7.572 1.00 0.00 C ATOM 252 O LYS A 20 115.367 13.139 -7.213 1.00 0.00 O ATOM 253 CB LYS A 20 113.835 12.059 -10.005 1.00 0.00 C ATOM 254 CG LYS A 20 115.289 12.313 -10.422 1.00 0.00 C ATOM 255 CD LYS A 20 115.538 11.708 -11.805 1.00 0.00 C ATOM 256 CE LYS A 20 117.041 11.681 -12.089 1.00 0.00 C ATOM 257 NZ LYS A 20 117.719 10.803 -11.093 1.00 0.00 N ATOM 0 H LYS A 20 114.101 14.525 -9.647 1.00 0.00 H new ATOM 0 HA LYS A 20 112.511 12.448 -8.369 1.00 0.00 H new ATOM 0 HB2 LYS A 20 113.664 10.987 -9.905 1.00 0.00 H new ATOM 0 HB3 LYS A 20 113.162 12.417 -10.784 1.00 0.00 H new ATOM 0 HG2 LYS A 20 115.491 13.384 -10.440 1.00 0.00 H new ATOM 0 HG3 LYS A 20 115.969 11.873 -9.693 1.00 0.00 H new ATOM 0 HD2 LYS A 20 115.131 10.698 -11.850 1.00 0.00 H new ATOM 0 HD3 LYS A 20 115.024 12.293 -12.567 1.00 0.00 H new ATOM 0 HE2 LYS A 20 117.225 11.313 -13.099 1.00 0.00 H new ATOM 0 HE3 LYS A 20 117.450 12.690 -12.038 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 118.590 10.414 -11.509 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 117.957 11.358 -10.246 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 117.084 10.023 -10.828 1.00 0.00 H new ATOM 271 N MET A 21 114.334 11.150 -7.031 1.00 0.00 N ATOM 272 CA MET A 21 115.142 10.738 -5.881 1.00 0.00 C ATOM 273 C MET A 21 115.713 9.340 -6.095 1.00 0.00 C ATOM 274 O MET A 21 115.248 8.605 -6.963 1.00 0.00 O ATOM 275 CB MET A 21 114.287 10.752 -4.613 1.00 0.00 C ATOM 276 CG MET A 21 113.722 12.157 -4.391 1.00 0.00 C ATOM 277 SD MET A 21 112.912 12.236 -2.775 1.00 0.00 S ATOM 278 CE MET A 21 114.414 12.220 -1.767 1.00 0.00 C ATOM 0 H MET A 21 113.671 10.449 -7.362 1.00 0.00 H new ATOM 0 HA MET A 21 115.968 11.441 -5.773 1.00 0.00 H new ATOM 0 HB2 MET A 21 113.474 10.032 -4.703 1.00 0.00 H new ATOM 0 HB3 MET A 21 114.887 10.450 -3.754 1.00 0.00 H new ATOM 0 HG2 MET A 21 114.523 12.895 -4.444 1.00 0.00 H new ATOM 0 HG3 MET A 21 113.010 12.402 -5.179 1.00 0.00 H new ATOM 0 HE1 MET A 21 114.427 11.323 -1.147 1.00 0.00 H new ATOM 0 HE2 MET A 21 115.289 12.224 -2.417 1.00 0.00 H new ATOM 0 HE3 MET A 21 114.433 13.103 -1.128 1.00 0.00 H new ATOM 288 N GLY A 22 116.716 8.972 -5.299 1.00 0.00 N ATOM 289 CA GLY A 22 117.331 7.652 -5.424 1.00 0.00 C ATOM 290 C GLY A 22 117.398 6.986 -4.058 1.00 0.00 C ATOM 291 O GLY A 22 117.625 7.663 -3.056 1.00 0.00 O ATOM 0 H GLY A 22 117.116 9.561 -4.569 1.00 0.00 H new ATOM 0 HA2 GLY A 22 116.753 7.035 -6.112 1.00 0.00 H new ATOM 0 HA3 GLY A 22 118.333 7.745 -5.843 1.00 0.00 H new ATOM 295 N GLY A 23 117.182 5.673 -4.013 1.00 0.00 N ATOM 296 CA GLY A 23 117.167 4.973 -2.735 1.00 0.00 C ATOM 297 C GLY A 23 117.687 3.546 -2.849 1.00 0.00 C ATOM 298 O GLY A 23 117.812 2.997 -3.945 1.00 0.00 O ATOM 0 H GLY A 23 117.018 5.084 -4.830 1.00 0.00 H new ATOM 0 HA2 GLY A 23 117.775 5.522 -2.016 1.00 0.00 H new ATOM 0 HA3 GLY A 23 116.149 4.956 -2.345 1.00 0.00 H new ATOM 302 N PHE A 24 117.952 2.947 -1.691 1.00 0.00 N ATOM 303 CA PHE A 24 118.449 1.577 -1.624 1.00 0.00 C ATOM 304 C PHE A 24 117.483 0.721 -0.814 1.00 0.00 C ATOM 305 O PHE A 24 116.811 1.224 0.086 1.00 0.00 O ATOM 306 CB PHE A 24 119.831 1.553 -0.970 1.00 0.00 C ATOM 307 CG PHE A 24 120.874 2.332 -1.738 1.00 0.00 C ATOM 308 CD1 PHE A 24 121.587 1.715 -2.773 1.00 0.00 C ATOM 309 CD2 PHE A 24 121.127 3.670 -1.413 1.00 0.00 C ATOM 310 CE1 PHE A 24 122.553 2.438 -3.484 1.00 0.00 C ATOM 311 CE2 PHE A 24 122.093 4.392 -2.125 1.00 0.00 C ATOM 312 CZ PHE A 24 122.805 3.776 -3.160 1.00 0.00 C ATOM 0 H PHE A 24 117.830 3.393 -0.782 1.00 0.00 H new ATOM 0 HA PHE A 24 118.527 1.177 -2.635 1.00 0.00 H new ATOM 0 HB2 PHE A 24 119.754 1.960 0.038 1.00 0.00 H new ATOM 0 HB3 PHE A 24 120.160 0.519 -0.872 1.00 0.00 H new ATOM 0 HD1 PHE A 24 121.392 0.683 -3.023 1.00 0.00 H new ATOM 0 HD2 PHE A 24 120.578 4.145 -0.614 1.00 0.00 H new ATOM 0 HE1 PHE A 24 123.104 1.963 -4.282 1.00 0.00 H new ATOM 0 HE2 PHE A 24 122.288 5.424 -1.875 1.00 0.00 H new ATOM 0 HZ PHE A 24 123.549 4.333 -3.709 1.00 0.00 H new ATOM 322 N ASN A 25 117.416 -0.569 -1.141 1.00 0.00 N ATOM 323 CA ASN A 25 116.478 -1.474 -0.483 1.00 0.00 C ATOM 324 C ASN A 25 117.207 -2.681 0.099 1.00 0.00 C ATOM 325 O ASN A 25 118.078 -3.256 -0.555 1.00 0.00 O ATOM 326 CB ASN A 25 115.440 -1.949 -1.502 1.00 0.00 C ATOM 327 CG ASN A 25 114.247 -2.570 -0.789 1.00 0.00 C ATOM 328 OD1 ASN A 25 113.539 -1.883 -0.051 1.00 0.00 O ATOM 329 ND2 ASN A 25 113.978 -3.834 -0.967 1.00 0.00 N ATOM 0 H ASN A 25 117.998 -1.008 -1.854 1.00 0.00 H new ATOM 0 HA ASN A 25 115.988 -0.940 0.331 1.00 0.00 H new ATOM 0 HB2 ASN A 25 115.110 -1.109 -2.114 1.00 0.00 H new ATOM 0 HB3 ASN A 25 115.889 -2.678 -2.176 1.00 0.00 H new ATOM 0 HD21 ASN A 25 113.179 -4.257 -0.494 1.00 0.00 H new ATOM 0 HD22 ASN A 25 114.567 -4.399 -1.579 1.00 0.00 H new ATOM 336 N LEU A 26 116.833 -3.061 1.321 1.00 0.00 N ATOM 337 CA LEU A 26 117.420 -4.226 1.979 1.00 0.00 C ATOM 338 C LEU A 26 116.298 -5.197 2.342 1.00 0.00 C ATOM 339 O LEU A 26 115.262 -4.779 2.850 1.00 0.00 O ATOM 340 CB LEU A 26 118.171 -3.777 3.244 1.00 0.00 C ATOM 341 CG LEU A 26 119.424 -4.629 3.507 1.00 0.00 C ATOM 342 CD1 LEU A 26 119.072 -6.119 3.592 1.00 0.00 C ATOM 343 CD2 LEU A 26 120.453 -4.396 2.395 1.00 0.00 C ATOM 0 H LEU A 26 116.126 -2.578 1.875 1.00 0.00 H new ATOM 0 HA LEU A 26 118.127 -4.721 1.314 1.00 0.00 H new ATOM 0 HB2 LEU A 26 118.460 -2.731 3.141 1.00 0.00 H new ATOM 0 HB3 LEU A 26 117.503 -3.841 4.103 1.00 0.00 H new ATOM 0 HG LEU A 26 119.849 -4.327 4.464 1.00 0.00 H new ATOM 0 HD11 LEU A 26 119.977 -6.697 3.779 1.00 0.00 H new ATOM 0 HD12 LEU A 26 118.365 -6.280 4.406 1.00 0.00 H new ATOM 0 HD13 LEU A 26 118.623 -6.441 2.652 1.00 0.00 H new ATOM 0 HD21 LEU A 26 121.339 -5.002 2.586 1.00 0.00 H new ATOM 0 HD22 LEU A 26 120.021 -4.678 1.435 1.00 0.00 H new ATOM 0 HD23 LEU A 26 120.732 -3.343 2.372 1.00 0.00 H new ATOM 355 N LYS A 27 116.507 -6.487 2.093 1.00 0.00 N ATOM 356 CA LYS A 27 115.432 -7.469 2.225 1.00 0.00 C ATOM 357 C LYS A 27 115.859 -8.665 3.073 1.00 0.00 C ATOM 358 O LYS A 27 116.960 -9.191 2.911 1.00 0.00 O ATOM 359 CB LYS A 27 115.049 -7.951 0.825 1.00 0.00 C ATOM 360 CG LYS A 27 113.840 -8.886 0.887 1.00 0.00 C ATOM 361 CD LYS A 27 113.554 -9.414 -0.522 1.00 0.00 C ATOM 362 CE LYS A 27 112.262 -10.231 -0.521 1.00 0.00 C ATOM 363 NZ LYS A 27 112.560 -11.628 -0.100 1.00 0.00 N ATOM 0 H LYS A 27 117.404 -6.876 1.801 1.00 0.00 H new ATOM 0 HA LYS A 27 114.586 -6.997 2.724 1.00 0.00 H new ATOM 0 HB2 LYS A 27 114.821 -7.095 0.190 1.00 0.00 H new ATOM 0 HB3 LYS A 27 115.893 -8.469 0.370 1.00 0.00 H new ATOM 0 HG2 LYS A 27 114.037 -9.714 1.568 1.00 0.00 H new ATOM 0 HG3 LYS A 27 112.971 -8.355 1.275 1.00 0.00 H new ATOM 0 HD2 LYS A 27 113.467 -8.582 -1.221 1.00 0.00 H new ATOM 0 HD3 LYS A 27 114.385 -10.032 -0.863 1.00 0.00 H new ATOM 0 HE2 LYS A 27 111.536 -9.782 0.157 1.00 0.00 H new ATOM 0 HE3 LYS A 27 111.815 -10.227 -1.515 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 111.769 -12.248 -0.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 113.429 -11.954 -0.569 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 112.690 -11.659 0.931 1.00 0.00 H new ATOM 377 N TYR A 28 114.979 -9.089 3.979 1.00 0.00 N ATOM 378 CA TYR A 28 115.219 -10.290 4.778 1.00 0.00 C ATOM 379 C TYR A 28 114.038 -11.247 4.649 1.00 0.00 C ATOM 380 O TYR A 28 112.888 -10.814 4.684 1.00 0.00 O ATOM 381 CB TYR A 28 115.417 -9.911 6.245 1.00 0.00 C ATOM 382 CG TYR A 28 116.574 -8.966 6.468 1.00 0.00 C ATOM 383 CD1 TYR A 28 117.881 -9.464 6.537 1.00 0.00 C ATOM 384 CD2 TYR A 28 116.341 -7.592 6.604 1.00 0.00 C ATOM 385 CE1 TYR A 28 118.954 -8.588 6.742 1.00 0.00 C ATOM 386 CE2 TYR A 28 117.413 -6.716 6.808 1.00 0.00 C ATOM 387 CZ TYR A 28 118.720 -7.214 6.877 1.00 0.00 C ATOM 388 OH TYR A 28 119.777 -6.350 7.079 1.00 0.00 O ATOM 0 H TYR A 28 114.095 -8.620 4.178 1.00 0.00 H new ATOM 0 HA TYR A 28 116.120 -10.782 4.411 1.00 0.00 H new ATOM 0 HB2 TYR A 28 114.503 -9.450 6.620 1.00 0.00 H new ATOM 0 HB3 TYR A 28 115.580 -10.817 6.828 1.00 0.00 H new ATOM 0 HD1 TYR A 28 118.061 -10.524 6.432 1.00 0.00 H new ATOM 0 HD2 TYR A 28 115.333 -7.208 6.551 1.00 0.00 H new ATOM 0 HE1 TYR A 28 119.962 -8.972 6.796 1.00 0.00 H new ATOM 0 HE2 TYR A 28 117.232 -5.656 6.912 1.00 0.00 H new ATOM 0 HH TYR A 28 119.440 -5.432 7.151 1.00 0.00 H new ATOM 398 N ARG A 29 114.324 -12.541 4.510 1.00 0.00 N ATOM 399 CA ARG A 29 113.271 -13.535 4.303 1.00 0.00 C ATOM 400 C ARG A 29 113.506 -14.777 5.160 1.00 0.00 C ATOM 401 O ARG A 29 114.640 -15.231 5.311 1.00 0.00 O ATOM 402 CB ARG A 29 113.226 -13.934 2.828 1.00 0.00 C ATOM 403 CG ARG A 29 112.020 -14.843 2.575 1.00 0.00 C ATOM 404 CD ARG A 29 111.928 -15.165 1.082 1.00 0.00 C ATOM 405 NE ARG A 29 113.039 -16.033 0.681 1.00 0.00 N ATOM 406 CZ ARG A 29 113.170 -16.546 -0.553 1.00 0.00 C ATOM 407 NH1 ARG A 29 112.301 -16.306 -1.505 1.00 0.00 N ATOM 408 NH2 ARG A 29 114.196 -17.309 -0.813 1.00 0.00 N ATOM 0 H ARG A 29 115.269 -12.924 4.537 1.00 0.00 H new ATOM 0 HA ARG A 29 112.320 -13.091 4.598 1.00 0.00 H new ATOM 0 HB2 ARG A 29 113.160 -13.044 2.203 1.00 0.00 H new ATOM 0 HB3 ARG A 29 114.146 -14.450 2.553 1.00 0.00 H new ATOM 0 HG2 ARG A 29 112.118 -15.763 3.151 1.00 0.00 H new ATOM 0 HG3 ARG A 29 111.105 -14.353 2.909 1.00 0.00 H new ATOM 0 HD2 ARG A 29 110.978 -15.655 0.866 1.00 0.00 H new ATOM 0 HD3 ARG A 29 111.950 -14.243 0.502 1.00 0.00 H new ATOM 0 HE ARG A 29 113.750 -16.259 1.376 1.00 0.00 H new ATOM 0 HH11 ARG A 29 111.493 -15.712 -1.320 1.00 0.00 H new ATOM 0 HH12 ARG A 29 112.433 -16.713 -2.431 1.00 0.00 H new ATOM 0 HH21 ARG A 29 114.882 -17.507 -0.085 1.00 0.00 H new ATOM 0 HH22 ARG A 29 114.312 -17.708 -1.745 1.00 0.00 H new ATOM 422 N TYR A 30 112.427 -15.323 5.721 1.00 0.00 N ATOM 423 CA TYR A 30 112.519 -16.525 6.550 1.00 0.00 C ATOM 424 C TYR A 30 111.555 -17.598 6.044 1.00 0.00 C ATOM 425 O TYR A 30 110.439 -17.291 5.626 1.00 0.00 O ATOM 426 CB TYR A 30 112.187 -16.183 8.003 1.00 0.00 C ATOM 427 CG TYR A 30 112.412 -17.331 8.958 1.00 0.00 C ATOM 428 CD1 TYR A 30 113.683 -17.549 9.502 1.00 0.00 C ATOM 429 CD2 TYR A 30 111.349 -18.175 9.300 1.00 0.00 C ATOM 430 CE1 TYR A 30 113.892 -18.612 10.388 1.00 0.00 C ATOM 431 CE2 TYR A 30 111.558 -19.239 10.187 1.00 0.00 C ATOM 432 CZ TYR A 30 112.830 -19.458 10.731 1.00 0.00 C ATOM 433 OH TYR A 30 113.036 -20.506 11.604 1.00 0.00 O ATOM 0 H TYR A 30 111.482 -14.954 5.617 1.00 0.00 H new ATOM 0 HA TYR A 30 113.537 -16.909 6.491 1.00 0.00 H new ATOM 0 HB2 TYR A 30 112.796 -15.335 8.317 1.00 0.00 H new ATOM 0 HB3 TYR A 30 111.145 -15.868 8.065 1.00 0.00 H new ATOM 0 HD1 TYR A 30 114.502 -16.897 9.238 1.00 0.00 H new ATOM 0 HD2 TYR A 30 110.368 -18.006 8.880 1.00 0.00 H new ATOM 0 HE1 TYR A 30 114.873 -18.780 10.807 1.00 0.00 H new ATOM 0 HE2 TYR A 30 110.738 -19.891 10.451 1.00 0.00 H new ATOM 0 HH TYR A 30 112.195 -20.993 11.735 1.00 0.00 H new ATOM 443 N GLU A 31 111.991 -18.856 6.085 1.00 0.00 N ATOM 444 CA GLU A 31 111.182 -19.961 5.572 1.00 0.00 C ATOM 445 C GLU A 31 111.122 -21.115 6.572 1.00 0.00 C ATOM 446 O GLU A 31 112.083 -21.368 7.298 1.00 0.00 O ATOM 447 CB GLU A 31 111.780 -20.456 4.253 1.00 0.00 C ATOM 448 CG GLU A 31 110.837 -21.479 3.604 1.00 0.00 C ATOM 449 CD GLU A 31 111.433 -22.072 2.322 1.00 0.00 C ATOM 450 OE1 GLU A 31 112.553 -21.731 1.966 1.00 0.00 O ATOM 451 OE2 GLU A 31 110.748 -22.870 1.702 1.00 0.00 O ATOM 0 H GLU A 31 112.895 -19.135 6.466 1.00 0.00 H new ATOM 0 HA GLU A 31 110.167 -19.599 5.411 1.00 0.00 H new ATOM 0 HB2 GLU A 31 111.939 -19.615 3.578 1.00 0.00 H new ATOM 0 HB3 GLU A 31 112.755 -20.910 4.433 1.00 0.00 H new ATOM 0 HG2 GLU A 31 110.628 -22.281 4.312 1.00 0.00 H new ATOM 0 HG3 GLU A 31 109.885 -21.001 3.374 1.00 0.00 H new ATOM 458 N GLU A 32 109.987 -21.812 6.603 1.00 0.00 N ATOM 459 CA GLU A 32 109.832 -22.975 7.473 1.00 0.00 C ATOM 460 C GLU A 32 110.285 -24.240 6.746 1.00 0.00 C ATOM 461 O GLU A 32 110.117 -24.360 5.533 1.00 0.00 O ATOM 462 CB GLU A 32 108.370 -23.125 7.898 1.00 0.00 C ATOM 463 CG GLU A 32 107.931 -21.887 8.686 1.00 0.00 C ATOM 464 CD GLU A 32 108.740 -21.725 9.975 1.00 0.00 C ATOM 465 OE1 GLU A 32 109.365 -22.683 10.408 1.00 0.00 O ATOM 466 OE2 GLU A 32 108.720 -20.634 10.520 1.00 0.00 O ATOM 0 H GLU A 32 109.166 -21.593 6.039 1.00 0.00 H new ATOM 0 HA GLU A 32 110.450 -22.830 8.359 1.00 0.00 H new ATOM 0 HB2 GLU A 32 107.737 -23.252 7.020 1.00 0.00 H new ATOM 0 HB3 GLU A 32 108.249 -24.019 8.510 1.00 0.00 H new ATOM 0 HG2 GLU A 32 108.051 -20.999 8.066 1.00 0.00 H new ATOM 0 HG3 GLU A 32 106.871 -21.966 8.928 1.00 0.00 H new ATOM 473 N ASP A 33 110.859 -25.180 7.491 1.00 0.00 N ATOM 474 CA ASP A 33 111.456 -26.362 6.879 1.00 0.00 C ATOM 475 C ASP A 33 110.415 -27.335 6.321 1.00 0.00 C ATOM 476 O ASP A 33 110.569 -27.826 5.203 1.00 0.00 O ATOM 477 CB ASP A 33 112.320 -27.093 7.910 1.00 0.00 C ATOM 478 CG ASP A 33 113.482 -26.210 8.362 1.00 0.00 C ATOM 479 OD1 ASP A 33 113.931 -25.391 7.575 1.00 0.00 O ATOM 480 OD2 ASP A 33 113.910 -26.369 9.494 1.00 0.00 O ATOM 0 H ASP A 33 110.923 -25.148 8.508 1.00 0.00 H new ATOM 0 HA ASP A 33 112.060 -26.013 6.041 1.00 0.00 H new ATOM 0 HB2 ASP A 33 111.712 -27.371 8.771 1.00 0.00 H new ATOM 0 HB3 ASP A 33 112.705 -28.018 7.480 1.00 0.00 H new ATOM 485 N ASN A 34 109.359 -27.615 7.086 1.00 0.00 N ATOM 486 CA ASN A 34 108.374 -28.620 6.664 1.00 0.00 C ATOM 487 C ASN A 34 107.066 -28.015 6.144 1.00 0.00 C ATOM 488 O ASN A 34 106.262 -28.721 5.534 1.00 0.00 O ATOM 489 CB ASN A 34 108.056 -29.542 7.844 1.00 0.00 C ATOM 490 CG ASN A 34 107.441 -30.844 7.342 1.00 0.00 C ATOM 491 OD1 ASN A 34 107.669 -31.241 6.198 1.00 0.00 O ATOM 492 ND2 ASN A 34 106.669 -31.538 8.132 1.00 0.00 N ATOM 0 H ASN A 34 109.163 -27.172 7.984 1.00 0.00 H new ATOM 0 HA ASN A 34 108.824 -29.169 5.837 1.00 0.00 H new ATOM 0 HB2 ASN A 34 108.966 -29.754 8.406 1.00 0.00 H new ATOM 0 HB3 ASN A 34 107.368 -29.046 8.528 1.00 0.00 H new ATOM 0 HD21 ASN A 34 106.254 -32.410 7.803 1.00 0.00 H new ATOM 0 HD22 ASN A 34 106.481 -31.209 9.079 1.00 0.00 H new ATOM 499 N SER A 35 106.845 -26.723 6.373 1.00 0.00 N ATOM 500 CA SER A 35 105.648 -26.057 5.870 1.00 0.00 C ATOM 501 C SER A 35 105.976 -24.601 5.534 1.00 0.00 C ATOM 502 O SER A 35 105.617 -23.695 6.291 1.00 0.00 O ATOM 503 CB SER A 35 104.528 -26.135 6.911 1.00 0.00 C ATOM 504 OG SER A 35 103.287 -25.835 6.287 1.00 0.00 O ATOM 0 H SER A 35 107.476 -26.120 6.901 1.00 0.00 H new ATOM 0 HA SER A 35 105.307 -26.557 4.964 1.00 0.00 H new ATOM 0 HB2 SER A 35 104.495 -27.131 7.353 1.00 0.00 H new ATOM 0 HB3 SER A 35 104.720 -25.433 7.722 1.00 0.00 H new ATOM 0 HG SER A 35 102.567 -25.885 6.950 1.00 0.00 H new ATOM 510 N PRO A 36 106.634 -24.346 4.423 1.00 0.00 N ATOM 511 CA PRO A 36 107.199 -22.988 4.166 1.00 0.00 C ATOM 512 C PRO A 36 106.130 -21.931 3.912 1.00 0.00 C ATOM 513 O PRO A 36 105.181 -22.142 3.156 1.00 0.00 O ATOM 514 CB PRO A 36 108.078 -23.182 2.928 1.00 0.00 C ATOM 515 CG PRO A 36 107.498 -24.354 2.214 1.00 0.00 C ATOM 516 CD PRO A 36 106.895 -25.256 3.289 1.00 0.00 C ATOM 0 HA PRO A 36 107.745 -22.618 5.034 1.00 0.00 H new ATOM 0 HB2 PRO A 36 108.070 -22.293 2.297 1.00 0.00 H new ATOM 0 HB3 PRO A 36 109.116 -23.365 3.207 1.00 0.00 H new ATOM 0 HG2 PRO A 36 106.737 -24.037 1.501 1.00 0.00 H new ATOM 0 HG3 PRO A 36 108.265 -24.883 1.648 1.00 0.00 H new ATOM 0 HD2 PRO A 36 105.978 -25.732 2.941 1.00 0.00 H new ATOM 0 HD3 PRO A 36 107.582 -26.055 3.569 1.00 0.00 H new ATOM 524 N LEU A 37 106.313 -20.791 4.566 1.00 0.00 N ATOM 525 CA LEU A 37 105.525 -19.595 4.302 1.00 0.00 C ATOM 526 C LEU A 37 106.509 -18.464 4.021 1.00 0.00 C ATOM 527 O LEU A 37 107.486 -18.325 4.761 1.00 0.00 O ATOM 528 CB LEU A 37 104.663 -19.259 5.528 1.00 0.00 C ATOM 529 CG LEU A 37 103.363 -18.533 5.141 1.00 0.00 C ATOM 530 CD1 LEU A 37 103.660 -17.263 4.333 1.00 0.00 C ATOM 531 CD2 LEU A 37 102.464 -19.473 4.331 1.00 0.00 C ATOM 0 H LEU A 37 107.014 -20.670 5.297 1.00 0.00 H new ATOM 0 HA LEU A 37 104.858 -19.743 3.453 1.00 0.00 H new ATOM 0 HB2 LEU A 37 104.419 -20.178 6.062 1.00 0.00 H new ATOM 0 HB3 LEU A 37 105.236 -18.634 6.213 1.00 0.00 H new ATOM 0 HG LEU A 37 102.849 -18.240 6.056 1.00 0.00 H new ATOM 0 HD11 LEU A 37 102.723 -16.770 4.073 1.00 0.00 H new ATOM 0 HD12 LEU A 37 104.272 -16.587 4.930 1.00 0.00 H new ATOM 0 HD13 LEU A 37 104.196 -17.529 3.422 1.00 0.00 H new ATOM 0 HD21 LEU A 37 101.545 -18.953 4.060 1.00 0.00 H new ATOM 0 HD22 LEU A 37 102.985 -19.785 3.426 1.00 0.00 H new ATOM 0 HD23 LEU A 37 102.221 -20.351 4.930 1.00 0.00 H new ATOM 543 N GLY A 38 106.268 -17.660 2.984 1.00 0.00 N ATOM 544 CA GLY A 38 107.246 -16.648 2.612 1.00 0.00 C ATOM 545 C GLY A 38 106.923 -15.331 3.294 1.00 0.00 C ATOM 546 O GLY A 38 105.873 -14.744 3.055 1.00 0.00 O ATOM 0 H GLY A 38 105.429 -17.690 2.405 1.00 0.00 H new ATOM 0 HA2 GLY A 38 108.246 -16.977 2.895 1.00 0.00 H new ATOM 0 HA3 GLY A 38 107.249 -16.515 1.530 1.00 0.00 H new ATOM 550 N VAL A 39 107.825 -14.873 4.152 1.00 0.00 N ATOM 551 CA VAL A 39 107.656 -13.579 4.802 1.00 0.00 C ATOM 552 C VAL A 39 108.876 -12.723 4.508 1.00 0.00 C ATOM 553 O VAL A 39 110.012 -13.166 4.675 1.00 0.00 O ATOM 554 CB VAL A 39 107.500 -13.760 6.316 1.00 0.00 C ATOM 555 CG1 VAL A 39 107.240 -12.403 6.975 1.00 0.00 C ATOM 556 CG2 VAL A 39 106.321 -14.692 6.608 1.00 0.00 C ATOM 0 H VAL A 39 108.675 -15.373 4.413 1.00 0.00 H new ATOM 0 HA VAL A 39 106.758 -13.093 4.419 1.00 0.00 H new ATOM 0 HB VAL A 39 108.417 -14.193 6.717 1.00 0.00 H new ATOM 0 HG11 VAL A 39 107.130 -12.536 8.051 1.00 0.00 H new ATOM 0 HG12 VAL A 39 108.078 -11.735 6.776 1.00 0.00 H new ATOM 0 HG13 VAL A 39 106.327 -11.970 6.568 1.00 0.00 H new ATOM 0 HG21 VAL A 39 106.214 -14.817 7.686 1.00 0.00 H new ATOM 0 HG22 VAL A 39 105.407 -14.261 6.201 1.00 0.00 H new ATOM 0 HG23 VAL A 39 106.501 -15.663 6.146 1.00 0.00 H new ATOM 566 N ILE A 40 108.636 -11.493 4.070 1.00 0.00 N ATOM 567 CA ILE A 40 109.729 -10.574 3.778 1.00 0.00 C ATOM 568 C ILE A 40 109.508 -9.234 4.461 1.00 0.00 C ATOM 569 O ILE A 40 108.379 -8.751 4.553 1.00 0.00 O ATOM 570 CB ILE A 40 109.847 -10.379 2.264 1.00 0.00 C ATOM 571 CG1 ILE A 40 108.542 -9.805 1.706 1.00 0.00 C ATOM 572 CG2 ILE A 40 110.134 -11.728 1.601 1.00 0.00 C ATOM 573 CD1 ILE A 40 108.728 -9.451 0.230 1.00 0.00 C ATOM 0 H ILE A 40 107.704 -11.112 3.910 1.00 0.00 H new ATOM 0 HA ILE A 40 110.655 -11.002 4.162 1.00 0.00 H new ATOM 0 HB ILE A 40 110.660 -9.684 2.055 1.00 0.00 H new ATOM 0 HG12 ILE A 40 107.736 -10.531 1.818 1.00 0.00 H new ATOM 0 HG13 ILE A 40 108.253 -8.918 2.270 1.00 0.00 H new ATOM 0 HG21 ILE A 40 110.219 -11.593 0.523 1.00 0.00 H new ATOM 0 HG22 ILE A 40 111.068 -12.133 1.990 1.00 0.00 H new ATOM 0 HG23 ILE A 40 109.320 -12.420 1.817 1.00 0.00 H new ATOM 0 HD11 ILE A 40 107.798 -9.042 -0.166 1.00 0.00 H new ATOM 0 HD12 ILE A 40 109.521 -8.710 0.131 1.00 0.00 H new ATOM 0 HD13 ILE A 40 108.997 -10.348 -0.328 1.00 0.00 H new ATOM 585 N GLY A 41 110.605 -8.653 4.931 1.00 0.00 N ATOM 586 CA GLY A 41 110.585 -7.310 5.494 1.00 0.00 C ATOM 587 C GLY A 41 111.605 -6.462 4.754 1.00 0.00 C ATOM 588 O GLY A 41 112.746 -6.887 4.570 1.00 0.00 O ATOM 0 H GLY A 41 111.524 -9.095 4.933 1.00 0.00 H new ATOM 0 HA2 GLY A 41 109.590 -6.874 5.400 1.00 0.00 H new ATOM 0 HA3 GLY A 41 110.819 -7.342 6.558 1.00 0.00 H new ATOM 592 N SER A 42 111.189 -5.285 4.295 1.00 0.00 N ATOM 593 CA SER A 42 112.062 -4.444 3.480 1.00 0.00 C ATOM 594 C SER A 42 112.149 -3.028 4.033 1.00 0.00 C ATOM 595 O SER A 42 111.143 -2.441 4.431 1.00 0.00 O ATOM 596 CB SER A 42 111.539 -4.401 2.046 1.00 0.00 C ATOM 597 OG SER A 42 112.506 -3.773 1.217 1.00 0.00 O ATOM 0 H SER A 42 110.263 -4.895 4.471 1.00 0.00 H new ATOM 0 HA SER A 42 113.062 -4.877 3.500 1.00 0.00 H new ATOM 0 HB2 SER A 42 111.337 -5.411 1.689 1.00 0.00 H new ATOM 0 HB3 SER A 42 110.597 -3.854 2.006 1.00 0.00 H new ATOM 0 HG SER A 42 112.212 -2.863 1.003 1.00 0.00 H new ATOM 603 N PHE A 43 113.364 -2.487 4.051 1.00 0.00 N ATOM 604 CA PHE A 43 113.579 -1.109 4.477 1.00 0.00 C ATOM 605 C PHE A 43 114.122 -0.300 3.307 1.00 0.00 C ATOM 606 O PHE A 43 115.106 -0.694 2.678 1.00 0.00 O ATOM 607 CB PHE A 43 114.576 -1.068 5.637 1.00 0.00 C ATOM 608 CG PHE A 43 114.100 -1.803 6.867 1.00 0.00 C ATOM 609 CD1 PHE A 43 113.276 -1.155 7.796 1.00 0.00 C ATOM 610 CD2 PHE A 43 114.484 -3.132 7.080 1.00 0.00 C ATOM 611 CE1 PHE A 43 112.836 -1.837 8.936 1.00 0.00 C ATOM 612 CE2 PHE A 43 114.043 -3.814 8.222 1.00 0.00 C ATOM 613 CZ PHE A 43 113.220 -3.166 9.149 1.00 0.00 C ATOM 0 H PHE A 43 114.213 -2.981 3.776 1.00 0.00 H new ATOM 0 HA PHE A 43 112.632 -0.684 4.810 1.00 0.00 H new ATOM 0 HB2 PHE A 43 115.521 -1.500 5.309 1.00 0.00 H new ATOM 0 HB3 PHE A 43 114.774 -0.029 5.899 1.00 0.00 H new ATOM 0 HD1 PHE A 43 112.980 -0.129 7.633 1.00 0.00 H new ATOM 0 HD2 PHE A 43 115.120 -3.632 6.364 1.00 0.00 H new ATOM 0 HE1 PHE A 43 112.200 -1.338 9.652 1.00 0.00 H new ATOM 0 HE2 PHE A 43 114.339 -4.840 8.386 1.00 0.00 H new ATOM 0 HZ PHE A 43 112.881 -3.691 10.029 1.00 0.00 H new ATOM 623 N THR A 44 113.486 0.830 3.011 1.00 0.00 N ATOM 624 CA THR A 44 113.911 1.660 1.886 1.00 0.00 C ATOM 625 C THR A 44 114.301 3.051 2.367 1.00 0.00 C ATOM 626 O THR A 44 113.577 3.669 3.145 1.00 0.00 O ATOM 627 CB THR A 44 112.772 1.774 0.869 1.00 0.00 C ATOM 628 OG1 THR A 44 112.334 0.472 0.506 1.00 0.00 O ATOM 629 CG2 THR A 44 113.267 2.512 -0.376 1.00 0.00 C ATOM 0 H THR A 44 112.683 1.190 3.527 1.00 0.00 H new ATOM 0 HA THR A 44 114.777 1.193 1.417 1.00 0.00 H new ATOM 0 HB THR A 44 111.944 2.328 1.311 1.00 0.00 H new ATOM 0 HG1 THR A 44 113.111 -0.114 0.390 1.00 0.00 H new ATOM 0 HG21 THR A 44 112.455 2.592 -1.099 1.00 0.00 H new ATOM 0 HG22 THR A 44 113.604 3.510 -0.097 1.00 0.00 H new ATOM 0 HG23 THR A 44 114.095 1.960 -0.821 1.00 0.00 H new ATOM 637 N TYR A 45 115.448 3.529 1.895 1.00 0.00 N ATOM 638 CA TYR A 45 115.910 4.875 2.218 1.00 0.00 C ATOM 639 C TYR A 45 116.111 5.660 0.929 1.00 0.00 C ATOM 640 O TYR A 45 116.871 5.234 0.062 1.00 0.00 O ATOM 641 CB TYR A 45 117.226 4.802 2.998 1.00 0.00 C ATOM 642 CG TYR A 45 117.841 6.151 3.299 1.00 0.00 C ATOM 643 CD1 TYR A 45 117.033 7.215 3.718 1.00 0.00 C ATOM 644 CD2 TYR A 45 119.221 6.336 3.157 1.00 0.00 C ATOM 645 CE1 TYR A 45 117.605 8.463 3.996 1.00 0.00 C ATOM 646 CE2 TYR A 45 119.794 7.584 3.434 1.00 0.00 C ATOM 647 CZ TYR A 45 118.985 8.647 3.853 1.00 0.00 C ATOM 648 OH TYR A 45 119.548 9.876 4.127 1.00 0.00 O ATOM 0 H TYR A 45 116.076 3.003 1.287 1.00 0.00 H new ATOM 0 HA TYR A 45 115.165 5.377 2.835 1.00 0.00 H new ATOM 0 HB2 TYR A 45 117.051 4.277 3.937 1.00 0.00 H new ATOM 0 HB3 TYR A 45 117.941 4.208 2.429 1.00 0.00 H new ATOM 0 HD1 TYR A 45 115.968 7.073 3.827 1.00 0.00 H new ATOM 0 HD2 TYR A 45 119.845 5.516 2.834 1.00 0.00 H new ATOM 0 HE1 TYR A 45 116.981 9.283 4.321 1.00 0.00 H new ATOM 0 HE2 TYR A 45 120.859 7.726 3.324 1.00 0.00 H new ATOM 0 HH TYR A 45 120.236 10.077 3.459 1.00 0.00 H new ATOM 658 N THR A 46 115.427 6.796 0.811 1.00 0.00 N ATOM 659 CA THR A 46 115.491 7.601 -0.406 1.00 0.00 C ATOM 660 C THR A 46 115.898 9.033 -0.073 1.00 0.00 C ATOM 661 O THR A 46 115.422 9.604 0.910 1.00 0.00 O ATOM 662 CB THR A 46 114.119 7.594 -1.083 1.00 0.00 C ATOM 663 OG1 THR A 46 113.720 6.252 -1.323 1.00 0.00 O ATOM 664 CG2 THR A 46 114.177 8.355 -2.410 1.00 0.00 C ATOM 0 H THR A 46 114.825 7.178 1.540 1.00 0.00 H new ATOM 0 HA THR A 46 116.236 7.178 -1.079 1.00 0.00 H new ATOM 0 HB THR A 46 113.398 8.083 -0.428 1.00 0.00 H new ATOM 0 HG1 THR A 46 112.810 6.241 -1.685 1.00 0.00 H new ATOM 0 HG21 THR A 46 113.194 8.342 -2.880 1.00 0.00 H new ATOM 0 HG22 THR A 46 114.477 9.387 -2.225 1.00 0.00 H new ATOM 0 HG23 THR A 46 114.902 7.879 -3.071 1.00 0.00 H new ATOM 672 N GLU A 47 116.755 9.612 -0.911 1.00 0.00 N ATOM 673 CA GLU A 47 117.304 10.934 -0.637 1.00 0.00 C ATOM 674 C GLU A 47 117.762 11.585 -1.941 1.00 0.00 C ATOM 675 O GLU A 47 117.987 10.896 -2.938 1.00 0.00 O ATOM 676 CB GLU A 47 118.479 10.789 0.336 1.00 0.00 C ATOM 677 CG GLU A 47 118.918 12.160 0.875 1.00 0.00 C ATOM 678 CD GLU A 47 120.128 12.045 1.809 1.00 0.00 C ATOM 679 OE1 GLU A 47 120.633 10.948 2.007 1.00 0.00 O ATOM 680 OE2 GLU A 47 120.539 13.073 2.321 1.00 0.00 O ATOM 0 H GLU A 47 117.081 9.188 -1.780 1.00 0.00 H new ATOM 0 HA GLU A 47 116.542 11.570 -0.188 1.00 0.00 H new ATOM 0 HB2 GLU A 47 118.192 10.143 1.165 1.00 0.00 H new ATOM 0 HB3 GLU A 47 119.317 10.307 -0.168 1.00 0.00 H new ATOM 0 HG2 GLU A 47 119.164 12.816 0.040 1.00 0.00 H new ATOM 0 HG3 GLU A 47 118.089 12.622 1.410 1.00 0.00 H new ATOM 687 N LYS A 48 117.822 12.914 -1.954 1.00 0.00 N ATOM 688 CA LYS A 48 118.348 13.641 -3.104 1.00 0.00 C ATOM 689 C LYS A 48 119.215 14.807 -2.636 1.00 0.00 C ATOM 690 O LYS A 48 118.834 15.554 -1.736 1.00 0.00 O ATOM 691 CB LYS A 48 117.198 14.155 -3.975 1.00 0.00 C ATOM 692 CG LYS A 48 117.749 14.831 -5.235 1.00 0.00 C ATOM 693 CD LYS A 48 118.290 13.772 -6.198 1.00 0.00 C ATOM 694 CE LYS A 48 118.716 14.441 -7.507 1.00 0.00 C ATOM 695 NZ LYS A 48 120.064 15.051 -7.337 1.00 0.00 N ATOM 0 H LYS A 48 117.514 13.507 -1.184 1.00 0.00 H new ATOM 0 HA LYS A 48 118.961 12.963 -3.698 1.00 0.00 H new ATOM 0 HB2 LYS A 48 116.545 13.328 -4.253 1.00 0.00 H new ATOM 0 HB3 LYS A 48 116.592 14.863 -3.409 1.00 0.00 H new ATOM 0 HG2 LYS A 48 116.964 15.410 -5.721 1.00 0.00 H new ATOM 0 HG3 LYS A 48 118.541 15.530 -4.967 1.00 0.00 H new ATOM 0 HD2 LYS A 48 119.138 13.256 -5.748 1.00 0.00 H new ATOM 0 HD3 LYS A 48 117.526 13.019 -6.394 1.00 0.00 H new ATOM 0 HE2 LYS A 48 118.736 13.707 -8.313 1.00 0.00 H new ATOM 0 HE3 LYS A 48 117.992 15.205 -7.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 120.275 15.660 -8.153 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 120.080 15.620 -6.467 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 120.780 14.299 -7.272 1.00 0.00 H new ATOM 709 N SER A 49 120.384 14.955 -3.255 1.00 0.00 N ATOM 710 CA SER A 49 121.313 16.020 -2.886 1.00 0.00 C ATOM 711 C SER A 49 121.397 17.066 -3.994 1.00 0.00 C ATOM 712 O SER A 49 121.334 16.737 -5.178 1.00 0.00 O ATOM 713 CB SER A 49 122.702 15.431 -2.636 1.00 0.00 C ATOM 714 OG SER A 49 123.567 16.457 -2.168 1.00 0.00 O ATOM 0 H SER A 49 120.710 14.353 -4.012 1.00 0.00 H new ATOM 0 HA SER A 49 120.948 16.498 -1.977 1.00 0.00 H new ATOM 0 HB2 SER A 49 122.642 14.626 -1.903 1.00 0.00 H new ATOM 0 HB3 SER A 49 123.097 14.997 -3.555 1.00 0.00 H new ATOM 0 HG SER A 49 124.458 16.084 -2.005 1.00 0.00 H new ATOM 720 N ARG A 50 121.541 18.329 -3.599 1.00 0.00 N ATOM 721 CA ARG A 50 121.625 19.427 -4.558 1.00 0.00 C ATOM 722 C ARG A 50 122.926 20.201 -4.370 1.00 0.00 C ATOM 723 O ARG A 50 123.450 20.292 -3.260 1.00 0.00 O ATOM 724 CB ARG A 50 120.437 20.372 -4.367 1.00 0.00 C ATOM 725 CG ARG A 50 119.139 19.631 -4.695 1.00 0.00 C ATOM 726 CD ARG A 50 117.958 20.601 -4.625 1.00 0.00 C ATOM 727 NE ARG A 50 117.890 21.226 -3.301 1.00 0.00 N ATOM 728 CZ ARG A 50 116.884 22.023 -2.909 1.00 0.00 C ATOM 729 NH1 ARG A 50 115.872 22.309 -3.694 1.00 0.00 N ATOM 730 NH2 ARG A 50 116.914 22.533 -1.708 1.00 0.00 N ATOM 0 H ARG A 50 121.602 18.617 -2.622 1.00 0.00 H new ATOM 0 HA ARG A 50 121.604 19.012 -5.565 1.00 0.00 H new ATOM 0 HB2 ARG A 50 120.410 20.737 -3.340 1.00 0.00 H new ATOM 0 HB3 ARG A 50 120.544 21.244 -5.013 1.00 0.00 H new ATOM 0 HG2 ARG A 50 119.202 19.191 -5.690 1.00 0.00 H new ATOM 0 HG3 ARG A 50 118.990 18.811 -3.993 1.00 0.00 H new ATOM 0 HD2 ARG A 50 118.063 21.368 -5.392 1.00 0.00 H new ATOM 0 HD3 ARG A 50 117.029 20.069 -4.832 1.00 0.00 H new ATOM 0 HE ARG A 50 118.648 21.046 -2.642 1.00 0.00 H new ATOM 0 HH11 ARG A 50 115.832 21.921 -4.637 1.00 0.00 H new ATOM 0 HH12 ARG A 50 115.125 22.919 -3.361 1.00 0.00 H new ATOM 0 HH21 ARG A 50 117.694 22.324 -1.084 1.00 0.00 H new ATOM 0 HH22 ARG A 50 116.158 23.141 -1.393 1.00 0.00 H new ATOM 744 N THR A 51 123.443 20.756 -5.462 1.00 0.00 N ATOM 745 CA THR A 51 124.689 21.514 -5.405 1.00 0.00 C ATOM 746 C THR A 51 124.438 22.922 -4.876 1.00 0.00 C ATOM 747 O THR A 51 123.374 23.499 -5.098 1.00 0.00 O ATOM 748 CB THR A 51 125.321 21.596 -6.796 1.00 0.00 C ATOM 749 OG1 THR A 51 124.453 22.306 -7.668 1.00 0.00 O ATOM 750 CG2 THR A 51 125.559 20.188 -7.344 1.00 0.00 C ATOM 0 H THR A 51 123.023 20.696 -6.390 1.00 0.00 H new ATOM 0 HA THR A 51 125.370 20.999 -4.728 1.00 0.00 H new ATOM 0 HB THR A 51 126.276 22.117 -6.727 1.00 0.00 H new ATOM 0 HG1 THR A 51 124.857 22.361 -8.559 1.00 0.00 H new ATOM 0 HG21 THR A 51 126.009 20.254 -8.335 1.00 0.00 H new ATOM 0 HG22 THR A 51 126.229 19.646 -6.676 1.00 0.00 H new ATOM 0 HG23 THR A 51 124.609 19.659 -7.412 1.00 0.00 H new ATOM 758 N ALA A 52 125.426 23.468 -4.174 1.00 0.00 N ATOM 759 CA ALA A 52 125.303 24.808 -3.610 1.00 0.00 C ATOM 760 C ALA A 52 125.417 25.867 -4.702 1.00 0.00 C ATOM 761 O ALA A 52 126.183 25.715 -5.653 1.00 0.00 O ATOM 762 CB ALA A 52 126.393 25.034 -2.561 1.00 0.00 C ATOM 0 H ALA A 52 126.315 23.007 -3.983 1.00 0.00 H new ATOM 0 HA ALA A 52 124.323 24.894 -3.141 1.00 0.00 H new ATOM 0 HB1 ALA A 52 126.295 26.036 -2.144 1.00 0.00 H new ATOM 0 HB2 ALA A 52 126.289 24.298 -1.764 1.00 0.00 H new ATOM 0 HB3 ALA A 52 127.373 24.929 -3.026 1.00 0.00 H new ATOM 768 N SER A 53 124.649 26.942 -4.554 1.00 0.00 N ATOM 769 CA SER A 53 124.684 28.038 -5.516 1.00 0.00 C ATOM 770 C SER A 53 123.828 29.200 -5.024 1.00 0.00 C ATOM 771 O SER A 53 124.344 30.270 -4.698 1.00 0.00 O ATOM 772 CB SER A 53 124.168 27.559 -6.873 1.00 0.00 C ATOM 773 OG SER A 53 122.921 26.901 -6.694 1.00 0.00 O ATOM 0 H SER A 53 123.998 27.077 -3.781 1.00 0.00 H new ATOM 0 HA SER A 53 125.715 28.376 -5.622 1.00 0.00 H new ATOM 0 HB2 SER A 53 124.052 28.405 -7.551 1.00 0.00 H new ATOM 0 HB3 SER A 53 124.888 26.881 -7.330 1.00 0.00 H new ATOM 0 HG SER A 53 122.586 26.594 -7.562 1.00 0.00 H new ATOM 779 N SER A 54 122.520 28.981 -4.970 1.00 0.00 N ATOM 780 CA SER A 54 121.600 29.996 -4.464 1.00 0.00 C ATOM 781 C SER A 54 121.940 30.394 -3.025 1.00 0.00 C ATOM 782 O SER A 54 121.748 31.544 -2.633 1.00 0.00 O ATOM 783 CB SER A 54 120.165 29.470 -4.519 1.00 0.00 C ATOM 784 OG SER A 54 119.870 29.055 -5.846 1.00 0.00 O ATOM 0 H SER A 54 122.072 28.114 -5.268 1.00 0.00 H new ATOM 0 HA SER A 54 121.698 30.879 -5.096 1.00 0.00 H new ATOM 0 HB2 SER A 54 120.044 28.635 -3.829 1.00 0.00 H new ATOM 0 HB3 SER A 54 119.468 30.247 -4.205 1.00 0.00 H new ATOM 0 HG SER A 54 118.952 28.715 -5.886 1.00 0.00 H new ATOM 790 N GLY A 55 122.443 29.440 -2.244 1.00 0.00 N ATOM 791 CA GLY A 55 122.765 29.691 -0.840 1.00 0.00 C ATOM 792 C GLY A 55 121.723 29.116 0.132 1.00 0.00 C ATOM 793 O GLY A 55 121.936 29.141 1.344 1.00 0.00 O ATOM 0 H GLY A 55 122.636 28.489 -2.558 1.00 0.00 H new ATOM 0 HA2 GLY A 55 123.740 29.259 -0.615 1.00 0.00 H new ATOM 0 HA3 GLY A 55 122.848 30.766 -0.679 1.00 0.00 H new ATOM 797 N ASP A 56 120.605 28.601 -0.382 1.00 0.00 N ATOM 798 CA ASP A 56 119.617 27.942 0.463 1.00 0.00 C ATOM 799 C ASP A 56 119.881 26.442 0.494 1.00 0.00 C ATOM 800 O ASP A 56 119.759 25.763 -0.526 1.00 0.00 O ATOM 801 CB ASP A 56 118.207 28.207 -0.072 1.00 0.00 C ATOM 802 CG ASP A 56 117.169 27.620 0.879 1.00 0.00 C ATOM 803 OD1 ASP A 56 116.811 26.469 0.695 1.00 0.00 O ATOM 804 OD2 ASP A 56 116.750 28.331 1.778 1.00 0.00 O ATOM 0 H ASP A 56 120.365 28.629 -1.373 1.00 0.00 H new ATOM 0 HA ASP A 56 119.695 28.342 1.474 1.00 0.00 H new ATOM 0 HB2 ASP A 56 118.046 29.280 -0.182 1.00 0.00 H new ATOM 0 HB3 ASP A 56 118.096 27.765 -1.062 1.00 0.00 H new ATOM 809 N TYR A 57 120.242 25.923 1.664 1.00 0.00 N ATOM 810 CA TYR A 57 120.569 24.505 1.795 1.00 0.00 C ATOM 811 C TYR A 57 119.562 23.798 2.697 1.00 0.00 C ATOM 812 O TYR A 57 119.408 24.145 3.867 1.00 0.00 O ATOM 813 CB TYR A 57 121.973 24.356 2.384 1.00 0.00 C ATOM 814 CG TYR A 57 122.472 22.931 2.401 1.00 0.00 C ATOM 815 CD1 TYR A 57 123.082 22.390 1.262 1.00 0.00 C ATOM 816 CD2 TYR A 57 122.326 22.151 3.554 1.00 0.00 C ATOM 817 CE1 TYR A 57 123.547 21.069 1.277 1.00 0.00 C ATOM 818 CE2 TYR A 57 122.792 20.831 3.569 1.00 0.00 C ATOM 819 CZ TYR A 57 123.402 20.290 2.431 1.00 0.00 C ATOM 820 OH TYR A 57 123.860 18.988 2.447 1.00 0.00 O ATOM 0 H TYR A 57 120.315 26.458 2.530 1.00 0.00 H new ATOM 0 HA TYR A 57 120.531 24.048 0.806 1.00 0.00 H new ATOM 0 HB2 TYR A 57 122.667 24.968 1.808 1.00 0.00 H new ATOM 0 HB3 TYR A 57 121.974 24.745 3.402 1.00 0.00 H new ATOM 0 HD1 TYR A 57 123.194 22.992 0.372 1.00 0.00 H new ATOM 0 HD2 TYR A 57 121.854 22.567 4.432 1.00 0.00 H new ATOM 0 HE1 TYR A 57 124.017 20.652 0.399 1.00 0.00 H new ATOM 0 HE2 TYR A 57 122.681 20.230 4.459 1.00 0.00 H new ATOM 0 HH TYR A 57 124.415 18.846 3.242 1.00 0.00 H new ATOM 830 N ASN A 58 118.881 22.803 2.139 1.00 0.00 N ATOM 831 CA ASN A 58 117.917 22.018 2.901 1.00 0.00 C ATOM 832 C ASN A 58 118.039 20.541 2.542 1.00 0.00 C ATOM 833 O ASN A 58 118.534 20.196 1.469 1.00 0.00 O ATOM 834 CB ASN A 58 116.496 22.502 2.608 1.00 0.00 C ATOM 835 CG ASN A 58 116.341 23.959 3.031 1.00 0.00 C ATOM 836 OD1 ASN A 58 116.911 24.378 4.037 1.00 0.00 O ATOM 837 ND2 ASN A 58 115.600 24.760 2.316 1.00 0.00 N ATOM 0 H ASN A 58 118.978 22.521 1.164 1.00 0.00 H new ATOM 0 HA ASN A 58 118.127 22.145 3.963 1.00 0.00 H new ATOM 0 HB2 ASN A 58 116.280 22.399 1.544 1.00 0.00 H new ATOM 0 HB3 ASN A 58 115.775 21.882 3.141 1.00 0.00 H new ATOM 0 HD21 ASN A 58 115.492 25.736 2.591 1.00 0.00 H new ATOM 0 HD22 ASN A 58 115.128 24.410 1.482 1.00 0.00 H new ATOM 844 N LYS A 59 117.587 19.670 3.442 1.00 0.00 N ATOM 845 CA LYS A 59 117.647 18.230 3.203 1.00 0.00 C ATOM 846 C LYS A 59 116.251 17.616 3.244 1.00 0.00 C ATOM 847 O LYS A 59 115.497 17.823 4.195 1.00 0.00 O ATOM 848 CB LYS A 59 118.517 17.558 4.266 1.00 0.00 C ATOM 849 CG LYS A 59 119.958 18.063 4.152 1.00 0.00 C ATOM 850 CD LYS A 59 120.841 17.305 5.145 1.00 0.00 C ATOM 851 CE LYS A 59 122.255 17.889 5.123 1.00 0.00 C ATOM 852 NZ LYS A 59 123.213 16.895 5.682 1.00 0.00 N ATOM 0 H LYS A 59 117.178 19.934 4.338 1.00 0.00 H new ATOM 0 HA LYS A 59 118.079 18.070 2.215 1.00 0.00 H new ATOM 0 HB2 LYS A 59 118.124 17.773 5.260 1.00 0.00 H new ATOM 0 HB3 LYS A 59 118.490 16.476 4.140 1.00 0.00 H new ATOM 0 HG2 LYS A 59 120.327 17.918 3.136 1.00 0.00 H new ATOM 0 HG3 LYS A 59 119.997 19.133 4.356 1.00 0.00 H new ATOM 0 HD2 LYS A 59 120.422 17.377 6.149 1.00 0.00 H new ATOM 0 HD3 LYS A 59 120.870 16.246 4.887 1.00 0.00 H new ATOM 0 HE2 LYS A 59 122.537 18.147 4.102 1.00 0.00 H new ATOM 0 HE3 LYS A 59 122.289 18.810 5.706 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 124.174 17.292 5.667 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 122.947 16.670 6.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 123.188 16.028 5.108 1.00 0.00 H new ATOM 866 N ASN A 60 115.915 16.858 2.203 1.00 0.00 N ATOM 867 CA ASN A 60 114.644 16.143 2.154 1.00 0.00 C ATOM 868 C ASN A 60 114.895 14.646 2.017 1.00 0.00 C ATOM 869 O ASN A 60 115.558 14.208 1.075 1.00 0.00 O ATOM 870 CB ASN A 60 113.817 16.627 0.961 1.00 0.00 C ATOM 871 CG ASN A 60 112.444 15.961 0.972 1.00 0.00 C ATOM 872 OD1 ASN A 60 111.955 15.556 2.027 1.00 0.00 O ATOM 873 ND2 ASN A 60 111.790 15.821 -0.148 1.00 0.00 N ATOM 0 H ASN A 60 116.506 16.724 1.382 1.00 0.00 H new ATOM 0 HA ASN A 60 114.097 16.337 3.077 1.00 0.00 H new ATOM 0 HB2 ASN A 60 113.705 17.710 1.002 1.00 0.00 H new ATOM 0 HB3 ASN A 60 114.335 16.395 0.031 1.00 0.00 H new ATOM 0 HD21 ASN A 60 110.872 15.376 -0.151 1.00 0.00 H new ATOM 0 HD22 ASN A 60 112.196 16.157 -1.021 1.00 0.00 H new ATOM 880 N GLN A 61 114.367 13.865 2.956 1.00 0.00 N ATOM 881 CA GLN A 61 114.559 12.417 2.910 1.00 0.00 C ATOM 882 C GLN A 61 113.369 11.688 3.524 1.00 0.00 C ATOM 883 O GLN A 61 112.624 12.272 4.308 1.00 0.00 O ATOM 884 CB GLN A 61 115.863 12.041 3.627 1.00 0.00 C ATOM 885 CG GLN A 61 115.774 12.365 5.122 1.00 0.00 C ATOM 886 CD GLN A 61 117.156 12.264 5.759 1.00 0.00 C ATOM 887 OE1 GLN A 61 118.144 12.704 5.174 1.00 0.00 O ATOM 888 NE2 GLN A 61 117.284 11.706 6.933 1.00 0.00 N ATOM 0 H GLN A 61 113.813 14.201 3.744 1.00 0.00 H new ATOM 0 HA GLN A 61 114.631 12.107 1.867 1.00 0.00 H new ATOM 0 HB2 GLN A 61 116.064 10.978 3.492 1.00 0.00 H new ATOM 0 HB3 GLN A 61 116.698 12.583 3.182 1.00 0.00 H new ATOM 0 HG2 GLN A 61 115.372 13.368 5.262 1.00 0.00 H new ATOM 0 HG3 GLN A 61 115.087 11.675 5.612 1.00 0.00 H new ATOM 0 HE21 GLN A 61 116.463 11.342 7.417 1.00 0.00 H new ATOM 0 HE22 GLN A 61 118.205 11.635 7.366 1.00 0.00 H new ATOM 897 N TYR A 62 113.195 10.418 3.163 1.00 0.00 N ATOM 898 CA TYR A 62 112.112 9.629 3.738 1.00 0.00 C ATOM 899 C TYR A 62 112.477 8.150 3.827 1.00 0.00 C ATOM 900 O TYR A 62 113.325 7.657 3.085 1.00 0.00 O ATOM 901 CB TYR A 62 110.822 9.818 2.933 1.00 0.00 C ATOM 902 CG TYR A 62 110.856 9.263 1.529 1.00 0.00 C ATOM 903 CD1 TYR A 62 111.285 10.069 0.467 1.00 0.00 C ATOM 904 CD2 TYR A 62 110.435 7.949 1.285 1.00 0.00 C ATOM 905 CE1 TYR A 62 111.292 9.562 -0.838 1.00 0.00 C ATOM 906 CE2 TYR A 62 110.447 7.442 -0.019 1.00 0.00 C ATOM 907 CZ TYR A 62 110.873 8.248 -1.081 1.00 0.00 C ATOM 908 OH TYR A 62 110.880 7.748 -2.368 1.00 0.00 O ATOM 0 H TYR A 62 113.778 9.923 2.488 1.00 0.00 H new ATOM 0 HA TYR A 62 111.947 9.988 4.754 1.00 0.00 H new ATOM 0 HB2 TYR A 62 110.002 9.346 3.474 1.00 0.00 H new ATOM 0 HB3 TYR A 62 110.598 10.883 2.881 1.00 0.00 H new ATOM 0 HD1 TYR A 62 111.610 11.082 0.655 1.00 0.00 H new ATOM 0 HD2 TYR A 62 110.101 7.328 2.103 1.00 0.00 H new ATOM 0 HE1 TYR A 62 111.621 10.184 -1.657 1.00 0.00 H new ATOM 0 HE2 TYR A 62 110.127 6.428 -0.206 1.00 0.00 H new ATOM 0 HH TYR A 62 110.561 6.821 -2.361 1.00 0.00 H new ATOM 918 N TYR A 63 111.819 7.460 4.755 1.00 0.00 N ATOM 919 CA TYR A 63 112.064 6.040 4.984 1.00 0.00 C ATOM 920 C TYR A 63 110.744 5.285 4.905 1.00 0.00 C ATOM 921 O TYR A 63 109.718 5.802 5.341 1.00 0.00 O ATOM 922 CB TYR A 63 112.677 5.830 6.370 1.00 0.00 C ATOM 923 CG TYR A 63 113.940 6.621 6.610 1.00 0.00 C ATOM 924 CD1 TYR A 63 113.863 7.979 6.943 1.00 0.00 C ATOM 925 CD2 TYR A 63 115.188 5.994 6.513 1.00 0.00 C ATOM 926 CE1 TYR A 63 115.033 8.710 7.177 1.00 0.00 C ATOM 927 CE2 TYR A 63 116.358 6.727 6.747 1.00 0.00 C ATOM 928 CZ TYR A 63 116.280 8.085 7.078 1.00 0.00 C ATOM 929 OH TYR A 63 117.434 8.806 7.309 1.00 0.00 O ATOM 0 H TYR A 63 111.108 7.865 5.364 1.00 0.00 H new ATOM 0 HA TYR A 63 112.754 5.670 4.226 1.00 0.00 H new ATOM 0 HB2 TYR A 63 111.941 6.102 7.126 1.00 0.00 H new ATOM 0 HB3 TYR A 63 112.894 4.770 6.503 1.00 0.00 H new ATOM 0 HD1 TYR A 63 112.900 8.462 7.019 1.00 0.00 H new ATOM 0 HD2 TYR A 63 115.248 4.946 6.258 1.00 0.00 H new ATOM 0 HE1 TYR A 63 114.973 9.757 7.434 1.00 0.00 H new ATOM 0 HE2 TYR A 63 117.321 6.244 6.672 1.00 0.00 H new ATOM 0 HH TYR A 63 117.895 8.967 6.459 1.00 0.00 H new ATOM 939 N GLY A 64 110.765 4.070 4.362 1.00 0.00 N ATOM 940 CA GLY A 64 109.537 3.287 4.219 1.00 0.00 C ATOM 941 C GLY A 64 109.708 1.886 4.791 1.00 0.00 C ATOM 942 O GLY A 64 110.727 1.235 4.558 1.00 0.00 O ATOM 0 H GLY A 64 111.607 3.609 4.017 1.00 0.00 H new ATOM 0 HA2 GLY A 64 108.718 3.794 4.729 1.00 0.00 H new ATOM 0 HA3 GLY A 64 109.265 3.222 3.166 1.00 0.00 H new ATOM 946 N ILE A 65 108.707 1.435 5.547 1.00 0.00 N ATOM 947 CA ILE A 65 108.723 0.092 6.121 1.00 0.00 C ATOM 948 C ILE A 65 107.572 -0.715 5.533 1.00 0.00 C ATOM 949 O ILE A 65 106.425 -0.274 5.574 1.00 0.00 O ATOM 950 CB ILE A 65 108.584 0.165 7.647 1.00 0.00 C ATOM 951 CG1 ILE A 65 109.705 1.035 8.225 1.00 0.00 C ATOM 952 CG2 ILE A 65 108.685 -1.242 8.243 1.00 0.00 C ATOM 953 CD1 ILE A 65 109.472 1.244 9.723 1.00 0.00 C ATOM 0 H ILE A 65 107.876 1.980 5.775 1.00 0.00 H new ATOM 0 HA ILE A 65 109.670 -0.392 5.882 1.00 0.00 H new ATOM 0 HB ILE A 65 107.616 0.599 7.896 1.00 0.00 H new ATOM 0 HG12 ILE A 65 110.671 0.558 8.060 1.00 0.00 H new ATOM 0 HG13 ILE A 65 109.733 1.997 7.713 1.00 0.00 H new ATOM 0 HG21 ILE A 65 108.586 -1.186 9.327 1.00 0.00 H new ATOM 0 HG22 ILE A 65 107.889 -1.867 7.838 1.00 0.00 H new ATOM 0 HG23 ILE A 65 109.652 -1.676 7.989 1.00 0.00 H new ATOM 0 HD11 ILE A 65 110.270 1.863 10.133 1.00 0.00 H new ATOM 0 HD12 ILE A 65 108.513 1.740 9.876 1.00 0.00 H new ATOM 0 HD13 ILE A 65 109.466 0.278 10.229 1.00 0.00 H new ATOM 965 N THR A 66 107.883 -1.880 4.970 1.00 0.00 N ATOM 966 CA THR A 66 106.860 -2.709 4.340 1.00 0.00 C ATOM 967 C THR A 66 107.078 -4.193 4.636 1.00 0.00 C ATOM 968 O THR A 66 108.175 -4.612 5.002 1.00 0.00 O ATOM 969 CB THR A 66 106.853 -2.455 2.828 1.00 0.00 C ATOM 970 OG1 THR A 66 105.784 -3.173 2.231 1.00 0.00 O ATOM 971 CG2 THR A 66 108.181 -2.893 2.204 1.00 0.00 C ATOM 0 H THR A 66 108.826 -2.268 4.937 1.00 0.00 H new ATOM 0 HA THR A 66 105.891 -2.435 4.757 1.00 0.00 H new ATOM 0 HB THR A 66 106.721 -1.388 2.652 1.00 0.00 H new ATOM 0 HG1 THR A 66 105.151 -3.454 2.924 1.00 0.00 H new ATOM 0 HG21 THR A 66 108.158 -2.705 1.131 1.00 0.00 H new ATOM 0 HG22 THR A 66 108.998 -2.329 2.654 1.00 0.00 H new ATOM 0 HG23 THR A 66 108.334 -3.957 2.383 1.00 0.00 H new ATOM 979 N ALA A 67 106.015 -4.976 4.474 1.00 0.00 N ATOM 980 CA ALA A 67 106.089 -6.420 4.668 1.00 0.00 C ATOM 981 C ALA A 67 105.155 -7.111 3.681 1.00 0.00 C ATOM 982 O ALA A 67 104.193 -6.496 3.217 1.00 0.00 O ATOM 983 CB ALA A 67 105.690 -6.782 6.100 1.00 0.00 C ATOM 0 H ALA A 67 105.091 -4.634 4.209 1.00 0.00 H new ATOM 0 HA ALA A 67 107.113 -6.752 4.496 1.00 0.00 H new ATOM 0 HB1 ALA A 67 105.749 -7.862 6.232 1.00 0.00 H new ATOM 0 HB2 ALA A 67 106.367 -6.293 6.801 1.00 0.00 H new ATOM 0 HB3 ALA A 67 104.669 -6.449 6.289 1.00 0.00 H new ATOM 989 N GLY A 68 105.447 -8.369 3.341 1.00 0.00 N ATOM 990 CA GLY A 68 104.627 -9.071 2.357 1.00 0.00 C ATOM 991 C GLY A 68 104.651 -10.598 2.538 1.00 0.00 C ATOM 992 O GLY A 68 105.702 -11.148 2.869 1.00 0.00 O ATOM 0 H GLY A 68 106.224 -8.909 3.722 1.00 0.00 H new ATOM 0 HA2 GLY A 68 103.598 -8.718 2.430 1.00 0.00 H new ATOM 0 HA3 GLY A 68 104.979 -8.823 1.355 1.00 0.00 H new ATOM 996 N PRO A 69 103.539 -11.295 2.373 1.00 0.00 N ATOM 997 CA PRO A 69 103.559 -12.788 2.253 1.00 0.00 C ATOM 998 C PRO A 69 104.056 -13.236 0.876 1.00 0.00 C ATOM 999 O PRO A 69 104.050 -12.437 -0.064 1.00 0.00 O ATOM 1000 CB PRO A 69 102.104 -13.205 2.467 1.00 0.00 C ATOM 1001 CG PRO A 69 101.299 -12.035 2.024 1.00 0.00 C ATOM 1002 CD PRO A 69 102.150 -10.795 2.297 1.00 0.00 C ATOM 0 HA PRO A 69 104.238 -13.245 2.973 1.00 0.00 H new ATOM 0 HB2 PRO A 69 101.859 -14.095 1.887 1.00 0.00 H new ATOM 0 HB3 PRO A 69 101.911 -13.443 3.513 1.00 0.00 H new ATOM 0 HG2 PRO A 69 101.053 -12.112 0.965 1.00 0.00 H new ATOM 0 HG3 PRO A 69 100.355 -11.985 2.567 1.00 0.00 H new ATOM 0 HD2 PRO A 69 102.039 -10.057 1.503 1.00 0.00 H new ATOM 0 HD3 PRO A 69 101.854 -10.309 3.227 1.00 0.00 H new ATOM 1010 N ALA A 70 104.452 -14.508 0.742 1.00 0.00 N ATOM 1011 CA ALA A 70 104.904 -15.010 -0.556 1.00 0.00 C ATOM 1012 C ALA A 70 104.473 -16.461 -0.767 1.00 0.00 C ATOM 1013 O ALA A 70 104.292 -17.213 0.191 1.00 0.00 O ATOM 1014 CB ALA A 70 106.427 -14.894 -0.665 1.00 0.00 C ATOM 0 H ALA A 70 104.468 -15.192 1.498 1.00 0.00 H new ATOM 0 HA ALA A 70 104.441 -14.402 -1.333 1.00 0.00 H new ATOM 0 HB1 ALA A 70 106.752 -15.270 -1.635 1.00 0.00 H new ATOM 0 HB2 ALA A 70 106.720 -13.849 -0.564 1.00 0.00 H new ATOM 0 HB3 ALA A 70 106.894 -15.480 0.127 1.00 0.00 H new ATOM 1020 N TYR A 71 104.311 -16.842 -2.032 1.00 0.00 N ATOM 1021 CA TYR A 71 103.898 -18.197 -2.384 1.00 0.00 C ATOM 1022 C TYR A 71 104.946 -18.832 -3.292 1.00 0.00 C ATOM 1023 O TYR A 71 105.360 -18.222 -4.277 1.00 0.00 O ATOM 1024 CB TYR A 71 102.545 -18.159 -3.096 1.00 0.00 C ATOM 1025 CG TYR A 71 101.954 -19.527 -3.346 1.00 0.00 C ATOM 1026 CD1 TYR A 71 101.236 -20.174 -2.332 1.00 0.00 C ATOM 1027 CD2 TYR A 71 102.120 -20.146 -4.590 1.00 0.00 C ATOM 1028 CE1 TYR A 71 100.684 -21.439 -2.563 1.00 0.00 C ATOM 1029 CE2 TYR A 71 101.568 -21.412 -4.820 1.00 0.00 C ATOM 1030 CZ TYR A 71 100.851 -22.059 -3.807 1.00 0.00 C ATOM 1031 OH TYR A 71 100.307 -23.307 -4.036 1.00 0.00 O ATOM 0 H TYR A 71 104.460 -16.228 -2.833 1.00 0.00 H new ATOM 0 HA TYR A 71 103.803 -18.792 -1.476 1.00 0.00 H new ATOM 0 HB2 TYR A 71 101.846 -17.574 -2.498 1.00 0.00 H new ATOM 0 HB3 TYR A 71 102.660 -17.642 -4.049 1.00 0.00 H new ATOM 0 HD1 TYR A 71 101.108 -19.696 -1.372 1.00 0.00 H new ATOM 0 HD2 TYR A 71 102.673 -19.648 -5.372 1.00 0.00 H new ATOM 0 HE1 TYR A 71 100.129 -21.937 -1.782 1.00 0.00 H new ATOM 0 HE2 TYR A 71 101.696 -21.890 -5.780 1.00 0.00 H new ATOM 0 HH TYR A 71 100.515 -23.592 -4.950 1.00 0.00 H new ATOM 1041 N ARG A 72 105.377 -20.045 -2.955 1.00 0.00 N ATOM 1042 CA ARG A 72 106.432 -20.713 -3.714 1.00 0.00 C ATOM 1043 C ARG A 72 105.882 -21.921 -4.467 1.00 0.00 C ATOM 1044 O ARG A 72 105.092 -22.697 -3.927 1.00 0.00 O ATOM 1045 CB ARG A 72 107.533 -21.179 -2.760 1.00 0.00 C ATOM 1046 CG ARG A 72 108.138 -19.970 -2.043 1.00 0.00 C ATOM 1047 CD ARG A 72 109.295 -20.432 -1.157 1.00 0.00 C ATOM 1048 NE ARG A 72 109.741 -19.333 -0.293 1.00 0.00 N ATOM 1049 CZ ARG A 72 110.982 -19.244 0.210 1.00 0.00 C ATOM 1050 NH1 ARG A 72 111.908 -20.137 -0.048 1.00 0.00 N ATOM 1051 NH2 ARG A 72 111.278 -18.234 0.980 1.00 0.00 N ATOM 0 H ARG A 72 105.015 -20.583 -2.167 1.00 0.00 H new ATOM 0 HA ARG A 72 106.835 -20.003 -4.436 1.00 0.00 H new ATOM 0 HB2 ARG A 72 107.124 -21.879 -2.032 1.00 0.00 H new ATOM 0 HB3 ARG A 72 108.307 -21.711 -3.314 1.00 0.00 H new ATOM 0 HG2 ARG A 72 108.492 -19.241 -2.772 1.00 0.00 H new ATOM 0 HG3 ARG A 72 107.378 -19.474 -1.439 1.00 0.00 H new ATOM 0 HD2 ARG A 72 108.980 -21.279 -0.547 1.00 0.00 H new ATOM 0 HD3 ARG A 72 110.123 -20.776 -1.777 1.00 0.00 H new ATOM 0 HE ARG A 72 109.072 -18.598 -0.063 1.00 0.00 H new ATOM 0 HH11 ARG A 72 111.695 -20.933 -0.649 1.00 0.00 H new ATOM 0 HH12 ARG A 72 112.840 -20.035 0.353 1.00 0.00 H new ATOM 0 HH21 ARG A 72 110.572 -17.529 1.191 1.00 0.00 H new ATOM 0 HH22 ARG A 72 112.216 -18.149 1.372 1.00 0.00 H new ATOM 1065 N ILE A 73 106.307 -22.073 -5.719 1.00 0.00 N ATOM 1066 CA ILE A 73 105.906 -23.217 -6.536 1.00 0.00 C ATOM 1067 C ILE A 73 107.145 -23.971 -7.013 1.00 0.00 C ATOM 1068 O ILE A 73 108.148 -23.360 -7.383 1.00 0.00 O ATOM 1069 CB ILE A 73 105.076 -22.758 -7.743 1.00 0.00 C ATOM 1070 CG1 ILE A 73 103.882 -21.914 -7.268 1.00 0.00 C ATOM 1071 CG2 ILE A 73 104.560 -23.987 -8.497 1.00 0.00 C ATOM 1072 CD1 ILE A 73 104.294 -20.444 -7.160 1.00 0.00 C ATOM 0 H ILE A 73 106.930 -21.418 -6.191 1.00 0.00 H new ATOM 0 HA ILE A 73 105.291 -23.880 -5.927 1.00 0.00 H new ATOM 0 HB ILE A 73 105.701 -22.155 -8.401 1.00 0.00 H new ATOM 0 HG12 ILE A 73 103.051 -22.018 -7.966 1.00 0.00 H new ATOM 0 HG13 ILE A 73 103.532 -22.275 -6.301 1.00 0.00 H new ATOM 0 HG21 ILE A 73 103.970 -23.666 -9.355 1.00 0.00 H new ATOM 0 HG22 ILE A 73 105.405 -24.584 -8.840 1.00 0.00 H new ATOM 0 HG23 ILE A 73 103.938 -24.587 -7.833 1.00 0.00 H new ATOM 0 HD11 ILE A 73 103.443 -19.852 -6.823 1.00 0.00 H new ATOM 0 HD12 ILE A 73 105.110 -20.347 -6.444 1.00 0.00 H new ATOM 0 HD13 ILE A 73 104.622 -20.085 -8.136 1.00 0.00 H new ATOM 1084 N ASN A 74 107.072 -25.297 -6.997 1.00 0.00 N ATOM 1085 CA ASN A 74 108.223 -26.121 -7.355 1.00 0.00 C ATOM 1086 C ASN A 74 108.693 -25.852 -8.783 1.00 0.00 C ATOM 1087 O ASN A 74 109.892 -25.730 -9.032 1.00 0.00 O ATOM 1088 CB ASN A 74 107.865 -27.601 -7.211 1.00 0.00 C ATOM 1089 CG ASN A 74 107.504 -27.913 -5.762 1.00 0.00 C ATOM 1090 OD1 ASN A 74 106.493 -28.564 -5.500 1.00 0.00 O ATOM 1091 ND2 ASN A 74 108.276 -27.484 -4.800 1.00 0.00 N ATOM 0 H ASN A 74 106.236 -25.822 -6.742 1.00 0.00 H new ATOM 0 HA ASN A 74 109.036 -25.862 -6.677 1.00 0.00 H new ATOM 0 HB2 ASN A 74 107.027 -27.846 -7.864 1.00 0.00 H new ATOM 0 HB3 ASN A 74 108.706 -28.219 -7.526 1.00 0.00 H new ATOM 0 HD21 ASN A 74 108.042 -27.688 -3.829 1.00 0.00 H new ATOM 0 HD22 ASN A 74 109.113 -26.945 -5.020 1.00 0.00 H new ATOM 1098 N ASP A 75 107.751 -25.760 -9.720 1.00 0.00 N ATOM 1099 CA ASP A 75 108.108 -25.565 -11.124 1.00 0.00 C ATOM 1100 C ASP A 75 108.122 -24.086 -11.514 1.00 0.00 C ATOM 1101 O ASP A 75 108.893 -23.678 -12.385 1.00 0.00 O ATOM 1102 CB ASP A 75 107.138 -26.334 -12.029 1.00 0.00 C ATOM 1103 CG ASP A 75 105.724 -25.760 -11.942 1.00 0.00 C ATOM 1104 OD1 ASP A 75 105.392 -25.186 -10.918 1.00 0.00 O ATOM 1105 OD2 ASP A 75 104.991 -25.904 -12.906 1.00 0.00 O ATOM 0 H ASP A 75 106.749 -25.816 -9.537 1.00 0.00 H new ATOM 0 HA ASP A 75 109.118 -25.952 -11.258 1.00 0.00 H new ATOM 0 HB2 ASP A 75 107.488 -26.290 -13.060 1.00 0.00 H new ATOM 0 HB3 ASP A 75 107.124 -27.385 -11.741 1.00 0.00 H new ATOM 1110 N TRP A 76 107.275 -23.284 -10.876 1.00 0.00 N ATOM 1111 CA TRP A 76 107.183 -21.863 -11.197 1.00 0.00 C ATOM 1112 C TRP A 76 107.858 -21.022 -10.118 1.00 0.00 C ATOM 1113 O TRP A 76 107.902 -21.411 -8.950 1.00 0.00 O ATOM 1114 CB TRP A 76 105.716 -21.450 -11.323 1.00 0.00 C ATOM 1115 CG TRP A 76 105.534 -20.043 -11.795 1.00 0.00 C ATOM 1116 CD1 TRP A 76 105.131 -19.009 -11.021 1.00 0.00 C ATOM 1117 CD2 TRP A 76 105.738 -19.498 -13.132 1.00 0.00 C ATOM 1118 NE1 TRP A 76 105.076 -17.865 -11.796 1.00 0.00 N ATOM 1119 CE2 TRP A 76 105.440 -18.114 -13.104 1.00 0.00 C ATOM 1120 CE3 TRP A 76 106.148 -20.063 -14.352 1.00 0.00 C ATOM 1121 CZ2 TRP A 76 105.547 -17.320 -14.249 1.00 0.00 C ATOM 1122 CZ3 TRP A 76 106.257 -19.270 -15.503 1.00 0.00 C ATOM 1123 CH2 TRP A 76 105.957 -17.902 -15.452 1.00 0.00 C ATOM 0 H TRP A 76 106.644 -23.592 -10.136 1.00 0.00 H new ATOM 0 HA TRP A 76 107.692 -21.692 -12.145 1.00 0.00 H new ATOM 0 HB2 TRP A 76 105.214 -22.126 -12.016 1.00 0.00 H new ATOM 0 HB3 TRP A 76 105.229 -21.567 -10.355 1.00 0.00 H new ATOM 0 HD1 TRP A 76 104.891 -19.068 -9.970 1.00 0.00 H new ATOM 0 HE1 TRP A 76 104.800 -16.948 -11.444 1.00 0.00 H new ATOM 0 HE3 TRP A 76 106.381 -21.116 -14.403 1.00 0.00 H new ATOM 0 HZ2 TRP A 76 105.315 -16.266 -14.205 1.00 0.00 H new ATOM 0 HZ3 TRP A 76 106.574 -19.716 -16.434 1.00 0.00 H new ATOM 0 HH2 TRP A 76 106.043 -17.297 -16.343 1.00 0.00 H new ATOM 1134 N ALA A 77 108.383 -19.866 -10.517 1.00 0.00 N ATOM 1135 CA ALA A 77 109.047 -18.968 -9.577 1.00 0.00 C ATOM 1136 C ALA A 77 108.111 -18.612 -8.425 1.00 0.00 C ATOM 1137 O ALA A 77 106.986 -19.104 -8.357 1.00 0.00 O ATOM 1138 CB ALA A 77 109.484 -17.692 -10.303 1.00 0.00 C ATOM 0 H ALA A 77 108.362 -19.531 -11.480 1.00 0.00 H new ATOM 0 HA ALA A 77 109.923 -19.473 -9.170 1.00 0.00 H new ATOM 0 HB1 ALA A 77 109.979 -17.024 -9.598 1.00 0.00 H new ATOM 0 HB2 ALA A 77 110.175 -17.949 -11.106 1.00 0.00 H new ATOM 0 HB3 ALA A 77 108.610 -17.194 -10.722 1.00 0.00 H new ATOM 1144 N SER A 78 108.578 -17.757 -7.520 1.00 0.00 N ATOM 1145 CA SER A 78 107.777 -17.368 -6.364 1.00 0.00 C ATOM 1146 C SER A 78 107.275 -15.939 -6.531 1.00 0.00 C ATOM 1147 O SER A 78 107.923 -15.118 -7.181 1.00 0.00 O ATOM 1148 CB SER A 78 108.618 -17.467 -5.090 1.00 0.00 C ATOM 1149 OG SER A 78 109.665 -16.507 -5.145 1.00 0.00 O ATOM 0 H SER A 78 109.500 -17.323 -7.564 1.00 0.00 H new ATOM 0 HA SER A 78 106.923 -18.041 -6.287 1.00 0.00 H new ATOM 0 HB2 SER A 78 107.994 -17.292 -4.214 1.00 0.00 H new ATOM 0 HB3 SER A 78 109.033 -18.470 -4.991 1.00 0.00 H new ATOM 0 HG SER A 78 110.206 -16.566 -4.330 1.00 0.00 H new ATOM 1155 N ILE A 79 106.122 -15.642 -5.938 1.00 0.00 N ATOM 1156 CA ILE A 79 105.540 -14.307 -6.049 1.00 0.00 C ATOM 1157 C ILE A 79 105.287 -13.755 -4.654 1.00 0.00 C ATOM 1158 O ILE A 79 105.057 -14.521 -3.720 1.00 0.00 O ATOM 1159 CB ILE A 79 104.214 -14.372 -6.819 1.00 0.00 C ATOM 1160 CG1 ILE A 79 104.441 -15.002 -8.196 1.00 0.00 C ATOM 1161 CG2 ILE A 79 103.651 -12.961 -7.008 1.00 0.00 C ATOM 1162 CD1 ILE A 79 103.091 -15.290 -8.855 1.00 0.00 C ATOM 0 H ILE A 79 105.577 -16.300 -5.381 1.00 0.00 H new ATOM 0 HA ILE A 79 106.231 -13.658 -6.586 1.00 0.00 H new ATOM 0 HB ILE A 79 103.509 -14.977 -6.249 1.00 0.00 H new ATOM 0 HG12 ILE A 79 105.027 -14.330 -8.823 1.00 0.00 H new ATOM 0 HG13 ILE A 79 105.013 -15.925 -8.096 1.00 0.00 H new ATOM 0 HG21 ILE A 79 102.710 -13.015 -7.555 1.00 0.00 H new ATOM 0 HG22 ILE A 79 103.478 -12.505 -6.033 1.00 0.00 H new ATOM 0 HG23 ILE A 79 104.363 -12.357 -7.570 1.00 0.00 H new ATOM 0 HD11 ILE A 79 103.253 -15.738 -9.835 1.00 0.00 H new ATOM 0 HD12 ILE A 79 102.521 -15.978 -8.231 1.00 0.00 H new ATOM 0 HD13 ILE A 79 102.536 -14.359 -8.969 1.00 0.00 H new ATOM 1174 N TYR A 80 105.324 -12.434 -4.517 1.00 0.00 N ATOM 1175 CA TYR A 80 105.017 -11.815 -3.235 1.00 0.00 C ATOM 1176 C TYR A 80 104.364 -10.454 -3.432 1.00 0.00 C ATOM 1177 O TYR A 80 104.542 -9.816 -4.469 1.00 0.00 O ATOM 1178 CB TYR A 80 106.297 -11.672 -2.405 1.00 0.00 C ATOM 1179 CG TYR A 80 107.291 -10.683 -2.969 1.00 0.00 C ATOM 1180 CD1 TYR A 80 108.268 -11.114 -3.875 1.00 0.00 C ATOM 1181 CD2 TYR A 80 107.237 -9.338 -2.585 1.00 0.00 C ATOM 1182 CE1 TYR A 80 109.189 -10.200 -4.397 1.00 0.00 C ATOM 1183 CE2 TYR A 80 108.160 -8.424 -3.107 1.00 0.00 C ATOM 1184 CZ TYR A 80 109.136 -8.855 -4.013 1.00 0.00 C ATOM 1185 OH TYR A 80 110.046 -7.954 -4.528 1.00 0.00 O ATOM 0 H TYR A 80 105.559 -11.781 -5.265 1.00 0.00 H new ATOM 0 HA TYR A 80 104.314 -12.455 -2.702 1.00 0.00 H new ATOM 0 HB2 TYR A 80 106.029 -11.365 -1.394 1.00 0.00 H new ATOM 0 HB3 TYR A 80 106.777 -12.648 -2.326 1.00 0.00 H new ATOM 0 HD1 TYR A 80 108.310 -12.152 -4.171 1.00 0.00 H new ATOM 0 HD2 TYR A 80 106.484 -9.006 -1.886 1.00 0.00 H new ATOM 0 HE1 TYR A 80 109.942 -10.532 -5.097 1.00 0.00 H new ATOM 0 HE2 TYR A 80 108.119 -7.386 -2.811 1.00 0.00 H new ATOM 0 HH TYR A 80 110.423 -8.309 -5.360 1.00 0.00 H new ATOM 1195 N GLY A 81 103.633 -10.008 -2.416 1.00 0.00 N ATOM 1196 CA GLY A 81 103.035 -8.677 -2.445 1.00 0.00 C ATOM 1197 C GLY A 81 103.278 -7.977 -1.116 1.00 0.00 C ATOM 1198 O GLY A 81 103.244 -8.613 -0.065 1.00 0.00 O ATOM 0 H GLY A 81 103.441 -10.543 -1.569 1.00 0.00 H new ATOM 0 HA2 GLY A 81 103.464 -8.093 -3.259 1.00 0.00 H new ATOM 0 HA3 GLY A 81 101.965 -8.753 -2.637 1.00 0.00 H new ATOM 1202 N VAL A 82 103.464 -6.661 -1.159 1.00 0.00 N ATOM 1203 CA VAL A 82 103.866 -5.919 0.034 1.00 0.00 C ATOM 1204 C VAL A 82 103.073 -4.628 0.179 1.00 0.00 C ATOM 1205 O VAL A 82 102.636 -4.039 -0.810 1.00 0.00 O ATOM 1206 CB VAL A 82 105.359 -5.571 -0.037 1.00 0.00 C ATOM 1207 CG1 VAL A 82 106.202 -6.847 -0.040 1.00 0.00 C ATOM 1208 CG2 VAL A 82 105.646 -4.775 -1.315 1.00 0.00 C ATOM 0 H VAL A 82 103.345 -6.091 -1.996 1.00 0.00 H new ATOM 0 HA VAL A 82 103.667 -6.556 0.896 1.00 0.00 H new ATOM 0 HB VAL A 82 105.618 -4.972 0.836 1.00 0.00 H new ATOM 0 HG11 VAL A 82 107.259 -6.585 -0.091 1.00 0.00 H new ATOM 0 HG12 VAL A 82 106.011 -7.411 0.873 1.00 0.00 H new ATOM 0 HG13 VAL A 82 105.937 -7.456 -0.905 1.00 0.00 H new ATOM 0 HG21 VAL A 82 106.707 -4.530 -1.361 1.00 0.00 H new ATOM 0 HG22 VAL A 82 105.374 -5.373 -2.185 1.00 0.00 H new ATOM 0 HG23 VAL A 82 105.062 -3.855 -1.310 1.00 0.00 H new ATOM 1218 N VAL A 83 102.911 -4.200 1.427 1.00 0.00 N ATOM 1219 CA VAL A 83 102.340 -2.893 1.723 1.00 0.00 C ATOM 1220 C VAL A 83 103.146 -2.257 2.853 1.00 0.00 C ATOM 1221 O VAL A 83 103.741 -2.979 3.656 1.00 0.00 O ATOM 1222 CB VAL A 83 100.865 -3.041 2.119 1.00 0.00 C ATOM 1223 CG1 VAL A 83 100.734 -3.914 3.370 1.00 0.00 C ATOM 1224 CG2 VAL A 83 100.265 -1.659 2.397 1.00 0.00 C ATOM 0 H VAL A 83 103.169 -4.742 2.252 1.00 0.00 H new ATOM 0 HA VAL A 83 102.386 -2.253 0.842 1.00 0.00 H new ATOM 0 HB VAL A 83 100.328 -3.516 1.298 1.00 0.00 H new ATOM 0 HG11 VAL A 83 99.682 -4.010 3.638 1.00 0.00 H new ATOM 0 HG12 VAL A 83 101.149 -4.902 3.169 1.00 0.00 H new ATOM 0 HG13 VAL A 83 101.278 -3.453 4.194 1.00 0.00 H new ATOM 0 HG21 VAL A 83 99.217 -1.767 2.678 1.00 0.00 H new ATOM 0 HG22 VAL A 83 100.812 -1.182 3.211 1.00 0.00 H new ATOM 0 HG23 VAL A 83 100.339 -1.043 1.501 1.00 0.00 H new ATOM 1234 N GLY A 84 103.166 -0.928 2.919 1.00 0.00 N ATOM 1235 CA GLY A 84 103.930 -0.256 3.966 1.00 0.00 C ATOM 1236 C GLY A 84 103.638 1.236 4.017 1.00 0.00 C ATOM 1237 O GLY A 84 102.804 1.745 3.268 1.00 0.00 O ATOM 0 H GLY A 84 102.674 -0.307 2.276 1.00 0.00 H new ATOM 0 HA2 GLY A 84 103.694 -0.705 4.931 1.00 0.00 H new ATOM 0 HA3 GLY A 84 104.995 -0.411 3.794 1.00 0.00 H new ATOM 1241 N VAL A 85 104.366 1.931 4.885 1.00 0.00 N ATOM 1242 CA VAL A 85 104.152 3.360 5.092 1.00 0.00 C ATOM 1243 C VAL A 85 105.485 4.089 4.999 1.00 0.00 C ATOM 1244 O VAL A 85 106.503 3.589 5.477 1.00 0.00 O ATOM 1245 CB VAL A 85 103.514 3.612 6.464 1.00 0.00 C ATOM 1246 CG1 VAL A 85 103.211 5.103 6.629 1.00 0.00 C ATOM 1247 CG2 VAL A 85 102.207 2.821 6.580 1.00 0.00 C ATOM 0 H VAL A 85 105.109 1.529 5.456 1.00 0.00 H new ATOM 0 HA VAL A 85 103.477 3.734 4.322 1.00 0.00 H new ATOM 0 HB VAL A 85 104.208 3.291 7.241 1.00 0.00 H new ATOM 0 HG11 VAL A 85 102.758 5.276 7.605 1.00 0.00 H new ATOM 0 HG12 VAL A 85 104.137 5.673 6.552 1.00 0.00 H new ATOM 0 HG13 VAL A 85 102.522 5.423 5.847 1.00 0.00 H new ATOM 0 HG21 VAL A 85 101.757 3.003 7.556 1.00 0.00 H new ATOM 0 HG22 VAL A 85 101.518 3.140 5.798 1.00 0.00 H new ATOM 0 HG23 VAL A 85 102.415 1.757 6.469 1.00 0.00 H new ATOM 1257 N GLY A 86 105.483 5.258 4.366 1.00 0.00 N ATOM 1258 CA GLY A 86 106.708 6.037 4.211 1.00 0.00 C ATOM 1259 C GLY A 86 106.519 7.436 4.775 1.00 0.00 C ATOM 1260 O GLY A 86 105.473 8.044 4.568 1.00 0.00 O ATOM 0 H GLY A 86 104.653 5.685 3.954 1.00 0.00 H new ATOM 0 HA2 GLY A 86 107.531 5.539 4.724 1.00 0.00 H new ATOM 0 HA3 GLY A 86 106.978 6.096 3.157 1.00 0.00 H new ATOM 1264 N TYR A 87 107.523 7.932 5.495 1.00 0.00 N ATOM 1265 CA TYR A 87 107.452 9.265 6.091 1.00 0.00 C ATOM 1266 C TYR A 87 108.684 10.080 5.712 1.00 0.00 C ATOM 1267 O TYR A 87 109.801 9.566 5.735 1.00 0.00 O ATOM 1268 CB TYR A 87 107.339 9.147 7.615 1.00 0.00 C ATOM 1269 CG TYR A 87 108.577 8.594 8.285 1.00 0.00 C ATOM 1270 CD1 TYR A 87 108.761 7.209 8.379 1.00 0.00 C ATOM 1271 CD2 TYR A 87 109.536 9.466 8.812 1.00 0.00 C ATOM 1272 CE1 TYR A 87 109.907 6.697 9.001 1.00 0.00 C ATOM 1273 CE2 TYR A 87 110.682 8.954 9.432 1.00 0.00 C ATOM 1274 CZ TYR A 87 110.867 7.569 9.527 1.00 0.00 C ATOM 1275 OH TYR A 87 111.996 7.065 10.140 1.00 0.00 O ATOM 0 H TYR A 87 108.393 7.433 5.680 1.00 0.00 H new ATOM 0 HA TYR A 87 106.569 9.778 5.710 1.00 0.00 H new ATOM 0 HB2 TYR A 87 107.123 10.132 8.030 1.00 0.00 H new ATOM 0 HB3 TYR A 87 106.491 8.506 7.857 1.00 0.00 H new ATOM 0 HD1 TYR A 87 108.020 6.536 7.972 1.00 0.00 H new ATOM 0 HD2 TYR A 87 109.392 10.534 8.740 1.00 0.00 H new ATOM 0 HE1 TYR A 87 110.050 5.629 9.075 1.00 0.00 H new ATOM 0 HE2 TYR A 87 111.423 9.627 9.837 1.00 0.00 H new ATOM 0 HH TYR A 87 112.559 7.806 10.448 1.00 0.00 H new ATOM 1285 N GLY A 88 108.474 11.355 5.394 1.00 0.00 N ATOM 1286 CA GLY A 88 109.561 12.220 4.946 1.00 0.00 C ATOM 1287 C GLY A 88 109.603 13.518 5.744 1.00 0.00 C ATOM 1288 O GLY A 88 108.577 13.984 6.249 1.00 0.00 O ATOM 0 H GLY A 88 107.563 11.811 5.438 1.00 0.00 H new ATOM 0 HA2 GLY A 88 110.511 11.696 5.050 1.00 0.00 H new ATOM 0 HA3 GLY A 88 109.436 12.446 3.887 1.00 0.00 H new ATOM 1292 N LYS A 89 110.796 14.098 5.831 1.00 0.00 N ATOM 1293 CA LYS A 89 111.009 15.306 6.617 1.00 0.00 C ATOM 1294 C LYS A 89 111.879 16.297 5.852 1.00 0.00 C ATOM 1295 O LYS A 89 112.807 15.898 5.144 1.00 0.00 O ATOM 1296 CB LYS A 89 111.682 14.951 7.944 1.00 0.00 C ATOM 1297 CG LYS A 89 110.803 13.965 8.718 1.00 0.00 C ATOM 1298 CD LYS A 89 111.342 13.794 10.141 1.00 0.00 C ATOM 1299 CE LYS A 89 112.729 13.146 10.095 1.00 0.00 C ATOM 1300 NZ LYS A 89 113.114 12.698 11.463 1.00 0.00 N ATOM 0 H LYS A 89 111.633 13.748 5.364 1.00 0.00 H new ATOM 0 HA LYS A 89 110.041 15.767 6.812 1.00 0.00 H new ATOM 0 HB2 LYS A 89 112.663 14.512 7.760 1.00 0.00 H new ATOM 0 HB3 LYS A 89 111.842 15.853 8.535 1.00 0.00 H new ATOM 0 HG2 LYS A 89 109.776 14.328 8.750 1.00 0.00 H new ATOM 0 HG3 LYS A 89 110.785 13.002 8.208 1.00 0.00 H new ATOM 0 HD2 LYS A 89 111.399 14.763 10.637 1.00 0.00 H new ATOM 0 HD3 LYS A 89 110.661 13.176 10.726 1.00 0.00 H new ATOM 0 HE2 LYS A 89 112.723 12.297 9.411 1.00 0.00 H new ATOM 0 HE3 LYS A 89 113.462 13.857 9.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 114.056 12.258 11.432 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 113.136 13.517 12.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 112.420 12.006 11.810 1.00 0.00 H new ATOM 1314 N PHE A 90 111.541 17.579 5.971 1.00 0.00 N ATOM 1315 CA PHE A 90 112.329 18.643 5.355 1.00 0.00 C ATOM 1316 C PHE A 90 113.068 19.431 6.433 1.00 0.00 C ATOM 1317 O PHE A 90 112.505 19.724 7.488 1.00 0.00 O ATOM 1318 CB PHE A 90 111.409 19.592 4.586 1.00 0.00 C ATOM 1319 CG PHE A 90 110.626 18.927 3.480 1.00 0.00 C ATOM 1320 CD1 PHE A 90 111.160 18.856 2.187 1.00 0.00 C ATOM 1321 CD2 PHE A 90 109.364 18.384 3.746 1.00 0.00 C ATOM 1322 CE1 PHE A 90 110.430 18.243 1.162 1.00 0.00 C ATOM 1323 CE2 PHE A 90 108.635 17.769 2.721 1.00 0.00 C ATOM 1324 CZ PHE A 90 109.167 17.700 1.429 1.00 0.00 C ATOM 0 H PHE A 90 110.726 17.906 6.489 1.00 0.00 H new ATOM 0 HA PHE A 90 113.049 18.196 4.670 1.00 0.00 H new ATOM 0 HB2 PHE A 90 110.711 20.051 5.286 1.00 0.00 H new ATOM 0 HB3 PHE A 90 112.008 20.396 4.160 1.00 0.00 H new ATOM 0 HD1 PHE A 90 112.134 19.274 1.981 1.00 0.00 H new ATOM 0 HD2 PHE A 90 108.952 18.439 4.743 1.00 0.00 H new ATOM 0 HE1 PHE A 90 110.841 18.189 0.165 1.00 0.00 H new ATOM 0 HE2 PHE A 90 107.662 17.348 2.928 1.00 0.00 H new ATOM 0 HZ PHE A 90 108.604 17.228 0.638 1.00 0.00 H new ATOM 1334 N GLN A 91 114.327 19.776 6.173 1.00 0.00 N ATOM 1335 CA GLN A 91 115.113 20.546 7.136 1.00 0.00 C ATOM 1336 C GLN A 91 115.239 22.001 6.696 1.00 0.00 C ATOM 1337 O GLN A 91 115.681 22.290 5.584 1.00 0.00 O ATOM 1338 CB GLN A 91 116.508 19.937 7.287 1.00 0.00 C ATOM 1339 CG GLN A 91 116.392 18.534 7.889 1.00 0.00 C ATOM 1340 CD GLN A 91 117.767 17.878 8.004 1.00 0.00 C ATOM 1341 OE1 GLN A 91 118.738 18.337 7.401 1.00 0.00 O ATOM 1342 NE2 GLN A 91 117.908 16.818 8.752 1.00 0.00 N ATOM 0 H GLN A 91 114.821 19.538 5.313 1.00 0.00 H new ATOM 0 HA GLN A 91 114.596 20.513 8.095 1.00 0.00 H new ATOM 0 HB2 GLN A 91 117.002 19.888 6.316 1.00 0.00 H new ATOM 0 HB3 GLN A 91 117.125 20.569 7.927 1.00 0.00 H new ATOM 0 HG2 GLN A 91 115.929 18.593 8.874 1.00 0.00 H new ATOM 0 HG3 GLN A 91 115.741 17.919 7.267 1.00 0.00 H new ATOM 0 HE21 GLN A 91 117.105 16.436 9.252 1.00 0.00 H new ATOM 0 HE22 GLN A 91 118.821 16.371 8.836 1.00 0.00 H new ATOM 1351 N THR A 92 114.847 22.911 7.581 1.00 0.00 N ATOM 1352 CA THR A 92 114.929 24.339 7.297 1.00 0.00 C ATOM 1353 C THR A 92 115.268 25.118 8.568 1.00 0.00 C ATOM 1354 O THR A 92 115.306 24.548 9.658 1.00 0.00 O ATOM 1355 CB THR A 92 113.603 24.833 6.703 1.00 0.00 C ATOM 1356 OG1 THR A 92 113.723 26.204 6.357 1.00 0.00 O ATOM 1357 CG2 THR A 92 112.464 24.650 7.710 1.00 0.00 C ATOM 0 H THR A 92 114.469 22.685 8.501 1.00 0.00 H new ATOM 0 HA THR A 92 115.724 24.507 6.570 1.00 0.00 H new ATOM 0 HB THR A 92 113.375 24.249 5.811 1.00 0.00 H new ATOM 0 HG1 THR A 92 112.877 26.520 5.976 1.00 0.00 H new ATOM 0 HG21 THR A 92 111.531 25.005 7.273 1.00 0.00 H new ATOM 0 HG22 THR A 92 112.367 23.594 7.962 1.00 0.00 H new ATOM 0 HG23 THR A 92 112.682 25.220 8.613 1.00 0.00 H new ATOM 1365 N THR A 93 115.515 26.417 8.425 1.00 0.00 N ATOM 1366 CA THR A 93 115.785 27.259 9.586 1.00 0.00 C ATOM 1367 C THR A 93 114.518 28.008 9.983 1.00 0.00 C ATOM 1368 O THR A 93 113.923 28.715 9.170 1.00 0.00 O ATOM 1369 CB THR A 93 116.896 28.261 9.263 1.00 0.00 C ATOM 1370 OG1 THR A 93 118.039 27.561 8.793 1.00 0.00 O ATOM 1371 CG2 THR A 93 117.260 29.048 10.523 1.00 0.00 C ATOM 0 H THR A 93 115.534 26.904 7.529 1.00 0.00 H new ATOM 0 HA THR A 93 116.107 26.628 10.414 1.00 0.00 H new ATOM 0 HB THR A 93 116.550 28.952 8.494 1.00 0.00 H new ATOM 0 HG1 THR A 93 118.751 28.201 8.584 1.00 0.00 H new ATOM 0 HG21 THR A 93 118.051 29.761 10.291 1.00 0.00 H new ATOM 0 HG22 THR A 93 116.382 29.585 10.883 1.00 0.00 H new ATOM 0 HG23 THR A 93 117.606 28.360 11.294 1.00 0.00 H new ATOM 1379 N GLU A 94 114.134 27.870 11.250 1.00 0.00 N ATOM 1380 CA GLU A 94 112.861 28.399 11.730 1.00 0.00 C ATOM 1381 C GLU A 94 112.689 28.066 13.209 1.00 0.00 C ATOM 1382 O GLU A 94 113.188 27.041 13.676 1.00 0.00 O ATOM 1383 CB GLU A 94 111.703 27.786 10.932 1.00 0.00 C ATOM 1384 CG GLU A 94 110.388 28.498 11.279 1.00 0.00 C ATOM 1385 CD GLU A 94 109.190 27.868 10.559 1.00 0.00 C ATOM 1386 OE1 GLU A 94 109.365 26.893 9.840 1.00 0.00 O ATOM 1387 OE2 GLU A 94 108.097 28.379 10.740 1.00 0.00 O ATOM 0 H GLU A 94 114.688 27.395 11.963 1.00 0.00 H new ATOM 0 HA GLU A 94 112.856 29.481 11.597 1.00 0.00 H new ATOM 0 HB2 GLU A 94 111.901 27.872 9.864 1.00 0.00 H new ATOM 0 HB3 GLU A 94 111.620 26.722 11.156 1.00 0.00 H new ATOM 0 HG2 GLU A 94 110.227 28.458 12.356 1.00 0.00 H new ATOM 0 HG3 GLU A 94 110.462 29.551 11.007 1.00 0.00 H new ATOM 1394 N TYR A 95 111.989 28.927 13.943 1.00 0.00 N ATOM 1395 CA TYR A 95 111.710 28.652 15.347 1.00 0.00 C ATOM 1396 C TYR A 95 110.528 27.686 15.425 1.00 0.00 C ATOM 1397 O TYR A 95 109.635 27.751 14.578 1.00 0.00 O ATOM 1398 CB TYR A 95 111.376 29.948 16.087 1.00 0.00 C ATOM 1399 CG TYR A 95 112.547 30.895 16.199 1.00 0.00 C ATOM 1400 CD1 TYR A 95 113.453 30.765 17.259 1.00 0.00 C ATOM 1401 CD2 TYR A 95 112.729 31.900 15.243 1.00 0.00 C ATOM 1402 CE1 TYR A 95 114.540 31.641 17.363 1.00 0.00 C ATOM 1403 CE2 TYR A 95 113.816 32.778 15.346 1.00 0.00 C ATOM 1404 CZ TYR A 95 114.721 32.648 16.406 1.00 0.00 C ATOM 1405 OH TYR A 95 115.792 33.512 16.508 1.00 0.00 O ATOM 0 H TYR A 95 111.610 29.808 13.595 1.00 0.00 H new ATOM 0 HA TYR A 95 112.588 28.209 15.817 1.00 0.00 H new ATOM 0 HB2 TYR A 95 110.559 30.452 15.571 1.00 0.00 H new ATOM 0 HB3 TYR A 95 111.019 29.704 17.087 1.00 0.00 H new ATOM 0 HD1 TYR A 95 113.313 29.989 17.997 1.00 0.00 H new ATOM 0 HD2 TYR A 95 112.031 31.999 14.425 1.00 0.00 H new ATOM 0 HE1 TYR A 95 115.239 31.541 18.180 1.00 0.00 H new ATOM 0 HE2 TYR A 95 113.956 33.554 14.608 1.00 0.00 H new ATOM 0 HH TYR A 95 115.771 34.149 15.764 1.00 0.00 H new ATOM 1415 N PRO A 96 110.483 26.810 16.404 1.00 0.00 N ATOM 1416 CA PRO A 96 109.537 25.653 16.348 1.00 0.00 C ATOM 1417 C PRO A 96 108.084 26.080 16.161 1.00 0.00 C ATOM 1418 O PRO A 96 107.595 27.000 16.817 1.00 0.00 O ATOM 1419 CB PRO A 96 109.720 24.943 17.696 1.00 0.00 C ATOM 1420 CG PRO A 96 111.033 25.407 18.229 1.00 0.00 C ATOM 1421 CD PRO A 96 111.270 26.801 17.653 1.00 0.00 C ATOM 0 HA PRO A 96 109.753 25.015 15.491 1.00 0.00 H new ATOM 0 HB2 PRO A 96 108.910 25.192 18.382 1.00 0.00 H new ATOM 0 HB3 PRO A 96 109.710 23.860 17.571 1.00 0.00 H new ATOM 0 HG2 PRO A 96 111.021 25.435 19.319 1.00 0.00 H new ATOM 0 HG3 PRO A 96 111.832 24.726 17.937 1.00 0.00 H new ATOM 0 HD2 PRO A 96 110.937 27.579 18.340 1.00 0.00 H new ATOM 0 HD3 PRO A 96 112.328 26.978 17.459 1.00 0.00 H new ATOM 1429 N THR A 97 107.410 25.388 15.248 1.00 0.00 N ATOM 1430 CA THR A 97 105.976 25.550 15.045 1.00 0.00 C ATOM 1431 C THR A 97 105.276 24.227 15.329 1.00 0.00 C ATOM 1432 O THR A 97 105.892 23.166 15.203 1.00 0.00 O ATOM 1433 CB THR A 97 105.692 25.987 13.607 1.00 0.00 C ATOM 1434 OG1 THR A 97 106.433 27.165 13.317 1.00 0.00 O ATOM 1435 CG2 THR A 97 104.198 26.268 13.441 1.00 0.00 C ATOM 0 H THR A 97 107.842 24.701 14.630 1.00 0.00 H new ATOM 0 HA THR A 97 105.602 26.316 15.724 1.00 0.00 H new ATOM 0 HB THR A 97 105.987 25.193 12.921 1.00 0.00 H new ATOM 0 HG1 THR A 97 106.254 27.446 12.395 1.00 0.00 H new ATOM 0 HG21 THR A 97 103.998 26.579 12.416 1.00 0.00 H new ATOM 0 HG22 THR A 97 103.631 25.364 13.663 1.00 0.00 H new ATOM 0 HG23 THR A 97 103.899 27.061 14.126 1.00 0.00 H new ATOM 1443 N TYR A 98 104.001 24.276 15.713 1.00 0.00 N ATOM 1444 CA TYR A 98 103.239 23.044 15.917 1.00 0.00 C ATOM 1445 C TYR A 98 102.231 22.853 14.788 1.00 0.00 C ATOM 1446 O TYR A 98 101.369 23.701 14.555 1.00 0.00 O ATOM 1447 CB TYR A 98 102.498 23.107 17.253 1.00 0.00 C ATOM 1448 CG TYR A 98 103.416 23.262 18.443 1.00 0.00 C ATOM 1449 CD1 TYR A 98 104.056 22.140 18.984 1.00 0.00 C ATOM 1450 CD2 TYR A 98 103.629 24.527 19.003 1.00 0.00 C ATOM 1451 CE1 TYR A 98 104.907 22.284 20.087 1.00 0.00 C ATOM 1452 CE2 TYR A 98 104.480 24.671 20.106 1.00 0.00 C ATOM 1453 CZ TYR A 98 105.119 23.549 20.648 1.00 0.00 C ATOM 1454 OH TYR A 98 105.957 23.691 21.734 1.00 0.00 O ATOM 0 H TYR A 98 103.482 25.137 15.886 1.00 0.00 H new ATOM 0 HA TYR A 98 103.932 22.203 15.923 1.00 0.00 H new ATOM 0 HB2 TYR A 98 101.798 23.942 17.233 1.00 0.00 H new ATOM 0 HB3 TYR A 98 101.907 22.199 17.375 1.00 0.00 H new ATOM 0 HD1 TYR A 98 103.893 21.164 18.551 1.00 0.00 H new ATOM 0 HD2 TYR A 98 103.137 25.392 18.584 1.00 0.00 H new ATOM 0 HE1 TYR A 98 105.400 21.419 20.505 1.00 0.00 H new ATOM 0 HE2 TYR A 98 104.643 25.647 20.538 1.00 0.00 H new ATOM 0 HH TYR A 98 105.994 24.634 21.998 1.00 0.00 H new ATOM 1464 N LYS A 99 102.353 21.727 14.092 1.00 0.00 N ATOM 1465 CA LYS A 99 101.424 21.373 13.023 1.00 0.00 C ATOM 1466 C LYS A 99 100.634 20.128 13.413 1.00 0.00 C ATOM 1467 O LYS A 99 101.136 19.278 14.149 1.00 0.00 O ATOM 1468 CB LYS A 99 102.197 21.123 11.725 1.00 0.00 C ATOM 1469 CG LYS A 99 101.217 20.980 10.559 1.00 0.00 C ATOM 1470 CD LYS A 99 101.990 20.666 9.276 1.00 0.00 C ATOM 1471 CE LYS A 99 101.029 20.676 8.085 1.00 0.00 C ATOM 1472 NZ LYS A 99 101.809 20.773 6.819 1.00 0.00 N ATOM 0 H LYS A 99 103.090 21.040 14.250 1.00 0.00 H new ATOM 0 HA LYS A 99 100.728 22.197 12.866 1.00 0.00 H new ATOM 0 HB2 LYS A 99 102.884 21.947 11.536 1.00 0.00 H new ATOM 0 HB3 LYS A 99 102.800 20.220 11.818 1.00 0.00 H new ATOM 0 HG2 LYS A 99 100.501 20.185 10.768 1.00 0.00 H new ATOM 0 HG3 LYS A 99 100.646 21.900 10.436 1.00 0.00 H new ATOM 0 HD2 LYS A 99 102.780 21.402 9.126 1.00 0.00 H new ATOM 0 HD3 LYS A 99 102.473 19.692 9.359 1.00 0.00 H new ATOM 0 HE2 LYS A 99 100.425 19.769 8.084 1.00 0.00 H new ATOM 0 HE3 LYS A 99 100.341 21.517 8.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 101.157 20.780 6.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 102.367 21.651 6.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 102.448 19.956 6.742 1.00 0.00 H new ATOM 1486 N HIS A 100 99.401 20.017 12.925 1.00 0.00 N ATOM 1487 CA HIS A 100 98.585 18.836 13.203 1.00 0.00 C ATOM 1488 C HIS A 100 99.316 17.565 12.770 1.00 0.00 C ATOM 1489 O HIS A 100 99.351 16.576 13.503 1.00 0.00 O ATOM 1490 CB HIS A 100 97.251 18.935 12.463 1.00 0.00 C ATOM 1491 CG HIS A 100 96.382 20.067 12.942 1.00 0.00 C ATOM 1492 ND1 HIS A 100 96.412 21.321 12.356 1.00 0.00 N ATOM 1493 CD2 HIS A 100 95.455 20.146 13.952 1.00 0.00 C ATOM 1494 CE1 HIS A 100 95.529 22.096 13.009 1.00 0.00 C ATOM 1495 NE2 HIS A 100 94.917 21.431 13.991 1.00 0.00 N ATOM 0 H HIS A 100 98.948 20.721 12.342 1.00 0.00 H new ATOM 0 HA HIS A 100 98.402 18.790 14.276 1.00 0.00 H new ATOM 0 HB2 HIS A 100 97.444 19.061 11.398 1.00 0.00 H new ATOM 0 HB3 HIS A 100 96.709 17.997 12.580 1.00 0.00 H new ATOM 0 HD2 HIS A 100 95.184 19.337 14.614 1.00 0.00 H new ATOM 0 HE1 HIS A 100 95.338 23.131 12.768 1.00 0.00 H new ATOM 0 HE2 HIS A 100 94.208 21.787 14.632 1.00 0.00 H new ATOM 1503 N ASP A 101 99.896 17.603 11.575 1.00 0.00 N ATOM 1504 CA ASP A 101 100.694 16.487 11.077 1.00 0.00 C ATOM 1505 C ASP A 101 102.181 16.820 11.181 1.00 0.00 C ATOM 1506 O ASP A 101 102.685 17.675 10.454 1.00 0.00 O ATOM 1507 CB ASP A 101 100.322 16.199 9.619 1.00 0.00 C ATOM 1508 CG ASP A 101 100.980 14.913 9.115 1.00 0.00 C ATOM 1509 OD1 ASP A 101 101.386 14.098 9.930 1.00 0.00 O ATOM 1510 OD2 ASP A 101 101.063 14.758 7.907 1.00 0.00 O ATOM 0 H ASP A 101 99.829 18.393 10.934 1.00 0.00 H new ATOM 0 HA ASP A 101 100.489 15.603 11.681 1.00 0.00 H new ATOM 0 HB2 ASP A 101 99.239 16.114 9.529 1.00 0.00 H new ATOM 0 HB3 ASP A 101 100.629 17.036 8.992 1.00 0.00 H new ATOM 1515 N THR A 102 102.880 16.139 12.084 1.00 0.00 N ATOM 1516 CA THR A 102 104.291 16.428 12.325 1.00 0.00 C ATOM 1517 C THR A 102 105.130 16.196 11.070 1.00 0.00 C ATOM 1518 O THR A 102 105.994 17.006 10.734 1.00 0.00 O ATOM 1519 CB THR A 102 104.814 15.542 13.459 1.00 0.00 C ATOM 1520 OG1 THR A 102 103.971 15.687 14.594 1.00 0.00 O ATOM 1521 CG2 THR A 102 106.239 15.961 13.826 1.00 0.00 C ATOM 0 H THR A 102 102.496 15.388 12.658 1.00 0.00 H new ATOM 0 HA THR A 102 104.376 17.478 12.603 1.00 0.00 H new ATOM 0 HB THR A 102 104.818 14.501 13.134 1.00 0.00 H new ATOM 0 HG1 THR A 102 104.302 15.120 15.322 1.00 0.00 H new ATOM 0 HG21 THR A 102 106.608 15.328 14.633 1.00 0.00 H new ATOM 0 HG22 THR A 102 106.886 15.852 12.955 1.00 0.00 H new ATOM 0 HG23 THR A 102 106.240 17.001 14.151 1.00 0.00 H new ATOM 1529 N SER A 103 104.871 15.089 10.381 1.00 0.00 N ATOM 1530 CA SER A 103 105.630 14.740 9.182 1.00 0.00 C ATOM 1531 C SER A 103 104.682 14.375 8.046 1.00 0.00 C ATOM 1532 O SER A 103 103.484 14.199 8.268 1.00 0.00 O ATOM 1533 CB SER A 103 106.555 13.558 9.476 1.00 0.00 C ATOM 1534 OG SER A 103 105.769 12.397 9.708 1.00 0.00 O ATOM 0 H SER A 103 104.144 14.419 10.630 1.00 0.00 H new ATOM 0 HA SER A 103 106.228 15.602 8.884 1.00 0.00 H new ATOM 0 HB2 SER A 103 107.231 13.392 8.637 1.00 0.00 H new ATOM 0 HB3 SER A 103 107.174 13.773 10.347 1.00 0.00 H new ATOM 0 HG SER A 103 106.357 11.636 9.895 1.00 0.00 H new ATOM 1540 N ASP A 104 105.218 14.254 6.834 1.00 0.00 N ATOM 1541 CA ASP A 104 104.387 13.913 5.684 1.00 0.00 C ATOM 1542 C ASP A 104 104.454 12.411 5.441 1.00 0.00 C ATOM 1543 O ASP A 104 105.539 11.837 5.432 1.00 0.00 O ATOM 1544 CB ASP A 104 104.873 14.660 4.438 1.00 0.00 C ATOM 1545 CG ASP A 104 104.733 16.169 4.627 1.00 0.00 C ATOM 1546 OD1 ASP A 104 103.838 16.585 5.345 1.00 0.00 O ATOM 1547 OD2 ASP A 104 105.527 16.891 4.046 1.00 0.00 O ATOM 0 H ASP A 104 106.208 14.385 6.625 1.00 0.00 H new ATOM 0 HA ASP A 104 103.357 14.206 5.888 1.00 0.00 H new ATOM 0 HB2 ASP A 104 105.915 14.408 4.240 1.00 0.00 H new ATOM 0 HB3 ASP A 104 104.297 14.342 3.569 1.00 0.00 H new ATOM 1552 N TYR A 105 103.301 11.773 5.245 1.00 0.00 N ATOM 1553 CA TYR A 105 103.264 10.319 5.104 1.00 0.00 C ATOM 1554 C TYR A 105 102.380 9.876 3.941 1.00 0.00 C ATOM 1555 O TYR A 105 101.468 10.592 3.526 1.00 0.00 O ATOM 1556 CB TYR A 105 102.768 9.689 6.411 1.00 0.00 C ATOM 1557 CG TYR A 105 101.311 9.963 6.713 1.00 0.00 C ATOM 1558 CD1 TYR A 105 100.941 11.147 7.360 1.00 0.00 C ATOM 1559 CD2 TYR A 105 100.333 9.031 6.346 1.00 0.00 C ATOM 1560 CE1 TYR A 105 99.594 11.400 7.641 1.00 0.00 C ATOM 1561 CE2 TYR A 105 98.985 9.284 6.626 1.00 0.00 C ATOM 1562 CZ TYR A 105 98.615 10.469 7.274 1.00 0.00 C ATOM 1563 OH TYR A 105 97.286 10.718 7.549 1.00 0.00 O ATOM 0 H TYR A 105 102.392 12.232 5.181 1.00 0.00 H new ATOM 0 HA TYR A 105 104.277 9.980 4.888 1.00 0.00 H new ATOM 0 HB2 TYR A 105 102.922 8.611 6.364 1.00 0.00 H new ATOM 0 HB3 TYR A 105 103.376 10.062 7.235 1.00 0.00 H new ATOM 0 HD1 TYR A 105 101.696 11.866 7.643 1.00 0.00 H new ATOM 0 HD2 TYR A 105 100.619 8.117 5.847 1.00 0.00 H new ATOM 0 HE1 TYR A 105 99.309 12.314 8.141 1.00 0.00 H new ATOM 0 HE2 TYR A 105 98.230 8.565 6.342 1.00 0.00 H new ATOM 0 HH TYR A 105 96.740 9.971 7.227 1.00 0.00 H new ATOM 1573 N GLY A 106 102.667 8.684 3.423 1.00 0.00 N ATOM 1574 CA GLY A 106 101.873 8.111 2.341 1.00 0.00 C ATOM 1575 C GLY A 106 101.889 6.587 2.412 1.00 0.00 C ATOM 1576 O GLY A 106 102.657 6.006 3.179 1.00 0.00 O ATOM 0 H GLY A 106 103.442 8.098 3.735 1.00 0.00 H new ATOM 0 HA2 GLY A 106 100.847 8.473 2.405 1.00 0.00 H new ATOM 0 HA3 GLY A 106 102.268 8.440 1.380 1.00 0.00 H new ATOM 1580 N PHE A 107 101.066 5.947 1.586 1.00 0.00 N ATOM 1581 CA PHE A 107 100.949 4.488 1.600 1.00 0.00 C ATOM 1582 C PHE A 107 101.490 3.898 0.302 1.00 0.00 C ATOM 1583 O PHE A 107 101.318 4.489 -0.764 1.00 0.00 O ATOM 1584 CB PHE A 107 99.483 4.086 1.773 1.00 0.00 C ATOM 1585 CG PHE A 107 98.879 4.563 3.072 1.00 0.00 C ATOM 1586 CD1 PHE A 107 99.043 3.806 4.239 1.00 0.00 C ATOM 1587 CD2 PHE A 107 98.156 5.761 3.111 1.00 0.00 C ATOM 1588 CE1 PHE A 107 98.484 4.248 5.443 1.00 0.00 C ATOM 1589 CE2 PHE A 107 97.597 6.202 4.315 1.00 0.00 C ATOM 1590 CZ PHE A 107 97.760 5.446 5.482 1.00 0.00 C ATOM 0 H PHE A 107 100.471 6.412 0.900 1.00 0.00 H new ATOM 0 HA PHE A 107 101.533 4.101 2.435 1.00 0.00 H new ATOM 0 HB2 PHE A 107 98.903 4.488 0.942 1.00 0.00 H new ATOM 0 HB3 PHE A 107 99.403 3.000 1.721 1.00 0.00 H new ATOM 0 HD1 PHE A 107 99.601 2.882 4.209 1.00 0.00 H new ATOM 0 HD2 PHE A 107 98.030 6.345 2.211 1.00 0.00 H new ATOM 0 HE1 PHE A 107 98.611 3.665 6.343 1.00 0.00 H new ATOM 0 HE2 PHE A 107 97.039 7.126 4.344 1.00 0.00 H new ATOM 0 HZ PHE A 107 97.328 5.786 6.411 1.00 0.00 H new ATOM 1600 N SER A 108 102.139 2.736 0.386 1.00 0.00 N ATOM 1601 CA SER A 108 102.734 2.119 -0.798 1.00 0.00 C ATOM 1602 C SER A 108 102.363 0.642 -0.897 1.00 0.00 C ATOM 1603 O SER A 108 102.218 -0.037 0.119 1.00 0.00 O ATOM 1604 CB SER A 108 104.255 2.257 -0.743 1.00 0.00 C ATOM 1605 OG SER A 108 104.594 3.632 -0.624 1.00 0.00 O ATOM 0 H SER A 108 102.265 2.209 1.250 1.00 0.00 H new ATOM 0 HA SER A 108 102.345 2.632 -1.678 1.00 0.00 H new ATOM 0 HB2 SER A 108 104.653 1.697 0.103 1.00 0.00 H new ATOM 0 HB3 SER A 108 104.703 1.836 -1.643 1.00 0.00 H new ATOM 0 HG SER A 108 105.569 3.727 -0.587 1.00 0.00 H new ATOM 1611 N TYR A 109 102.220 0.163 -2.129 1.00 0.00 N ATOM 1612 CA TYR A 109 101.913 -1.242 -2.380 1.00 0.00 C ATOM 1613 C TYR A 109 102.568 -1.693 -3.683 1.00 0.00 C ATOM 1614 O TYR A 109 102.784 -0.880 -4.582 1.00 0.00 O ATOM 1615 CB TYR A 109 100.399 -1.437 -2.477 1.00 0.00 C ATOM 1616 CG TYR A 109 99.987 -2.878 -2.672 1.00 0.00 C ATOM 1617 CD1 TYR A 109 99.738 -3.690 -1.561 1.00 0.00 C ATOM 1618 CD2 TYR A 109 99.854 -3.398 -3.965 1.00 0.00 C ATOM 1619 CE1 TYR A 109 99.356 -5.025 -1.742 1.00 0.00 C ATOM 1620 CE2 TYR A 109 99.471 -4.733 -4.146 1.00 0.00 C ATOM 1621 CZ TYR A 109 99.223 -5.547 -3.035 1.00 0.00 C ATOM 1622 OH TYR A 109 98.845 -6.862 -3.213 1.00 0.00 O ATOM 0 H TYR A 109 102.312 0.729 -2.972 1.00 0.00 H new ATOM 0 HA TYR A 109 102.301 -1.839 -1.555 1.00 0.00 H new ATOM 0 HB2 TYR A 109 99.933 -1.054 -1.569 1.00 0.00 H new ATOM 0 HB3 TYR A 109 100.017 -0.843 -3.307 1.00 0.00 H new ATOM 0 HD1 TYR A 109 99.840 -3.288 -0.564 1.00 0.00 H new ATOM 0 HD2 TYR A 109 100.047 -2.770 -4.822 1.00 0.00 H new ATOM 0 HE1 TYR A 109 99.164 -5.652 -0.884 1.00 0.00 H new ATOM 0 HE2 TYR A 109 99.367 -5.134 -5.143 1.00 0.00 H new ATOM 0 HH TYR A 109 98.799 -7.062 -4.171 1.00 0.00 H new ATOM 1632 N GLY A 110 102.899 -2.980 -3.779 1.00 0.00 N ATOM 1633 CA GLY A 110 103.492 -3.505 -5.007 1.00 0.00 C ATOM 1634 C GLY A 110 103.673 -5.017 -4.948 1.00 0.00 C ATOM 1635 O GLY A 110 103.314 -5.654 -3.960 1.00 0.00 O ATOM 0 H GLY A 110 102.770 -3.667 -3.036 1.00 0.00 H new ATOM 0 HA2 GLY A 110 102.858 -3.248 -5.855 1.00 0.00 H new ATOM 0 HA3 GLY A 110 104.458 -3.030 -5.176 1.00 0.00 H new ATOM 1639 N ALA A 111 104.239 -5.581 -6.010 1.00 0.00 N ATOM 1640 CA ALA A 111 104.475 -7.020 -6.077 1.00 0.00 C ATOM 1641 C ALA A 111 105.783 -7.306 -6.809 1.00 0.00 C ATOM 1642 O ALA A 111 106.260 -6.473 -7.581 1.00 0.00 O ATOM 1643 CB ALA A 111 103.318 -7.708 -6.805 1.00 0.00 C ATOM 0 H ALA A 111 104.543 -5.065 -6.836 1.00 0.00 H new ATOM 0 HA ALA A 111 104.543 -7.410 -5.061 1.00 0.00 H new ATOM 0 HB1 ALA A 111 103.503 -8.781 -6.850 1.00 0.00 H new ATOM 0 HB2 ALA A 111 102.388 -7.522 -6.267 1.00 0.00 H new ATOM 0 HB3 ALA A 111 103.237 -7.311 -7.817 1.00 0.00 H new ATOM 1649 N GLY A 112 106.359 -8.481 -6.567 1.00 0.00 N ATOM 1650 CA GLY A 112 107.637 -8.825 -7.184 1.00 0.00 C ATOM 1651 C GLY A 112 107.744 -10.319 -7.471 1.00 0.00 C ATOM 1652 O GLY A 112 107.005 -11.125 -6.904 1.00 0.00 O ATOM 0 H GLY A 112 105.969 -9.200 -5.958 1.00 0.00 H new ATOM 0 HA2 GLY A 112 107.754 -8.267 -8.113 1.00 0.00 H new ATOM 0 HA3 GLY A 112 108.451 -8.522 -6.526 1.00 0.00 H new ATOM 1656 N LEU A 113 108.677 -10.667 -8.356 1.00 0.00 N ATOM 1657 CA LEU A 113 108.909 -12.057 -8.732 1.00 0.00 C ATOM 1658 C LEU A 113 110.386 -12.406 -8.570 1.00 0.00 C ATOM 1659 O LEU A 113 111.257 -11.602 -8.905 1.00 0.00 O ATOM 1660 CB LEU A 113 108.485 -12.278 -10.187 1.00 0.00 C ATOM 1661 CG LEU A 113 108.581 -13.763 -10.548 1.00 0.00 C ATOM 1662 CD1 LEU A 113 107.358 -14.505 -10.005 1.00 0.00 C ATOM 1663 CD2 LEU A 113 108.632 -13.912 -12.070 1.00 0.00 C ATOM 0 H LEU A 113 109.287 -9.999 -8.828 1.00 0.00 H new ATOM 0 HA LEU A 113 108.318 -12.701 -8.081 1.00 0.00 H new ATOM 0 HB2 LEU A 113 107.464 -11.926 -10.333 1.00 0.00 H new ATOM 0 HB3 LEU A 113 109.121 -11.693 -10.851 1.00 0.00 H new ATOM 0 HG LEU A 113 109.484 -14.185 -10.108 1.00 0.00 H new ATOM 0 HD11 LEU A 113 107.429 -15.562 -10.263 1.00 0.00 H new ATOM 0 HD12 LEU A 113 107.319 -14.398 -8.921 1.00 0.00 H new ATOM 0 HD13 LEU A 113 106.453 -14.084 -10.443 1.00 0.00 H new ATOM 0 HD21 LEU A 113 108.700 -14.968 -12.330 1.00 0.00 H new ATOM 0 HD22 LEU A 113 107.728 -13.488 -12.508 1.00 0.00 H new ATOM 0 HD23 LEU A 113 109.504 -13.386 -12.458 1.00 0.00 H new ATOM 1675 N GLN A 114 110.658 -13.595 -8.038 1.00 0.00 N ATOM 1676 CA GLN A 114 112.030 -14.064 -7.865 1.00 0.00 C ATOM 1677 C GLN A 114 112.304 -15.224 -8.818 1.00 0.00 C ATOM 1678 O GLN A 114 111.565 -16.209 -8.822 1.00 0.00 O ATOM 1679 CB GLN A 114 112.230 -14.523 -6.419 1.00 0.00 C ATOM 1680 CG GLN A 114 113.690 -14.926 -6.193 1.00 0.00 C ATOM 1681 CD GLN A 114 113.920 -15.336 -4.736 1.00 0.00 C ATOM 1682 OE1 GLN A 114 113.049 -15.163 -3.882 1.00 0.00 O ATOM 1683 NE2 GLN A 114 115.055 -15.884 -4.399 1.00 0.00 N ATOM 0 H GLN A 114 109.946 -14.252 -7.719 1.00 0.00 H new ATOM 0 HA GLN A 114 112.722 -13.252 -8.087 1.00 0.00 H new ATOM 0 HB2 GLN A 114 111.955 -13.721 -5.733 1.00 0.00 H new ATOM 0 HB3 GLN A 114 111.574 -15.366 -6.203 1.00 0.00 H new ATOM 0 HG2 GLN A 114 113.951 -15.753 -6.854 1.00 0.00 H new ATOM 0 HG3 GLN A 114 114.346 -14.094 -6.450 1.00 0.00 H new ATOM 0 HE21 GLN A 114 115.780 -16.030 -5.102 1.00 0.00 H new ATOM 0 HE22 GLN A 114 115.218 -16.167 -3.433 1.00 0.00 H new ATOM 1692 N PHE A 115 113.364 -15.119 -9.623 1.00 0.00 N ATOM 1693 CA PHE A 115 113.644 -16.148 -10.627 1.00 0.00 C ATOM 1694 C PHE A 115 115.111 -16.563 -10.604 1.00 0.00 C ATOM 1695 O PHE A 115 115.967 -15.824 -10.116 1.00 0.00 O ATOM 1696 CB PHE A 115 113.250 -15.658 -12.024 1.00 0.00 C ATOM 1697 CG PHE A 115 114.131 -14.566 -12.587 1.00 0.00 C ATOM 1698 CD1 PHE A 115 115.257 -14.900 -13.346 1.00 0.00 C ATOM 1699 CD2 PHE A 115 113.807 -13.221 -12.368 1.00 0.00 C ATOM 1700 CE1 PHE A 115 116.063 -13.891 -13.887 1.00 0.00 C ATOM 1701 CE2 PHE A 115 114.615 -12.212 -12.906 1.00 0.00 C ATOM 1702 CZ PHE A 115 115.741 -12.547 -13.668 1.00 0.00 C ATOM 0 H PHE A 115 114.031 -14.348 -9.601 1.00 0.00 H new ATOM 0 HA PHE A 115 113.044 -17.024 -10.380 1.00 0.00 H new ATOM 0 HB2 PHE A 115 113.265 -16.506 -12.708 1.00 0.00 H new ATOM 0 HB3 PHE A 115 112.223 -15.295 -11.990 1.00 0.00 H new ATOM 0 HD1 PHE A 115 115.505 -15.937 -13.515 1.00 0.00 H new ATOM 0 HD2 PHE A 115 112.935 -12.963 -11.785 1.00 0.00 H new ATOM 0 HE1 PHE A 115 116.933 -14.150 -14.473 1.00 0.00 H new ATOM 0 HE2 PHE A 115 114.370 -11.175 -12.733 1.00 0.00 H new ATOM 0 HZ PHE A 115 116.361 -11.768 -14.087 1.00 0.00 H new ATOM 1712 N ASN A 116 115.378 -17.752 -11.146 1.00 0.00 N ATOM 1713 CA ASN A 116 116.712 -18.354 -11.133 1.00 0.00 C ATOM 1714 C ASN A 116 117.068 -18.850 -9.724 1.00 0.00 C ATOM 1715 O ASN A 116 117.983 -18.325 -9.086 1.00 0.00 O ATOM 1716 CB ASN A 116 117.771 -17.367 -11.647 1.00 0.00 C ATOM 1717 CG ASN A 116 118.940 -18.128 -12.261 1.00 0.00 C ATOM 1718 OD1 ASN A 116 119.830 -18.586 -11.544 1.00 0.00 O ATOM 1719 ND2 ASN A 116 118.993 -18.291 -13.555 1.00 0.00 N ATOM 0 H ASN A 116 114.673 -18.326 -11.608 1.00 0.00 H new ATOM 0 HA ASN A 116 116.701 -19.211 -11.806 1.00 0.00 H new ATOM 0 HB2 ASN A 116 117.330 -16.702 -12.389 1.00 0.00 H new ATOM 0 HB3 ASN A 116 118.124 -16.741 -10.828 1.00 0.00 H new ATOM 0 HD21 ASN A 116 119.773 -18.798 -13.974 1.00 0.00 H new ATOM 0 HD22 ASN A 116 118.255 -17.911 -14.148 1.00 0.00 H new ATOM 1726 N PRO A 117 116.366 -19.843 -9.214 1.00 0.00 N ATOM 1727 CA PRO A 117 116.672 -20.417 -7.872 1.00 0.00 C ATOM 1728 C PRO A 117 117.641 -21.601 -7.927 1.00 0.00 C ATOM 1729 O PRO A 117 118.303 -21.911 -6.938 1.00 0.00 O ATOM 1730 CB PRO A 117 115.299 -20.872 -7.383 1.00 0.00 C ATOM 1731 CG PRO A 117 114.570 -21.292 -8.616 1.00 0.00 C ATOM 1732 CD PRO A 117 115.189 -20.529 -9.793 1.00 0.00 C ATOM 0 HA PRO A 117 117.168 -19.694 -7.224 1.00 0.00 H new ATOM 0 HB2 PRO A 117 115.385 -21.696 -6.675 1.00 0.00 H new ATOM 0 HB3 PRO A 117 114.775 -20.065 -6.870 1.00 0.00 H new ATOM 0 HG2 PRO A 117 114.658 -22.368 -8.767 1.00 0.00 H new ATOM 0 HG3 PRO A 117 113.507 -21.068 -8.529 1.00 0.00 H new ATOM 0 HD2 PRO A 117 115.480 -21.206 -10.596 1.00 0.00 H new ATOM 0 HD3 PRO A 117 114.483 -19.815 -10.218 1.00 0.00 H new ATOM 1740 N MET A 118 117.724 -22.259 -9.081 1.00 0.00 N ATOM 1741 CA MET A 118 118.578 -23.434 -9.222 1.00 0.00 C ATOM 1742 C MET A 118 120.020 -23.124 -8.822 1.00 0.00 C ATOM 1743 O MET A 118 120.706 -23.968 -8.247 1.00 0.00 O ATOM 1744 CB MET A 118 118.546 -23.931 -10.669 1.00 0.00 C ATOM 1745 CG MET A 118 117.134 -24.411 -11.012 1.00 0.00 C ATOM 1746 SD MET A 118 117.136 -25.208 -12.638 1.00 0.00 S ATOM 1747 CE MET A 118 117.702 -23.783 -13.601 1.00 0.00 C ATOM 0 H MET A 118 117.214 -22.001 -9.926 1.00 0.00 H new ATOM 0 HA MET A 118 118.196 -24.208 -8.557 1.00 0.00 H new ATOM 0 HB2 MET A 118 118.844 -23.131 -11.346 1.00 0.00 H new ATOM 0 HB3 MET A 118 119.260 -24.744 -10.802 1.00 0.00 H new ATOM 0 HG2 MET A 118 116.784 -25.111 -10.254 1.00 0.00 H new ATOM 0 HG3 MET A 118 116.443 -23.568 -11.011 1.00 0.00 H new ATOM 0 HE1 MET A 118 117.351 -23.876 -14.629 1.00 0.00 H new ATOM 0 HE2 MET A 118 117.305 -22.867 -13.163 1.00 0.00 H new ATOM 0 HE3 MET A 118 118.791 -23.747 -13.592 1.00 0.00 H new ATOM 1757 N GLU A 119 120.475 -21.913 -9.128 1.00 0.00 N ATOM 1758 CA GLU A 119 121.829 -21.505 -8.772 1.00 0.00 C ATOM 1759 C GLU A 119 121.834 -20.839 -7.402 1.00 0.00 C ATOM 1760 O GLU A 119 120.783 -20.659 -6.786 1.00 0.00 O ATOM 1761 CB GLU A 119 122.376 -20.530 -9.817 1.00 0.00 C ATOM 1762 CG GLU A 119 122.441 -21.224 -11.183 1.00 0.00 C ATOM 1763 CD GLU A 119 123.064 -20.321 -12.253 1.00 0.00 C ATOM 1764 OE1 GLU A 119 123.256 -19.140 -11.999 1.00 0.00 O ATOM 1765 OE2 GLU A 119 123.344 -20.831 -13.324 1.00 0.00 O ATOM 0 H GLU A 119 119.931 -21.202 -9.618 1.00 0.00 H new ATOM 0 HA GLU A 119 122.462 -22.391 -8.741 1.00 0.00 H new ATOM 0 HB2 GLU A 119 121.738 -19.648 -9.876 1.00 0.00 H new ATOM 0 HB3 GLU A 119 123.368 -20.187 -9.525 1.00 0.00 H new ATOM 0 HG2 GLU A 119 123.024 -22.141 -11.097 1.00 0.00 H new ATOM 0 HG3 GLU A 119 121.436 -21.513 -11.492 1.00 0.00 H new ATOM 1772 N ASN A 120 123.020 -20.472 -6.926 1.00 0.00 N ATOM 1773 CA ASN A 120 123.137 -19.825 -5.619 1.00 0.00 C ATOM 1774 C ASN A 120 122.819 -18.322 -5.665 1.00 0.00 C ATOM 1775 O ASN A 120 123.007 -17.624 -4.670 1.00 0.00 O ATOM 1776 CB ASN A 120 124.554 -20.021 -5.076 1.00 0.00 C ATOM 1777 CG ASN A 120 124.874 -21.509 -4.983 1.00 0.00 C ATOM 1778 OD1 ASN A 120 125.947 -21.942 -5.404 1.00 0.00 O ATOM 1779 ND2 ASN A 120 124.002 -22.323 -4.452 1.00 0.00 N ATOM 0 H ASN A 120 123.904 -20.608 -7.416 1.00 0.00 H new ATOM 0 HA ASN A 120 122.402 -20.294 -4.965 1.00 0.00 H new ATOM 0 HB2 ASN A 120 125.274 -19.526 -5.727 1.00 0.00 H new ATOM 0 HB3 ASN A 120 124.643 -19.559 -4.093 1.00 0.00 H new ATOM 0 HD21 ASN A 120 124.209 -23.320 -4.385 1.00 0.00 H new ATOM 0 HD22 ASN A 120 123.114 -21.962 -4.104 1.00 0.00 H new ATOM 1786 N VAL A 121 122.343 -17.817 -6.806 1.00 0.00 N ATOM 1787 CA VAL A 121 121.974 -16.411 -6.923 1.00 0.00 C ATOM 1788 C VAL A 121 120.622 -16.280 -7.624 1.00 0.00 C ATOM 1789 O VAL A 121 120.325 -17.021 -8.561 1.00 0.00 O ATOM 1790 CB VAL A 121 123.063 -15.656 -7.696 1.00 0.00 C ATOM 1791 CG1 VAL A 121 123.194 -16.219 -9.114 1.00 0.00 C ATOM 1792 CG2 VAL A 121 122.711 -14.167 -7.769 1.00 0.00 C ATOM 0 H VAL A 121 122.206 -18.362 -7.657 1.00 0.00 H new ATOM 0 HA VAL A 121 121.886 -15.975 -5.928 1.00 0.00 H new ATOM 0 HB VAL A 121 124.012 -15.781 -7.174 1.00 0.00 H new ATOM 0 HG11 VAL A 121 123.970 -15.674 -9.652 1.00 0.00 H new ATOM 0 HG12 VAL A 121 123.461 -17.275 -9.063 1.00 0.00 H new ATOM 0 HG13 VAL A 121 122.245 -16.109 -9.638 1.00 0.00 H new ATOM 0 HG21 VAL A 121 123.488 -13.636 -8.319 1.00 0.00 H new ATOM 0 HG22 VAL A 121 121.756 -14.044 -8.280 1.00 0.00 H new ATOM 0 HG23 VAL A 121 122.638 -13.760 -6.760 1.00 0.00 H new ATOM 1802 N ALA A 122 119.808 -15.333 -7.165 1.00 0.00 N ATOM 1803 CA ALA A 122 118.496 -15.108 -7.763 1.00 0.00 C ATOM 1804 C ALA A 122 118.250 -13.615 -7.940 1.00 0.00 C ATOM 1805 O ALA A 122 118.849 -12.799 -7.244 1.00 0.00 O ATOM 1806 CB ALA A 122 117.405 -15.707 -6.875 1.00 0.00 C ATOM 0 H ALA A 122 120.032 -14.713 -6.386 1.00 0.00 H new ATOM 0 HA ALA A 122 118.469 -15.593 -8.739 1.00 0.00 H new ATOM 0 HB1 ALA A 122 116.430 -15.534 -7.330 1.00 0.00 H new ATOM 0 HB2 ALA A 122 117.570 -16.779 -6.768 1.00 0.00 H new ATOM 0 HB3 ALA A 122 117.436 -15.236 -5.893 1.00 0.00 H new ATOM 1812 N LEU A 123 117.359 -13.262 -8.865 1.00 0.00 N ATOM 1813 CA LEU A 123 117.096 -11.858 -9.172 1.00 0.00 C ATOM 1814 C LEU A 123 115.658 -11.507 -8.816 1.00 0.00 C ATOM 1815 O LEU A 123 114.765 -12.344 -8.948 1.00 0.00 O ATOM 1816 CB LEU A 123 117.335 -11.594 -10.660 1.00 0.00 C ATOM 1817 CG LEU A 123 118.767 -11.983 -11.038 1.00 0.00 C ATOM 1818 CD1 LEU A 123 118.959 -11.809 -12.546 1.00 0.00 C ATOM 1819 CD2 LEU A 123 119.759 -11.080 -10.299 1.00 0.00 C ATOM 0 H LEU A 123 116.810 -13.925 -9.412 1.00 0.00 H new ATOM 0 HA LEU A 123 117.773 -11.238 -8.584 1.00 0.00 H new ATOM 0 HB2 LEU A 123 116.625 -12.165 -11.258 1.00 0.00 H new ATOM 0 HB3 LEU A 123 117.165 -10.541 -10.883 1.00 0.00 H new ATOM 0 HG LEU A 123 118.943 -13.022 -10.760 1.00 0.00 H new ATOM 0 HD11 LEU A 123 119.978 -12.085 -12.817 1.00 0.00 H new ATOM 0 HD12 LEU A 123 118.255 -12.449 -13.079 1.00 0.00 H new ATOM 0 HD13 LEU A 123 118.781 -10.769 -12.818 1.00 0.00 H new ATOM 0 HD21 LEU A 123 120.777 -11.359 -10.570 1.00 0.00 H new ATOM 0 HD22 LEU A 123 119.582 -10.041 -10.577 1.00 0.00 H new ATOM 0 HD23 LEU A 123 119.625 -11.196 -9.223 1.00 0.00 H new ATOM 1831 N ASP A 124 115.438 -10.272 -8.369 1.00 0.00 N ATOM 1832 CA ASP A 124 114.107 -9.842 -7.957 1.00 0.00 C ATOM 1833 C ASP A 124 113.683 -8.609 -8.744 1.00 0.00 C ATOM 1834 O ASP A 124 114.416 -7.622 -8.802 1.00 0.00 O ATOM 1835 CB ASP A 124 114.110 -9.516 -6.462 1.00 0.00 C ATOM 1836 CG ASP A 124 112.696 -9.194 -5.993 1.00 0.00 C ATOM 1837 OD1 ASP A 124 111.969 -10.125 -5.691 1.00 0.00 O ATOM 1838 OD2 ASP A 124 112.360 -8.023 -5.946 1.00 0.00 O ATOM 0 H ASP A 124 116.160 -9.557 -8.284 1.00 0.00 H new ATOM 0 HA ASP A 124 113.401 -10.649 -8.154 1.00 0.00 H new ATOM 0 HB2 ASP A 124 114.505 -10.361 -5.898 1.00 0.00 H new ATOM 0 HB3 ASP A 124 114.768 -8.669 -6.268 1.00 0.00 H new ATOM 1843 N PHE A 125 112.506 -8.693 -9.359 1.00 0.00 N ATOM 1844 CA PHE A 125 111.941 -7.568 -10.096 1.00 0.00 C ATOM 1845 C PHE A 125 110.604 -7.182 -9.478 1.00 0.00 C ATOM 1846 O PHE A 125 109.733 -8.034 -9.314 1.00 0.00 O ATOM 1847 CB PHE A 125 111.735 -7.955 -11.561 1.00 0.00 C ATOM 1848 CG PHE A 125 111.240 -6.820 -12.424 1.00 0.00 C ATOM 1849 CD1 PHE A 125 109.865 -6.608 -12.581 1.00 0.00 C ATOM 1850 CD2 PHE A 125 112.156 -5.981 -13.072 1.00 0.00 C ATOM 1851 CE1 PHE A 125 109.406 -5.558 -13.385 1.00 0.00 C ATOM 1852 CE2 PHE A 125 111.696 -4.931 -13.875 1.00 0.00 C ATOM 1853 CZ PHE A 125 110.321 -4.719 -14.031 1.00 0.00 C ATOM 0 H PHE A 125 111.924 -9.531 -9.361 1.00 0.00 H new ATOM 0 HA PHE A 125 112.627 -6.723 -10.045 1.00 0.00 H new ATOM 0 HB2 PHE A 125 112.677 -8.324 -11.966 1.00 0.00 H new ATOM 0 HB3 PHE A 125 111.022 -8.778 -11.614 1.00 0.00 H new ATOM 0 HD1 PHE A 125 109.158 -7.255 -12.082 1.00 0.00 H new ATOM 0 HD2 PHE A 125 113.217 -6.144 -12.952 1.00 0.00 H new ATOM 0 HE1 PHE A 125 108.345 -5.395 -13.507 1.00 0.00 H new ATOM 0 HE2 PHE A 125 112.402 -4.284 -14.374 1.00 0.00 H new ATOM 0 HZ PHE A 125 109.966 -3.908 -14.650 1.00 0.00 H new ATOM 1863 N SER A 126 110.447 -5.910 -9.122 1.00 0.00 N ATOM 1864 CA SER A 126 109.215 -5.461 -8.478 1.00 0.00 C ATOM 1865 C SER A 126 108.824 -4.064 -8.942 1.00 0.00 C ATOM 1866 O SER A 126 109.681 -3.224 -9.216 1.00 0.00 O ATOM 1867 CB SER A 126 109.394 -5.463 -6.960 1.00 0.00 C ATOM 1868 OG SER A 126 108.155 -5.137 -6.344 1.00 0.00 O ATOM 0 H SER A 126 111.146 -5.181 -9.265 1.00 0.00 H new ATOM 0 HA SER A 126 108.418 -6.150 -8.758 1.00 0.00 H new ATOM 0 HB2 SER A 126 109.735 -6.442 -6.623 1.00 0.00 H new ATOM 0 HB3 SER A 126 110.159 -4.742 -6.671 1.00 0.00 H new ATOM 0 HG SER A 126 107.420 -5.349 -6.956 1.00 0.00 H new ATOM 1874 N TYR A 127 107.518 -3.826 -9.026 1.00 0.00 N ATOM 1875 CA TYR A 127 106.996 -2.503 -9.356 1.00 0.00 C ATOM 1876 C TYR A 127 106.173 -1.970 -8.189 1.00 0.00 C ATOM 1877 O TYR A 127 105.200 -2.594 -7.765 1.00 0.00 O ATOM 1878 CB TYR A 127 106.137 -2.581 -10.622 1.00 0.00 C ATOM 1879 CG TYR A 127 104.872 -3.391 -10.457 1.00 0.00 C ATOM 1880 CD1 TYR A 127 104.904 -4.781 -10.623 1.00 0.00 C ATOM 1881 CD2 TYR A 127 103.668 -2.751 -10.137 1.00 0.00 C ATOM 1882 CE1 TYR A 127 103.733 -5.531 -10.469 1.00 0.00 C ATOM 1883 CE2 TYR A 127 102.497 -3.503 -9.983 1.00 0.00 C ATOM 1884 CZ TYR A 127 102.528 -4.893 -10.149 1.00 0.00 C ATOM 1885 OH TYR A 127 101.374 -5.633 -9.997 1.00 0.00 O ATOM 0 H TYR A 127 106.800 -4.534 -8.870 1.00 0.00 H new ATOM 0 HA TYR A 127 107.828 -1.823 -9.541 1.00 0.00 H new ATOM 0 HB2 TYR A 127 105.871 -1.570 -10.931 1.00 0.00 H new ATOM 0 HB3 TYR A 127 106.732 -3.014 -11.426 1.00 0.00 H new ATOM 0 HD1 TYR A 127 105.833 -5.274 -10.870 1.00 0.00 H new ATOM 0 HD2 TYR A 127 103.643 -1.679 -10.009 1.00 0.00 H new ATOM 0 HE1 TYR A 127 103.758 -6.603 -10.597 1.00 0.00 H new ATOM 0 HE2 TYR A 127 101.568 -3.010 -9.736 1.00 0.00 H new ATOM 0 HH TYR A 127 100.629 -5.036 -9.775 1.00 0.00 H new ATOM 1895 N GLU A 128 106.574 -0.816 -7.662 1.00 0.00 N ATOM 1896 CA GLU A 128 105.916 -0.244 -6.489 1.00 0.00 C ATOM 1897 C GLU A 128 105.335 1.130 -6.805 1.00 0.00 C ATOM 1898 O GLU A 128 105.975 1.952 -7.461 1.00 0.00 O ATOM 1899 CB GLU A 128 106.930 -0.123 -5.349 1.00 0.00 C ATOM 1900 CG GLU A 128 106.213 0.290 -4.058 1.00 0.00 C ATOM 1901 CD GLU A 128 107.200 0.509 -2.904 1.00 0.00 C ATOM 1902 OE1 GLU A 128 108.400 0.384 -3.107 1.00 0.00 O ATOM 1903 OE2 GLU A 128 106.733 0.801 -1.816 1.00 0.00 O ATOM 0 H GLU A 128 107.348 -0.260 -8.026 1.00 0.00 H new ATOM 0 HA GLU A 128 105.099 -0.902 -6.193 1.00 0.00 H new ATOM 0 HB2 GLU A 128 107.442 -1.074 -5.203 1.00 0.00 H new ATOM 0 HB3 GLU A 128 107.692 0.613 -5.604 1.00 0.00 H new ATOM 0 HG2 GLU A 128 105.649 1.206 -4.233 1.00 0.00 H new ATOM 0 HG3 GLU A 128 105.493 -0.480 -3.780 1.00 0.00 H new ATOM 1910 N GLN A 129 104.116 1.370 -6.330 1.00 0.00 N ATOM 1911 CA GLN A 129 103.466 2.664 -6.506 1.00 0.00 C ATOM 1912 C GLN A 129 103.042 3.206 -5.146 1.00 0.00 C ATOM 1913 O GLN A 129 102.664 2.439 -4.262 1.00 0.00 O ATOM 1914 CB GLN A 129 102.238 2.519 -7.407 1.00 0.00 C ATOM 1915 CG GLN A 129 102.678 2.078 -8.806 1.00 0.00 C ATOM 1916 CD GLN A 129 101.463 1.845 -9.701 1.00 0.00 C ATOM 1917 OE1 GLN A 129 100.343 1.683 -9.215 1.00 0.00 O ATOM 1918 NE2 GLN A 129 101.621 1.816 -10.996 1.00 0.00 N ATOM 0 H GLN A 129 103.559 0.685 -5.820 1.00 0.00 H new ATOM 0 HA GLN A 129 104.167 3.355 -6.974 1.00 0.00 H new ATOM 0 HB2 GLN A 129 101.548 1.788 -6.984 1.00 0.00 H new ATOM 0 HB3 GLN A 129 101.703 3.467 -7.465 1.00 0.00 H new ATOM 0 HG2 GLN A 129 103.322 2.839 -9.248 1.00 0.00 H new ATOM 0 HG3 GLN A 129 103.267 1.163 -8.737 1.00 0.00 H new ATOM 0 HE21 GLN A 129 102.548 1.950 -11.400 1.00 0.00 H new ATOM 0 HE22 GLN A 129 100.817 1.659 -11.604 1.00 0.00 H new ATOM 1927 N SER A 130 103.113 4.524 -4.977 1.00 0.00 N ATOM 1928 CA SER A 130 102.768 5.135 -3.697 1.00 0.00 C ATOM 1929 C SER A 130 101.943 6.399 -3.898 1.00 0.00 C ATOM 1930 O SER A 130 102.136 7.132 -4.867 1.00 0.00 O ATOM 1931 CB SER A 130 104.044 5.478 -2.927 1.00 0.00 C ATOM 1932 OG SER A 130 103.694 5.972 -1.641 1.00 0.00 O ATOM 0 H SER A 130 103.403 5.182 -5.701 1.00 0.00 H new ATOM 0 HA SER A 130 102.173 4.420 -3.129 1.00 0.00 H new ATOM 0 HB2 SER A 130 104.674 4.594 -2.831 1.00 0.00 H new ATOM 0 HB3 SER A 130 104.622 6.224 -3.472 1.00 0.00 H new ATOM 0 HG SER A 130 103.924 5.305 -0.961 1.00 0.00 H new ATOM 1938 N ARG A 131 101.029 6.648 -2.965 1.00 0.00 N ATOM 1939 CA ARG A 131 100.214 7.858 -2.993 1.00 0.00 C ATOM 1940 C ARG A 131 100.484 8.682 -1.740 1.00 0.00 C ATOM 1941 O ARG A 131 100.317 8.192 -0.621 1.00 0.00 O ATOM 1942 CB ARG A 131 98.729 7.491 -3.058 1.00 0.00 C ATOM 1943 CG ARG A 131 97.897 8.760 -3.247 1.00 0.00 C ATOM 1944 CD ARG A 131 96.420 8.387 -3.382 1.00 0.00 C ATOM 1945 NE ARG A 131 95.904 7.888 -2.104 1.00 0.00 N ATOM 1946 CZ ARG A 131 95.534 8.688 -1.093 1.00 0.00 C ATOM 1947 NH1 ARG A 131 95.605 9.996 -1.172 1.00 0.00 N ATOM 1948 NH2 ARG A 131 95.088 8.148 0.008 1.00 0.00 N ATOM 0 H ARG A 131 100.834 6.027 -2.179 1.00 0.00 H new ATOM 0 HA ARG A 131 100.473 8.442 -3.876 1.00 0.00 H new ATOM 0 HB2 ARG A 131 98.550 6.800 -3.882 1.00 0.00 H new ATOM 0 HB3 ARG A 131 98.429 6.980 -2.143 1.00 0.00 H new ATOM 0 HG2 ARG A 131 98.038 9.429 -2.398 1.00 0.00 H new ATOM 0 HG3 ARG A 131 98.230 9.297 -4.135 1.00 0.00 H new ATOM 0 HD2 ARG A 131 95.845 9.257 -3.699 1.00 0.00 H new ATOM 0 HD3 ARG A 131 96.299 7.626 -4.153 1.00 0.00 H new ATOM 0 HE ARG A 131 95.822 6.879 -1.977 1.00 0.00 H new ATOM 0 HH11 ARG A 131 95.951 10.437 -2.024 1.00 0.00 H new ATOM 0 HH12 ARG A 131 95.314 10.571 -0.381 1.00 0.00 H new ATOM 0 HH21 ARG A 131 95.025 7.133 0.089 1.00 0.00 H new ATOM 0 HH22 ARG A 131 94.802 8.741 0.787 1.00 0.00 H new ATOM 1962 N ILE A 132 100.931 9.919 -1.940 1.00 0.00 N ATOM 1963 CA ILE A 132 101.267 10.806 -0.832 1.00 0.00 C ATOM 1964 C ILE A 132 100.515 12.112 -1.045 1.00 0.00 C ATOM 1965 O ILE A 132 100.973 12.988 -1.777 1.00 0.00 O ATOM 1966 CB ILE A 132 102.790 11.012 -0.734 1.00 0.00 C ATOM 1967 CG1 ILE A 132 103.107 11.988 0.405 1.00 0.00 C ATOM 1968 CG2 ILE A 132 103.372 11.540 -2.053 1.00 0.00 C ATOM 1969 CD1 ILE A 132 104.600 11.922 0.734 1.00 0.00 C ATOM 0 H ILE A 132 101.069 10.330 -2.863 1.00 0.00 H new ATOM 0 HA ILE A 132 100.966 10.369 0.120 1.00 0.00 H new ATOM 0 HB ILE A 132 103.250 10.045 -0.529 1.00 0.00 H new ATOM 0 HG12 ILE A 132 102.832 13.002 0.116 1.00 0.00 H new ATOM 0 HG13 ILE A 132 102.518 11.737 1.287 1.00 0.00 H new ATOM 0 HG21 ILE A 132 104.449 11.674 -1.948 1.00 0.00 H new ATOM 0 HG22 ILE A 132 103.171 10.825 -2.851 1.00 0.00 H new ATOM 0 HG23 ILE A 132 102.910 12.496 -2.298 1.00 0.00 H new ATOM 0 HD11 ILE A 132 104.825 12.616 1.544 1.00 0.00 H new ATOM 0 HD12 ILE A 132 104.860 10.909 1.041 1.00 0.00 H new ATOM 0 HD13 ILE A 132 105.179 12.194 -0.148 1.00 0.00 H new ATOM 1981 N ARG A 133 99.345 12.206 -0.406 1.00 0.00 N ATOM 1982 CA ARG A 133 98.305 13.210 -0.693 1.00 0.00 C ATOM 1983 C ARG A 133 98.449 13.914 -2.049 1.00 0.00 C ATOM 1984 O ARG A 133 99.183 14.893 -2.183 1.00 0.00 O ATOM 1985 CB ARG A 133 98.317 14.270 0.410 1.00 0.00 C ATOM 1986 CG ARG A 133 97.930 13.629 1.744 1.00 0.00 C ATOM 1987 CD ARG A 133 97.818 14.710 2.821 1.00 0.00 C ATOM 1988 NE ARG A 133 99.080 15.447 2.938 1.00 0.00 N ATOM 1989 CZ ARG A 133 99.157 16.722 3.348 1.00 0.00 C ATOM 1990 NH1 ARG A 133 98.097 17.419 3.680 1.00 0.00 N ATOM 1991 NH2 ARG A 133 100.331 17.290 3.420 1.00 0.00 N ATOM 0 H ARG A 133 99.084 11.570 0.347 1.00 0.00 H new ATOM 0 HA ARG A 133 97.364 12.662 -0.730 1.00 0.00 H new ATOM 0 HB2 ARG A 133 99.307 14.720 0.485 1.00 0.00 H new ATOM 0 HB3 ARG A 133 97.621 15.072 0.165 1.00 0.00 H new ATOM 0 HG2 ARG A 133 96.981 13.102 1.644 1.00 0.00 H new ATOM 0 HG3 ARG A 133 98.676 12.889 2.033 1.00 0.00 H new ATOM 0 HD2 ARG A 133 97.010 15.398 2.573 1.00 0.00 H new ATOM 0 HD3 ARG A 133 97.566 14.254 3.778 1.00 0.00 H new ATOM 0 HE ARG A 133 99.945 14.965 2.695 1.00 0.00 H new ATOM 0 HH11 ARG A 133 97.171 16.994 3.631 1.00 0.00 H new ATOM 0 HH12 ARG A 133 98.198 18.386 3.987 1.00 0.00 H new ATOM 0 HH21 ARG A 133 101.168 16.765 3.167 1.00 0.00 H new ATOM 0 HH22 ARG A 133 100.411 18.259 3.729 1.00 0.00 H new ATOM 2005 N SER A 134 97.740 13.392 -3.048 1.00 0.00 N ATOM 2006 CA SER A 134 97.587 14.059 -4.348 1.00 0.00 C ATOM 2007 C SER A 134 98.848 13.993 -5.218 1.00 0.00 C ATOM 2008 O SER A 134 98.795 14.372 -6.388 1.00 0.00 O ATOM 2009 CB SER A 134 97.172 15.526 -4.177 1.00 0.00 C ATOM 2010 OG SER A 134 96.795 16.055 -5.441 1.00 0.00 O ATOM 0 H SER A 134 97.255 12.497 -2.984 1.00 0.00 H new ATOM 0 HA SER A 134 96.800 13.508 -4.863 1.00 0.00 H new ATOM 0 HB2 SER A 134 96.342 15.602 -3.475 1.00 0.00 H new ATOM 0 HB3 SER A 134 97.997 16.103 -3.759 1.00 0.00 H new ATOM 0 HG SER A 134 97.328 15.631 -6.145 1.00 0.00 H new ATOM 2016 N VAL A 135 99.974 13.522 -4.676 1.00 0.00 N ATOM 2017 CA VAL A 135 101.191 13.378 -5.470 1.00 0.00 C ATOM 2018 C VAL A 135 101.424 11.903 -5.775 1.00 0.00 C ATOM 2019 O VAL A 135 101.290 11.055 -4.893 1.00 0.00 O ATOM 2020 CB VAL A 135 102.392 13.952 -4.711 1.00 0.00 C ATOM 2021 CG1 VAL A 135 103.644 13.875 -5.588 1.00 0.00 C ATOM 2022 CG2 VAL A 135 102.126 15.414 -4.345 1.00 0.00 C ATOM 0 H VAL A 135 100.066 13.237 -3.701 1.00 0.00 H new ATOM 0 HA VAL A 135 101.076 13.928 -6.404 1.00 0.00 H new ATOM 0 HB VAL A 135 102.545 13.370 -3.802 1.00 0.00 H new ATOM 0 HG11 VAL A 135 104.495 14.284 -5.044 1.00 0.00 H new ATOM 0 HG12 VAL A 135 103.844 12.835 -5.846 1.00 0.00 H new ATOM 0 HG13 VAL A 135 103.485 14.451 -6.500 1.00 0.00 H new ATOM 0 HG21 VAL A 135 102.984 15.816 -3.806 1.00 0.00 H new ATOM 0 HG22 VAL A 135 101.965 15.993 -5.254 1.00 0.00 H new ATOM 0 HG23 VAL A 135 101.239 15.476 -3.714 1.00 0.00 H new ATOM 2032 N ASP A 136 101.767 11.603 -7.025 1.00 0.00 N ATOM 2033 CA ASP A 136 101.937 10.215 -7.450 1.00 0.00 C ATOM 2034 C ASP A 136 103.415 9.867 -7.571 1.00 0.00 C ATOM 2035 O ASP A 136 104.166 10.559 -8.256 1.00 0.00 O ATOM 2036 CB ASP A 136 101.246 9.996 -8.798 1.00 0.00 C ATOM 2037 CG ASP A 136 99.766 10.349 -8.689 1.00 0.00 C ATOM 2038 OD1 ASP A 136 99.432 11.497 -8.926 1.00 0.00 O ATOM 2039 OD2 ASP A 136 98.989 9.464 -8.369 1.00 0.00 O ATOM 0 H ASP A 136 101.932 12.295 -7.756 1.00 0.00 H new ATOM 0 HA ASP A 136 101.486 9.567 -6.699 1.00 0.00 H new ATOM 0 HB2 ASP A 136 101.720 10.611 -9.563 1.00 0.00 H new ATOM 0 HB3 ASP A 136 101.359 8.957 -9.109 1.00 0.00 H new ATOM 2044 N VAL A 137 103.832 8.784 -6.920 1.00 0.00 N ATOM 2045 CA VAL A 137 105.234 8.371 -6.953 1.00 0.00 C ATOM 2046 C VAL A 137 105.356 6.998 -7.607 1.00 0.00 C ATOM 2047 O VAL A 137 104.666 6.057 -7.216 1.00 0.00 O ATOM 2048 CB VAL A 137 105.797 8.316 -5.527 1.00 0.00 C ATOM 2049 CG1 VAL A 137 107.288 7.978 -5.568 1.00 0.00 C ATOM 2050 CG2 VAL A 137 105.618 9.675 -4.841 1.00 0.00 C ATOM 0 H VAL A 137 103.225 8.180 -6.367 1.00 0.00 H new ATOM 0 HA VAL A 137 105.803 9.097 -7.534 1.00 0.00 H new ATOM 0 HB VAL A 137 105.260 7.548 -4.970 1.00 0.00 H new ATOM 0 HG11 VAL A 137 107.681 7.941 -4.552 1.00 0.00 H new ATOM 0 HG12 VAL A 137 107.428 7.009 -6.047 1.00 0.00 H new ATOM 0 HG13 VAL A 137 107.819 8.743 -6.134 1.00 0.00 H new ATOM 0 HG21 VAL A 137 106.020 9.628 -3.829 1.00 0.00 H new ATOM 0 HG22 VAL A 137 106.148 10.441 -5.407 1.00 0.00 H new ATOM 0 HG23 VAL A 137 104.558 9.924 -4.799 1.00 0.00 H new ATOM 2060 N GLY A 138 106.238 6.892 -8.598 1.00 0.00 N ATOM 2061 CA GLY A 138 106.459 5.627 -9.293 1.00 0.00 C ATOM 2062 C GLY A 138 107.916 5.210 -9.164 1.00 0.00 C ATOM 2063 O GLY A 138 108.812 5.995 -9.467 1.00 0.00 O ATOM 0 H GLY A 138 106.810 7.665 -8.937 1.00 0.00 H new ATOM 0 HA2 GLY A 138 105.813 4.855 -8.875 1.00 0.00 H new ATOM 0 HA3 GLY A 138 106.193 5.729 -10.345 1.00 0.00 H new ATOM 2067 N THR A 139 108.158 3.985 -8.706 1.00 0.00 N ATOM 2068 CA THR A 139 109.529 3.511 -8.515 1.00 0.00 C ATOM 2069 C THR A 139 109.766 2.201 -9.256 1.00 0.00 C ATOM 2070 O THR A 139 108.881 1.350 -9.344 1.00 0.00 O ATOM 2071 CB THR A 139 109.805 3.305 -7.024 1.00 0.00 C ATOM 2072 OG1 THR A 139 108.939 2.299 -6.519 1.00 0.00 O ATOM 2073 CG2 THR A 139 109.570 4.613 -6.265 1.00 0.00 C ATOM 0 H THR A 139 107.434 3.309 -8.462 1.00 0.00 H new ATOM 0 HA THR A 139 110.205 4.265 -8.917 1.00 0.00 H new ATOM 0 HB THR A 139 110.842 2.996 -6.889 1.00 0.00 H new ATOM 0 HG1 THR A 139 108.977 2.296 -5.540 1.00 0.00 H new ATOM 0 HG21 THR A 139 109.768 4.459 -5.204 1.00 0.00 H new ATOM 0 HG22 THR A 139 110.238 5.383 -6.651 1.00 0.00 H new ATOM 0 HG23 THR A 139 108.536 4.930 -6.398 1.00 0.00 H new ATOM 2081 N TRP A 140 110.976 2.055 -9.785 1.00 0.00 N ATOM 2082 CA TRP A 140 111.394 0.810 -10.419 1.00 0.00 C ATOM 2083 C TRP A 140 112.580 0.240 -9.651 1.00 0.00 C ATOM 2084 O TRP A 140 113.611 0.898 -9.520 1.00 0.00 O ATOM 2085 CB TRP A 140 111.796 1.079 -11.870 1.00 0.00 C ATOM 2086 CG TRP A 140 112.142 -0.157 -12.638 1.00 0.00 C ATOM 2087 CD1 TRP A 140 111.289 -0.841 -13.434 1.00 0.00 C ATOM 2088 CD2 TRP A 140 113.416 -0.862 -12.700 1.00 0.00 C ATOM 2089 NE1 TRP A 140 111.956 -1.920 -13.982 1.00 0.00 N ATOM 2090 CE2 TRP A 140 113.269 -1.979 -13.559 1.00 0.00 C ATOM 2091 CE3 TRP A 140 114.669 -0.647 -12.101 1.00 0.00 C ATOM 2092 CZ2 TRP A 140 114.333 -2.849 -13.815 1.00 0.00 C ATOM 2093 CZ3 TRP A 140 115.738 -1.519 -12.355 1.00 0.00 C ATOM 2094 CH2 TRP A 140 115.572 -2.618 -13.209 1.00 0.00 C ATOM 0 H TRP A 140 111.687 2.786 -9.787 1.00 0.00 H new ATOM 0 HA TRP A 140 110.571 0.095 -10.408 1.00 0.00 H new ATOM 0 HB2 TRP A 140 110.978 1.593 -12.375 1.00 0.00 H new ATOM 0 HB3 TRP A 140 112.652 1.754 -11.881 1.00 0.00 H new ATOM 0 HD1 TRP A 140 110.255 -0.586 -13.612 1.00 0.00 H new ATOM 0 HE1 TRP A 140 111.530 -2.591 -14.621 1.00 0.00 H new ATOM 0 HE3 TRP A 140 114.810 0.196 -11.440 1.00 0.00 H new ATOM 0 HZ2 TRP A 140 114.199 -3.693 -14.476 1.00 0.00 H new ATOM 0 HZ3 TRP A 140 116.696 -1.342 -11.889 1.00 0.00 H new ATOM 0 HH2 TRP A 140 116.400 -3.285 -13.399 1.00 0.00 H new ATOM 2105 N ILE A 141 112.440 -0.985 -9.152 1.00 0.00 N ATOM 2106 CA ILE A 141 113.468 -1.575 -8.296 1.00 0.00 C ATOM 2107 C ILE A 141 113.912 -2.938 -8.825 1.00 0.00 C ATOM 2108 O ILE A 141 113.093 -3.757 -9.239 1.00 0.00 O ATOM 2109 CB ILE A 141 112.923 -1.702 -6.867 1.00 0.00 C ATOM 2110 CG1 ILE A 141 114.009 -2.254 -5.935 1.00 0.00 C ATOM 2111 CG2 ILE A 141 111.713 -2.640 -6.846 1.00 0.00 C ATOM 2112 CD1 ILE A 141 113.613 -1.998 -4.480 1.00 0.00 C ATOM 0 H ILE A 141 111.633 -1.585 -9.323 1.00 0.00 H new ATOM 0 HA ILE A 141 114.342 -0.924 -8.295 1.00 0.00 H new ATOM 0 HB ILE A 141 112.620 -0.713 -6.523 1.00 0.00 H new ATOM 0 HG12 ILE A 141 114.139 -3.323 -6.105 1.00 0.00 H new ATOM 0 HG13 ILE A 141 114.965 -1.778 -6.152 1.00 0.00 H new ATOM 0 HG21 ILE A 141 111.334 -2.723 -5.827 1.00 0.00 H new ATOM 0 HG22 ILE A 141 110.931 -2.240 -7.492 1.00 0.00 H new ATOM 0 HG23 ILE A 141 112.011 -3.626 -7.204 1.00 0.00 H new ATOM 0 HD11 ILE A 141 114.385 -2.391 -3.818 1.00 0.00 H new ATOM 0 HD12 ILE A 141 113.505 -0.926 -4.316 1.00 0.00 H new ATOM 0 HD13 ILE A 141 112.666 -2.495 -4.268 1.00 0.00 H new ATOM 2124 N ALA A 142 115.221 -3.160 -8.802 1.00 0.00 N ATOM 2125 CA ALA A 142 115.778 -4.460 -9.163 1.00 0.00 C ATOM 2126 C ALA A 142 116.945 -4.789 -8.238 1.00 0.00 C ATOM 2127 O ALA A 142 117.693 -3.889 -7.847 1.00 0.00 O ATOM 2128 CB ALA A 142 116.258 -4.443 -10.614 1.00 0.00 C ATOM 0 H ALA A 142 115.915 -2.460 -8.538 1.00 0.00 H new ATOM 0 HA ALA A 142 115.004 -5.221 -9.057 1.00 0.00 H new ATOM 0 HB1 ALA A 142 116.671 -5.418 -10.872 1.00 0.00 H new ATOM 0 HB2 ALA A 142 115.419 -4.219 -11.272 1.00 0.00 H new ATOM 0 HB3 ALA A 142 117.027 -3.680 -10.734 1.00 0.00 H new ATOM 2134 N GLY A 143 117.093 -6.064 -7.880 1.00 0.00 N ATOM 2135 CA GLY A 143 118.162 -6.451 -6.964 1.00 0.00 C ATOM 2136 C GLY A 143 118.537 -7.920 -7.105 1.00 0.00 C ATOM 2137 O GLY A 143 117.972 -8.643 -7.924 1.00 0.00 O ATOM 0 H GLY A 143 116.501 -6.830 -8.202 1.00 0.00 H new ATOM 0 HA2 GLY A 143 119.041 -5.834 -7.152 1.00 0.00 H new ATOM 0 HA3 GLY A 143 117.848 -6.255 -5.939 1.00 0.00 H new ATOM 2141 N VAL A 144 119.476 -8.351 -6.271 1.00 0.00 N ATOM 2142 CA VAL A 144 119.963 -9.725 -6.303 1.00 0.00 C ATOM 2143 C VAL A 144 120.092 -10.247 -4.875 1.00 0.00 C ATOM 2144 O VAL A 144 120.344 -9.472 -3.955 1.00 0.00 O ATOM 2145 CB VAL A 144 121.311 -9.785 -7.033 1.00 0.00 C ATOM 2146 CG1 VAL A 144 122.354 -8.941 -6.294 1.00 0.00 C ATOM 2147 CG2 VAL A 144 121.793 -11.236 -7.107 1.00 0.00 C ATOM 0 H VAL A 144 119.917 -7.766 -5.561 1.00 0.00 H new ATOM 0 HA VAL A 144 119.257 -10.355 -6.844 1.00 0.00 H new ATOM 0 HB VAL A 144 121.181 -9.389 -8.040 1.00 0.00 H new ATOM 0 HG11 VAL A 144 123.305 -8.993 -6.823 1.00 0.00 H new ATOM 0 HG12 VAL A 144 122.019 -7.905 -6.251 1.00 0.00 H new ATOM 0 HG13 VAL A 144 122.481 -9.324 -5.281 1.00 0.00 H new ATOM 0 HG21 VAL A 144 122.751 -11.275 -7.626 1.00 0.00 H new ATOM 0 HG22 VAL A 144 121.910 -11.632 -6.098 1.00 0.00 H new ATOM 0 HG23 VAL A 144 121.062 -11.835 -7.649 1.00 0.00 H new ATOM 2157 N GLY A 145 119.898 -11.550 -4.690 1.00 0.00 N ATOM 2158 CA GLY A 145 119.934 -12.126 -3.349 1.00 0.00 C ATOM 2159 C GLY A 145 120.622 -13.485 -3.340 1.00 0.00 C ATOM 2160 O GLY A 145 120.740 -14.141 -4.375 1.00 0.00 O ATOM 0 H GLY A 145 119.717 -12.218 -5.439 1.00 0.00 H new ATOM 0 HA2 GLY A 145 120.458 -11.448 -2.675 1.00 0.00 H new ATOM 0 HA3 GLY A 145 118.917 -12.230 -2.970 1.00 0.00 H new ATOM 2164 N TYR A 146 121.055 -13.897 -2.152 1.00 0.00 N ATOM 2165 CA TYR A 146 121.772 -15.155 -1.984 1.00 0.00 C ATOM 2166 C TYR A 146 121.121 -15.982 -0.881 1.00 0.00 C ATOM 2167 O TYR A 146 120.640 -15.431 0.109 1.00 0.00 O ATOM 2168 CB TYR A 146 123.233 -14.880 -1.626 1.00 0.00 C ATOM 2169 CG TYR A 146 123.960 -14.059 -2.665 1.00 0.00 C ATOM 2170 CD1 TYR A 146 124.489 -14.679 -3.804 1.00 0.00 C ATOM 2171 CD2 TYR A 146 124.108 -12.678 -2.489 1.00 0.00 C ATOM 2172 CE1 TYR A 146 125.163 -13.919 -4.766 1.00 0.00 C ATOM 2173 CE2 TYR A 146 124.782 -11.917 -3.452 1.00 0.00 C ATOM 2174 CZ TYR A 146 125.309 -12.537 -4.590 1.00 0.00 C ATOM 2175 OH TYR A 146 125.974 -11.787 -5.538 1.00 0.00 O ATOM 0 H TYR A 146 120.920 -13.373 -1.287 1.00 0.00 H new ATOM 0 HA TYR A 146 121.731 -15.711 -2.920 1.00 0.00 H new ATOM 0 HB2 TYR A 146 123.273 -14.360 -0.669 1.00 0.00 H new ATOM 0 HB3 TYR A 146 123.752 -15.829 -1.495 1.00 0.00 H new ATOM 0 HD1 TYR A 146 124.377 -15.745 -3.940 1.00 0.00 H new ATOM 0 HD2 TYR A 146 123.702 -12.199 -1.610 1.00 0.00 H new ATOM 0 HE1 TYR A 146 125.571 -14.398 -5.644 1.00 0.00 H new ATOM 0 HE2 TYR A 146 124.895 -10.852 -3.316 1.00 0.00 H new ATOM 0 HH TYR A 146 125.985 -10.847 -5.263 1.00 0.00 H new ATOM 2185 N ARG A 147 121.088 -17.297 -1.072 1.00 0.00 N ATOM 2186 CA ARG A 147 120.505 -18.197 -0.081 1.00 0.00 C ATOM 2187 C ARG A 147 121.598 -18.994 0.623 1.00 0.00 C ATOM 2188 O ARG A 147 122.521 -19.501 -0.017 1.00 0.00 O ATOM 2189 CB ARG A 147 119.532 -19.159 -0.765 1.00 0.00 C ATOM 2190 CG ARG A 147 118.805 -19.992 0.293 1.00 0.00 C ATOM 2191 CD ARG A 147 117.761 -20.885 -0.381 1.00 0.00 C ATOM 2192 NE ARG A 147 118.414 -21.938 -1.165 1.00 0.00 N ATOM 2193 CZ ARG A 147 118.736 -21.807 -2.461 1.00 0.00 C ATOM 2194 NH1 ARG A 147 118.518 -20.700 -3.129 1.00 0.00 N ATOM 2195 NH2 ARG A 147 119.294 -22.815 -3.076 1.00 0.00 N ATOM 0 H ARG A 147 121.457 -17.763 -1.901 1.00 0.00 H new ATOM 0 HA ARG A 147 119.970 -17.601 0.659 1.00 0.00 H new ATOM 0 HB2 ARG A 147 118.811 -18.600 -1.361 1.00 0.00 H new ATOM 0 HB3 ARG A 147 120.072 -19.813 -1.449 1.00 0.00 H new ATOM 0 HG2 ARG A 147 119.520 -20.604 0.843 1.00 0.00 H new ATOM 0 HG3 ARG A 147 118.323 -19.336 1.018 1.00 0.00 H new ATOM 0 HD2 ARG A 147 117.115 -21.333 0.374 1.00 0.00 H new ATOM 0 HD3 ARG A 147 117.123 -20.284 -1.029 1.00 0.00 H new ATOM 0 HE ARG A 147 118.636 -22.818 -0.700 1.00 0.00 H new ATOM 0 HH11 ARG A 147 118.089 -19.900 -2.664 1.00 0.00 H new ATOM 0 HH12 ARG A 147 118.777 -20.639 -4.114 1.00 0.00 H new ATOM 0 HH21 ARG A 147 119.478 -23.682 -2.571 1.00 0.00 H new ATOM 0 HH22 ARG A 147 119.546 -22.735 -4.061 1.00 0.00 H new ATOM 2209 N PHE A 148 121.490 -19.101 1.943 1.00 0.00 N ATOM 2210 CA PHE A 148 122.472 -19.840 2.729 1.00 0.00 C ATOM 2211 C PHE A 148 121.774 -20.721 3.760 1.00 0.00 C ATOM 2212 O PHE A 148 120.732 -20.314 4.247 1.00 0.00 O ATOM 2213 CB PHE A 148 123.409 -18.864 3.445 1.00 0.00 C ATOM 2214 CG PHE A 148 124.242 -18.028 2.503 1.00 0.00 C ATOM 2215 CD1 PHE A 148 125.450 -18.529 2.004 1.00 0.00 C ATOM 2216 CD2 PHE A 148 123.807 -16.749 2.131 1.00 0.00 C ATOM 2217 CE1 PHE A 148 126.223 -17.752 1.131 1.00 0.00 C ATOM 2218 CE2 PHE A 148 124.579 -15.974 1.259 1.00 0.00 C ATOM 2219 CZ PHE A 148 125.788 -16.475 0.760 1.00 0.00 C ATOM 2220 OXT PHE A 148 122.292 -21.788 4.047 1.00 0.00 O ATOM 0 H PHE A 148 120.735 -18.687 2.490 1.00 0.00 H new ATOM 0 HA PHE A 148 123.050 -20.472 2.055 1.00 0.00 H new ATOM 0 HB2 PHE A 148 122.817 -18.203 4.078 1.00 0.00 H new ATOM 0 HB3 PHE A 148 124.072 -19.426 4.103 1.00 0.00 H new ATOM 0 HD1 PHE A 148 125.786 -19.514 2.292 1.00 0.00 H new ATOM 0 HD2 PHE A 148 122.876 -16.362 2.517 1.00 0.00 H new ATOM 0 HE1 PHE A 148 127.154 -18.139 0.745 1.00 0.00 H new ATOM 0 HE2 PHE A 148 124.243 -14.989 0.970 1.00 0.00 H new ATOM 0 HZ PHE A 148 126.385 -15.875 0.089 1.00 0.00 H new TER 2230 PHE A 148