USER MOD reduce.3.24.130724 H: found=0, std=0, add=1200, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1200 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 119 TYR OH : rot 142:sc= 0.273 USER MOD Set 1.2: A 123 LYS NZ :NH3+ -173:sc= 1.52 (180deg=1.05) USER MOD Set 2.1: A 111 GLN : amide:sc= -1.07 K(o=-1.1,f=-4!) USER MOD Set 2.2: A 114 LYS NZ :NH3+ 177:sc= 0.0138 (180deg=0) USER MOD Set 2.3: A 115 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 103 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 107 THR OG1 : rot 79:sc= 1.17 USER MOD Set 4.1: A 22 GLN : amide:sc= 0.725 K(o=1.9,f=-1.8!) USER MOD Set 4.2: A 27 TYR OH : rot -92:sc= 1.2 USER MOD Single : A 1 MET CE :methyl -169:sc=-0.00139 (180deg=-0.149) USER MOD Single : A 1 MET N :NH3+ -177:sc= 0.379 (180deg=-0.0595!) USER MOD Single : A 3 HIS : no HD1:sc= -0.451 X(o=-0.45,f=-0.58) USER MOD Single : A 4 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 6 HIS : no HD1:sc= -0.994 X(o=-0.99,f=-1) USER MOD Single : A 7 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 8 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 9 SER OG : rot 120:sc= 0.742 USER MOD Single : A 10 HIS :FLIP no HD1:sc= -0.304 F(o=-1.3,f=-0.3) USER MOD Single : A 11 MET CE :methyl -170:sc=-0.00732 (180deg=-0.228) USER MOD Single : A 14 HIS : no HD1:sc= -1.49 K(o=-1.5,f=-2.9) USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ -139:sc= -1.76! (180deg=-4.33!) USER MOD Single : A 25 GLN : amide:sc= 0.521 K(o=0.52,f=-0.011) USER MOD Single : A 34 LYS NZ :NH3+ 139:sc= 0.768 (180deg=0.16) USER MOD Single : A 36 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0104) USER MOD Single : A 44 SER OG : rot 180:sc= -2.04! USER MOD Single : A 46 MET CE :methyl 179:sc= -2.6 (180deg=-2.61) USER MOD Single : A 47 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 MET CE :methyl -158:sc= -0.101 (180deg=-0.676) USER MOD Single : A 61 LYS NZ :NH3+ -172:sc=-0.00816 (180deg=-0.0933) USER MOD Single : A 62 GLN : amide:sc= -0.801 K(o=-0.8,f=-5.9!) USER MOD Single : A 68 MET CE :methyl -166:sc= -0.0468 (180deg=-0.313) USER MOD Single : A 70 TYR OH : rot 130:sc= 0.132 USER MOD Single : A 74 THR OG1 : rot -79:sc= 0.912 USER MOD Single : A 76 LYS NZ :NH3+ -140:sc= 1.28 (180deg=0.178) USER MOD Single : A 84 ASN : amide:sc= -0.328 K(o=-0.33,f=-1.2) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 LYS NZ :NH3+ -147:sc= -0.43 (180deg=-1.37!) USER MOD Single : A 92 THR OG1 : rot 180:sc= -0.146 USER MOD Single : A 93 LYS NZ :NH3+ 175:sc=-0.00421 (180deg=-0.0667) USER MOD Single : A 96 ASN : amide:sc= -0.111 X(o=-0.11,f=-0.41) USER MOD Single : A 99 THR OG1 : rot -8:sc= 0.621 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 81:sc= 2.2 USER MOD Single : A 112 TYR OH : rot 180:sc= 0 USER MOD Single : A 113 MET CE :methyl -166:sc= -4.6! (180deg=-5.15!) USER MOD Single : A 117 TYR OH : rot 30:sc= -0.717 USER MOD Single : A 121 CYS SG : rot -24:sc= 0.00482 USER MOD Single : A 127 SER OG : rot -53:sc= 0.39 USER MOD Single : A 128 ASN : amide:sc= 0.555 K(o=0.55,f=0) USER MOD Single : A 130 ASN : amide:sc= 0 K(o=0,f=-0.88) USER MOD Single : A 133 GLN : amide:sc= 0.721 K(o=0.72,f=-0.02) USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 139 ASN : amide:sc= -1.63! C(o=-1.6!,f=-7.4!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 26.585 -0.001 -21.117 1.00 4.02 N ATOM 2 CA MET A 1 25.462 0.929 -20.804 1.00 61.33 C ATOM 3 C MET A 1 24.101 0.334 -21.220 1.00 20.52 C ATOM 4 O MET A 1 23.116 1.061 -21.368 1.00 60.03 O ATOM 5 CB MET A 1 25.682 2.278 -21.512 1.00 74.03 C ATOM 6 CG MET A 1 25.572 2.205 -23.029 1.00 32.23 C ATOM 7 SD MET A 1 26.719 1.018 -23.762 1.00 64.23 S ATOM 8 CE MET A 1 28.294 1.808 -23.438 1.00 0.14 C ATOM 0 H1 MET A 1 27.479 0.408 -20.778 1.00 4.02 H new ATOM 0 H2 MET A 1 26.421 -0.914 -20.646 1.00 4.02 H new ATOM 0 H3 MET A 1 26.639 -0.147 -22.145 1.00 4.02 H new ATOM 0 HA MET A 1 25.446 1.082 -19.725 1.00 61.33 H new ATOM 0 HB2 MET A 1 24.952 2.996 -21.139 1.00 74.03 H new ATOM 0 HB3 MET A 1 26.668 2.659 -21.247 1.00 74.03 H new ATOM 0 HG2 MET A 1 24.552 1.933 -23.301 1.00 32.23 H new ATOM 0 HG3 MET A 1 25.761 3.193 -23.450 1.00 32.23 H new ATOM 0 HE1 MET A 1 29.079 1.298 -23.997 1.00 0.14 H new ATOM 0 HE2 MET A 1 28.248 2.852 -23.747 1.00 0.14 H new ATOM 0 HE3 MET A 1 28.515 1.755 -22.372 1.00 0.14 H new ATOM 20 N GLY A 2 24.050 -0.990 -21.388 1.00 4.13 N ATOM 21 CA GLY A 2 22.830 -1.657 -21.844 1.00 24.50 C ATOM 22 C GLY A 2 21.683 -1.600 -20.838 1.00 71.33 C ATOM 23 O GLY A 2 21.421 -2.570 -20.124 1.00 0.30 O ATOM 0 H GLY A 2 24.835 -1.618 -21.216 1.00 4.13 H new ATOM 0 HA2 GLY A 2 22.504 -1.199 -22.778 1.00 24.50 H new ATOM 0 HA3 GLY A 2 23.058 -2.700 -22.063 1.00 24.50 H new ATOM 27 N HIS A 3 21.005 -0.453 -20.783 1.00 63.43 N ATOM 28 CA HIS A 3 19.843 -0.268 -19.905 1.00 23.14 C ATOM 29 C HIS A 3 18.765 -1.341 -20.151 1.00 71.22 C ATOM 30 O HIS A 3 18.116 -1.365 -21.202 1.00 53.53 O ATOM 31 CB HIS A 3 19.250 1.141 -20.089 1.00 62.43 C ATOM 32 CG HIS A 3 18.893 1.476 -21.509 1.00 4.43 C ATOM 33 ND1 HIS A 3 17.616 1.362 -22.014 1.00 31.42 N ATOM 34 CD2 HIS A 3 19.656 1.930 -22.533 1.00 24.34 C ATOM 35 CE1 HIS A 3 17.610 1.726 -23.280 1.00 14.13 C ATOM 36 NE2 HIS A 3 18.832 2.076 -23.620 1.00 33.41 N ATOM 0 H HIS A 3 21.241 0.369 -21.339 1.00 63.43 H new ATOM 0 HA HIS A 3 20.187 -0.377 -18.876 1.00 23.14 H new ATOM 0 HB2 HIS A 3 18.357 1.231 -19.470 1.00 62.43 H new ATOM 0 HB3 HIS A 3 19.967 1.876 -19.723 1.00 62.43 H new ATOM 0 HD2 HIS A 3 20.715 2.138 -22.499 1.00 24.34 H new ATOM 0 HE1 HIS A 3 16.747 1.736 -23.930 1.00 14.13 H new ATOM 0 HE2 HIS A 3 19.120 2.403 -24.542 1.00 33.41 H new ATOM 45 N HIS A 4 18.585 -2.227 -19.176 1.00 12.30 N ATOM 46 CA HIS A 4 17.620 -3.326 -19.293 1.00 23.35 C ATOM 47 C HIS A 4 16.188 -2.834 -19.042 1.00 0.25 C ATOM 48 O HIS A 4 15.914 -2.175 -18.040 1.00 2.40 O ATOM 49 CB HIS A 4 17.976 -4.446 -18.308 1.00 43.31 C ATOM 50 CG HIS A 4 19.363 -4.978 -18.496 1.00 74.14 C ATOM 51 ND1 HIS A 4 19.714 -5.822 -19.528 1.00 1.53 N ATOM 52 CD2 HIS A 4 20.498 -4.771 -17.786 1.00 32.44 C ATOM 53 CE1 HIS A 4 20.997 -6.110 -19.442 1.00 31.50 C ATOM 54 NE2 HIS A 4 21.496 -5.486 -18.396 1.00 1.03 N ATOM 0 H HIS A 4 19.094 -2.209 -18.292 1.00 12.30 H new ATOM 0 HA HIS A 4 17.670 -3.715 -20.310 1.00 23.35 H new ATOM 0 HB2 HIS A 4 17.872 -4.072 -17.289 1.00 43.31 H new ATOM 0 HB3 HIS A 4 17.262 -5.262 -18.422 1.00 43.31 H new ATOM 0 HD2 HIS A 4 20.598 -4.157 -16.903 1.00 32.44 H new ATOM 0 HE1 HIS A 4 21.547 -6.750 -20.116 1.00 31.50 H new ATOM 0 HE2 HIS A 4 22.468 -5.528 -18.089 1.00 1.03 H new ATOM 63 N HIS A 5 15.279 -3.170 -19.956 1.00 72.33 N ATOM 64 CA HIS A 5 13.899 -2.682 -19.893 1.00 11.30 C ATOM 65 C HIS A 5 13.099 -3.356 -18.757 1.00 63.32 C ATOM 66 O HIS A 5 12.571 -2.673 -17.881 1.00 30.45 O ATOM 67 CB HIS A 5 13.210 -2.895 -21.250 1.00 11.44 C ATOM 68 CG HIS A 5 11.827 -2.324 -21.346 1.00 51.05 C ATOM 69 ND1 HIS A 5 10.830 -2.896 -22.106 1.00 65.41 N ATOM 70 CD2 HIS A 5 11.280 -1.213 -20.794 1.00 43.12 C ATOM 71 CE1 HIS A 5 9.736 -2.169 -22.021 1.00 51.11 C ATOM 72 NE2 HIS A 5 9.979 -1.144 -21.229 1.00 44.51 N ATOM 0 H HIS A 5 15.472 -3.779 -20.751 1.00 72.33 H new ATOM 0 HA HIS A 5 13.928 -1.616 -19.669 1.00 11.30 H new ATOM 0 HB2 HIS A 5 13.828 -2.449 -22.030 1.00 11.44 H new ATOM 0 HB3 HIS A 5 13.162 -3.965 -21.454 1.00 11.44 H new ATOM 0 HD2 HIS A 5 11.774 -0.514 -20.136 1.00 43.12 H new ATOM 0 HE1 HIS A 5 8.799 -2.377 -22.516 1.00 51.11 H new ATOM 0 HE2 HIS A 5 9.309 -0.417 -20.979 1.00 44.51 H new ATOM 81 N HIS A 6 13.003 -4.693 -18.776 1.00 50.22 N ATOM 82 CA HIS A 6 12.261 -5.439 -17.735 1.00 71.02 C ATOM 83 C HIS A 6 12.668 -6.923 -17.669 1.00 32.14 C ATOM 84 O HIS A 6 13.050 -7.528 -18.670 1.00 62.33 O ATOM 85 CB HIS A 6 10.739 -5.355 -17.956 1.00 11.04 C ATOM 86 CG HIS A 6 10.131 -4.038 -17.573 1.00 5.53 C ATOM 87 ND1 HIS A 6 10.130 -3.555 -16.282 1.00 22.11 N ATOM 88 CD2 HIS A 6 9.511 -3.096 -18.321 1.00 53.32 C ATOM 89 CE1 HIS A 6 9.537 -2.380 -16.253 1.00 71.42 C ATOM 90 NE2 HIS A 6 9.152 -2.078 -17.477 1.00 50.12 N ATOM 0 H HIS A 6 13.425 -5.282 -19.494 1.00 50.22 H new ATOM 0 HA HIS A 6 12.523 -4.963 -16.790 1.00 71.02 H new ATOM 0 HB2 HIS A 6 10.525 -5.549 -19.007 1.00 11.04 H new ATOM 0 HB3 HIS A 6 10.256 -6.146 -17.382 1.00 11.04 H new ATOM 0 HD2 HIS A 6 9.332 -3.139 -19.385 1.00 53.32 H new ATOM 0 HE1 HIS A 6 9.391 -1.768 -15.376 1.00 71.42 H new ATOM 0 HE2 HIS A 6 8.666 -1.225 -17.751 1.00 50.12 H new ATOM 99 N HIS A 7 12.568 -7.500 -16.469 1.00 71.25 N ATOM 100 CA HIS A 7 12.800 -8.938 -16.258 1.00 25.33 C ATOM 101 C HIS A 7 11.787 -9.522 -15.258 1.00 34.35 C ATOM 102 O HIS A 7 11.220 -8.800 -14.439 1.00 22.42 O ATOM 103 CB HIS A 7 14.224 -9.196 -15.736 1.00 53.51 C ATOM 104 CG HIS A 7 15.308 -8.920 -16.734 1.00 61.40 C ATOM 105 ND1 HIS A 7 16.329 -8.021 -16.511 1.00 34.31 N ATOM 106 CD2 HIS A 7 15.545 -9.456 -17.953 1.00 15.21 C ATOM 107 CE1 HIS A 7 17.141 -8.014 -17.548 1.00 75.12 C ATOM 108 NE2 HIS A 7 16.691 -8.877 -18.437 1.00 63.12 N ATOM 0 H HIS A 7 12.326 -6.991 -15.619 1.00 71.25 H new ATOM 0 HA HIS A 7 12.675 -9.428 -17.223 1.00 25.33 H new ATOM 0 HB2 HIS A 7 14.392 -8.578 -14.854 1.00 53.51 H new ATOM 0 HB3 HIS A 7 14.298 -10.235 -15.415 1.00 53.51 H new ATOM 0 HD2 HIS A 7 14.944 -10.201 -18.453 1.00 15.21 H new ATOM 0 HE1 HIS A 7 18.026 -7.404 -17.652 1.00 75.12 H new ATOM 0 HE2 HIS A 7 17.124 -9.081 -19.338 1.00 63.12 H new ATOM 117 N HIS A 8 11.562 -10.831 -15.339 1.00 64.34 N ATOM 118 CA HIS A 8 10.724 -11.543 -14.363 1.00 63.03 C ATOM 119 C HIS A 8 11.548 -12.563 -13.561 1.00 5.41 C ATOM 120 O HIS A 8 12.582 -13.050 -14.025 1.00 63.02 O ATOM 121 CB HIS A 8 9.548 -12.249 -15.056 1.00 72.03 C ATOM 122 CG HIS A 8 8.453 -11.318 -15.490 1.00 73.22 C ATOM 123 ND1 HIS A 8 8.012 -11.218 -16.790 1.00 31.40 N ATOM 124 CD2 HIS A 8 7.678 -10.467 -14.772 1.00 12.12 C ATOM 125 CE1 HIS A 8 7.023 -10.349 -16.854 1.00 32.41 C ATOM 126 NE2 HIS A 8 6.797 -9.879 -15.644 1.00 34.23 N ATOM 0 H HIS A 8 11.948 -11.427 -16.072 1.00 64.34 H new ATOM 0 HA HIS A 8 10.327 -10.799 -13.672 1.00 63.03 H new ATOM 0 HB2 HIS A 8 9.922 -12.787 -15.927 1.00 72.03 H new ATOM 0 HB3 HIS A 8 9.132 -12.993 -14.377 1.00 72.03 H new ATOM 0 HD2 HIS A 8 7.743 -10.286 -13.709 1.00 12.12 H new ATOM 0 HE1 HIS A 8 6.487 -10.069 -17.749 1.00 32.41 H new ATOM 0 HE2 HIS A 8 6.085 -9.192 -15.397 1.00 34.23 H new ATOM 135 N SER A 9 11.079 -12.892 -12.362 1.00 14.34 N ATOM 136 CA SER A 9 11.791 -13.827 -11.479 1.00 45.15 C ATOM 137 C SER A 9 11.545 -15.291 -11.879 1.00 61.33 C ATOM 138 O SER A 9 10.544 -15.898 -11.495 1.00 54.43 O ATOM 139 CB SER A 9 11.382 -13.606 -10.011 1.00 14.13 C ATOM 140 OG SER A 9 9.991 -13.816 -9.818 1.00 74.33 O ATOM 0 H SER A 9 10.209 -12.528 -11.973 1.00 14.34 H new ATOM 0 HA SER A 9 12.857 -13.625 -11.587 1.00 45.15 H new ATOM 0 HB2 SER A 9 11.945 -14.284 -9.370 1.00 14.13 H new ATOM 0 HB3 SER A 9 11.643 -12.592 -9.709 1.00 14.13 H new ATOM 0 HG SER A 9 9.856 -14.540 -9.171 1.00 74.33 H new ATOM 146 N HIS A 10 12.464 -15.860 -12.657 1.00 34.24 N ATOM 147 CA HIS A 10 12.356 -17.262 -13.086 1.00 51.22 C ATOM 148 C HIS A 10 12.859 -18.211 -11.984 1.00 0.42 C ATOM 149 O HIS A 10 13.864 -18.911 -12.139 1.00 11.31 O ATOM 150 CB HIS A 10 13.123 -17.480 -14.403 1.00 25.24 C ATOM 151 CG HIS A 10 14.593 -17.184 -14.325 1.00 62.53 C ATOM 152 ND1 HIS A 10 15.260 -16.019 -14.138 1.00 74.04 N flip ATOM 153 CD2 HIS A 10 15.563 -18.151 -14.465 1.00 35.52 C flip ATOM 154 CE1 HIS A 10 16.599 -16.309 -14.170 1.00 0.04 C flip ATOM 155 NE2 HIS A 10 16.755 -17.599 -14.367 1.00 51.02 N flip ATOM 0 H HIS A 10 13.292 -15.377 -13.005 1.00 34.24 H new ATOM 0 HA HIS A 10 11.305 -17.490 -13.264 1.00 51.22 H new ATOM 0 HB2 HIS A 10 12.990 -18.515 -14.719 1.00 25.24 H new ATOM 0 HB3 HIS A 10 12.679 -16.851 -15.175 1.00 25.24 H new ATOM 0 HD2 HIS A 10 15.375 -19.202 -14.630 1.00 35.52 H new ATOM 0 HE1 HIS A 10 17.398 -15.592 -14.052 1.00 0.04 H new ATOM 0 HE2 HIS A 10 17.647 -18.089 -14.433 1.00 51.02 H new ATOM 164 N MET A 11 12.144 -18.224 -10.864 1.00 72.02 N ATOM 165 CA MET A 11 12.567 -18.970 -9.676 1.00 64.22 C ATOM 166 C MET A 11 11.374 -19.234 -8.742 1.00 25.13 C ATOM 167 O MET A 11 10.340 -18.575 -8.849 1.00 23.42 O ATOM 168 CB MET A 11 13.657 -18.171 -8.941 1.00 63.23 C ATOM 169 CG MET A 11 13.190 -16.800 -8.460 1.00 3.33 C ATOM 170 SD MET A 11 14.553 -15.743 -7.925 1.00 54.13 S ATOM 171 CE MET A 11 15.245 -16.720 -6.595 1.00 53.52 C ATOM 0 H MET A 11 11.262 -17.724 -10.750 1.00 72.02 H new ATOM 0 HA MET A 11 12.968 -19.935 -9.985 1.00 64.22 H new ATOM 0 HB2 MET A 11 14.004 -18.749 -8.084 1.00 63.23 H new ATOM 0 HB3 MET A 11 14.511 -18.042 -9.605 1.00 63.23 H new ATOM 0 HG2 MET A 11 12.646 -16.304 -9.264 1.00 3.33 H new ATOM 0 HG3 MET A 11 12.491 -16.929 -7.634 1.00 3.33 H new ATOM 0 HE1 MET A 11 15.979 -16.126 -6.050 1.00 53.52 H new ATOM 0 HE2 MET A 11 14.449 -17.025 -5.916 1.00 53.52 H new ATOM 0 HE3 MET A 11 15.729 -17.605 -7.008 1.00 53.52 H new ATOM 181 N PRO A 12 11.479 -20.212 -7.824 1.00 11.13 N ATOM 182 CA PRO A 12 10.423 -20.472 -6.839 1.00 51.23 C ATOM 183 C PRO A 12 10.403 -19.431 -5.700 1.00 74.34 C ATOM 184 O PRO A 12 10.851 -19.704 -4.584 1.00 52.12 O ATOM 185 CB PRO A 12 10.756 -21.884 -6.300 1.00 1.11 C ATOM 186 CG PRO A 12 11.894 -22.386 -7.140 1.00 31.12 C ATOM 187 CD PRO A 12 12.588 -21.165 -7.683 1.00 22.10 C ATOM 0 HA PRO A 12 9.431 -20.407 -7.286 1.00 51.23 H new ATOM 0 HB2 PRO A 12 11.035 -21.845 -5.247 1.00 1.11 H new ATOM 0 HB3 PRO A 12 9.893 -22.545 -6.376 1.00 1.11 H new ATOM 0 HG2 PRO A 12 12.579 -22.991 -6.546 1.00 31.12 H new ATOM 0 HG3 PRO A 12 11.530 -23.019 -7.949 1.00 31.12 H new ATOM 0 HD2 PRO A 12 13.356 -20.797 -7.003 1.00 22.10 H new ATOM 0 HD3 PRO A 12 13.076 -21.365 -8.637 1.00 22.10 H new ATOM 195 N ASP A 13 9.922 -18.222 -5.999 1.00 21.21 N ATOM 196 CA ASP A 13 9.750 -17.183 -4.975 1.00 14.11 C ATOM 197 C ASP A 13 8.309 -17.181 -4.435 1.00 65.25 C ATOM 198 O ASP A 13 8.074 -16.968 -3.244 1.00 20.20 O ATOM 199 CB ASP A 13 10.110 -15.803 -5.548 1.00 72.13 C ATOM 200 CG ASP A 13 9.232 -15.411 -6.723 1.00 44.44 C ATOM 201 OD1 ASP A 13 9.502 -15.870 -7.849 1.00 71.34 O ATOM 202 OD2 ASP A 13 8.254 -14.661 -6.522 1.00 51.45 O ATOM 0 H ASP A 13 9.645 -17.937 -6.938 1.00 21.21 H new ATOM 0 HA ASP A 13 10.424 -17.404 -4.147 1.00 14.11 H new ATOM 0 HB2 ASP A 13 10.017 -15.052 -4.763 1.00 72.13 H new ATOM 0 HB3 ASP A 13 11.153 -15.806 -5.864 1.00 72.13 H new ATOM 207 N HIS A 14 7.355 -17.430 -5.327 1.00 33.30 N ATOM 208 CA HIS A 14 5.935 -17.476 -4.971 1.00 51.22 C ATOM 209 C HIS A 14 5.618 -18.723 -4.121 1.00 23.31 C ATOM 210 O HIS A 14 5.362 -19.800 -4.655 1.00 73.45 O ATOM 211 CB HIS A 14 5.090 -17.460 -6.254 1.00 2.22 C ATOM 212 CG HIS A 14 3.612 -17.466 -6.019 1.00 22.34 C ATOM 213 ND1 HIS A 14 2.795 -18.490 -6.432 1.00 54.02 N ATOM 214 CD2 HIS A 14 2.800 -16.556 -5.432 1.00 51.43 C ATOM 215 CE1 HIS A 14 1.550 -18.212 -6.114 1.00 72.22 C ATOM 216 NE2 HIS A 14 1.518 -17.044 -5.501 1.00 63.51 N ATOM 0 H HIS A 14 7.540 -17.605 -6.315 1.00 33.30 H new ATOM 0 HA HIS A 14 5.691 -16.601 -4.369 1.00 51.22 H new ATOM 0 HB2 HIS A 14 5.350 -16.575 -6.835 1.00 2.22 H new ATOM 0 HB3 HIS A 14 5.353 -18.328 -6.859 1.00 2.22 H new ATOM 0 HD2 HIS A 14 3.104 -15.618 -4.991 1.00 51.43 H new ATOM 0 HE1 HIS A 14 0.694 -18.837 -6.321 1.00 72.22 H new ATOM 0 HE2 HIS A 14 0.683 -16.582 -5.140 1.00 63.51 H new ATOM 225 N GLY A 15 5.637 -18.553 -2.801 1.00 52.43 N ATOM 226 CA GLY A 15 5.485 -19.676 -1.873 1.00 70.45 C ATOM 227 C GLY A 15 4.224 -20.520 -2.078 1.00 64.34 C ATOM 228 O GLY A 15 4.287 -21.754 -2.069 1.00 11.22 O ATOM 0 H GLY A 15 5.756 -17.647 -2.347 1.00 52.43 H new ATOM 0 HA2 GLY A 15 6.357 -20.324 -1.965 1.00 70.45 H new ATOM 0 HA3 GLY A 15 5.482 -19.288 -0.854 1.00 70.45 H new ATOM 232 N ASP A 16 3.079 -19.868 -2.248 1.00 12.21 N ATOM 233 CA ASP A 16 1.799 -20.573 -2.379 1.00 64.15 C ATOM 234 C ASP A 16 1.621 -21.215 -3.771 1.00 45.03 C ATOM 235 O ASP A 16 1.040 -20.623 -4.681 1.00 14.25 O ATOM 236 CB ASP A 16 0.634 -19.622 -2.055 1.00 33.10 C ATOM 237 CG ASP A 16 0.687 -18.320 -2.849 1.00 34.32 C ATOM 238 OD1 ASP A 16 1.682 -17.579 -2.719 1.00 12.21 O ATOM 239 OD2 ASP A 16 -0.257 -18.041 -3.624 1.00 32.51 O ATOM 0 H ASP A 16 3.006 -18.852 -2.299 1.00 12.21 H new ATOM 0 HA ASP A 16 1.799 -21.390 -1.658 1.00 64.15 H new ATOM 0 HB2 ASP A 16 -0.309 -20.128 -2.261 1.00 33.10 H new ATOM 0 HB3 ASP A 16 0.646 -19.392 -0.990 1.00 33.10 H new ATOM 244 N TRP A 17 2.141 -22.429 -3.935 1.00 12.30 N ATOM 245 CA TRP A 17 1.975 -23.181 -5.187 1.00 65.04 C ATOM 246 C TRP A 17 0.681 -24.011 -5.176 1.00 63.25 C ATOM 247 O TRP A 17 0.167 -24.396 -6.228 1.00 12.21 O ATOM 248 CB TRP A 17 3.189 -24.087 -5.432 1.00 34.21 C ATOM 249 CG TRP A 17 4.466 -23.322 -5.634 1.00 2.13 C ATOM 250 CD1 TRP A 17 5.500 -23.191 -4.749 1.00 0.51 C ATOM 251 CD2 TRP A 17 4.832 -22.566 -6.794 1.00 33.11 C ATOM 252 NE1 TRP A 17 6.491 -22.411 -5.295 1.00 22.24 N ATOM 253 CE2 TRP A 17 6.102 -22.012 -6.550 1.00 25.02 C ATOM 254 CE3 TRP A 17 4.205 -22.306 -8.019 1.00 45.13 C ATOM 255 CZ2 TRP A 17 6.756 -21.213 -7.486 1.00 72.44 C ATOM 256 CZ3 TRP A 17 4.857 -21.516 -8.947 1.00 71.11 C ATOM 257 CH2 TRP A 17 6.121 -20.978 -8.676 1.00 24.12 C ATOM 0 H TRP A 17 2.681 -22.917 -3.220 1.00 12.30 H new ATOM 0 HA TRP A 17 1.902 -22.460 -6.002 1.00 65.04 H new ATOM 0 HB2 TRP A 17 3.307 -24.762 -4.585 1.00 34.21 H new ATOM 0 HB3 TRP A 17 3.001 -24.706 -6.309 1.00 34.21 H new ATOM 0 HD1 TRP A 17 5.533 -23.635 -3.765 1.00 0.51 H new ATOM 0 HE1 TRP A 17 7.372 -22.168 -4.842 1.00 22.24 H new ATOM 0 HE3 TRP A 17 3.229 -22.716 -8.235 1.00 45.13 H new ATOM 0 HZ2 TRP A 17 7.730 -20.794 -7.280 1.00 72.44 H new ATOM 0 HZ3 TRP A 17 4.384 -21.310 -9.896 1.00 71.11 H new ATOM 0 HH2 TRP A 17 6.605 -20.365 -9.421 1.00 24.12 H new ATOM 268 N THR A 18 0.159 -24.291 -3.984 1.00 2.34 N ATOM 269 CA THR A 18 -1.137 -24.971 -3.848 1.00 24.24 C ATOM 270 C THR A 18 -2.282 -24.067 -4.325 1.00 73.23 C ATOM 271 O THR A 18 -2.136 -22.842 -4.399 1.00 52.02 O ATOM 272 CB THR A 18 -1.419 -25.399 -2.383 1.00 72.15 C ATOM 273 OG1 THR A 18 -1.456 -24.247 -1.524 1.00 32.30 O ATOM 274 CG2 THR A 18 -0.357 -26.374 -1.877 1.00 13.25 C ATOM 0 H THR A 18 0.608 -24.060 -3.098 1.00 2.34 H new ATOM 0 HA THR A 18 -1.084 -25.864 -4.470 1.00 24.24 H new ATOM 0 HB THR A 18 -2.388 -25.899 -2.366 1.00 72.15 H new ATOM 0 HG1 THR A 18 -1.636 -24.531 -0.604 1.00 32.30 H new ATOM 0 HG21 THR A 18 -0.582 -26.655 -0.848 1.00 13.25 H new ATOM 0 HG22 THR A 18 -0.353 -27.265 -2.504 1.00 13.25 H new ATOM 0 HG23 THR A 18 0.623 -25.898 -1.917 1.00 13.25 H new ATOM 282 N TYR A 19 -3.419 -24.665 -4.662 1.00 34.40 N ATOM 283 CA TYR A 19 -4.583 -23.895 -5.110 1.00 4.24 C ATOM 284 C TYR A 19 -5.277 -23.182 -3.934 1.00 62.11 C ATOM 285 O TYR A 19 -6.248 -23.684 -3.365 1.00 62.03 O ATOM 286 CB TYR A 19 -5.575 -24.795 -5.866 1.00 25.44 C ATOM 287 CG TYR A 19 -5.096 -25.192 -7.256 1.00 11.40 C ATOM 288 CD1 TYR A 19 -4.076 -26.122 -7.429 1.00 14.32 C ATOM 289 CD2 TYR A 19 -5.663 -24.626 -8.395 1.00 73.01 C ATOM 290 CE1 TYR A 19 -3.634 -26.473 -8.693 1.00 4.33 C ATOM 291 CE2 TYR A 19 -5.230 -24.974 -9.662 1.00 61.41 C ATOM 292 CZ TYR A 19 -4.214 -25.896 -9.806 1.00 12.54 C ATOM 293 OH TYR A 19 -3.775 -26.239 -11.069 1.00 2.52 O ATOM 0 H TYR A 19 -3.564 -25.674 -4.635 1.00 34.40 H new ATOM 0 HA TYR A 19 -4.225 -23.127 -5.795 1.00 4.24 H new ATOM 0 HB2 TYR A 19 -5.754 -25.697 -5.281 1.00 25.44 H new ATOM 0 HB3 TYR A 19 -6.530 -24.277 -5.953 1.00 25.44 H new ATOM 0 HD1 TYR A 19 -3.621 -26.578 -6.562 1.00 14.32 H new ATOM 0 HD2 TYR A 19 -6.456 -23.901 -8.287 1.00 73.01 H new ATOM 0 HE1 TYR A 19 -2.839 -27.195 -8.808 1.00 4.33 H new ATOM 0 HE2 TYR A 19 -5.685 -24.526 -10.533 1.00 61.41 H new ATOM 0 HH TYR A 19 -4.289 -25.743 -11.740 1.00 2.52 H new ATOM 303 N GLU A 20 -4.732 -22.026 -3.553 1.00 62.32 N ATOM 304 CA GLU A 20 -5.324 -21.176 -2.511 1.00 74.12 C ATOM 305 C GLU A 20 -5.051 -19.694 -2.809 1.00 3.14 C ATOM 306 O GLU A 20 -3.900 -19.260 -2.864 1.00 62.45 O ATOM 307 CB GLU A 20 -4.789 -21.561 -1.121 1.00 21.22 C ATOM 308 CG GLU A 20 -5.326 -20.688 0.016 1.00 12.02 C ATOM 309 CD GLU A 20 -5.021 -21.249 1.401 1.00 53.14 C ATOM 310 OE1 GLU A 20 -3.847 -21.581 1.673 1.00 20.45 O ATOM 311 OE2 GLU A 20 -5.955 -21.360 2.228 1.00 22.14 O ATOM 0 H GLU A 20 -3.872 -21.651 -3.954 1.00 62.32 H new ATOM 0 HA GLU A 20 -6.402 -21.334 -2.511 1.00 74.12 H new ATOM 0 HB2 GLU A 20 -5.046 -22.601 -0.919 1.00 21.22 H new ATOM 0 HB3 GLU A 20 -3.701 -21.498 -1.131 1.00 21.22 H new ATOM 0 HG2 GLU A 20 -4.896 -19.690 -0.067 1.00 12.02 H new ATOM 0 HG3 GLU A 20 -6.405 -20.581 -0.096 1.00 12.02 H new ATOM 318 N GLU A 21 -6.125 -18.934 -3.014 1.00 62.44 N ATOM 319 CA GLU A 21 -6.035 -17.527 -3.426 1.00 65.01 C ATOM 320 C GLU A 21 -5.337 -16.641 -2.375 1.00 13.14 C ATOM 321 O GLU A 21 -4.481 -15.821 -2.712 1.00 14.13 O ATOM 322 CB GLU A 21 -7.446 -16.998 -3.729 1.00 33.04 C ATOM 323 CG GLU A 21 -8.172 -17.812 -4.798 1.00 73.45 C ATOM 324 CD GLU A 21 -9.612 -17.375 -5.018 1.00 75.11 C ATOM 325 OE1 GLU A 21 -10.507 -17.868 -4.296 1.00 31.34 O ATOM 326 OE2 GLU A 21 -9.860 -16.555 -5.928 1.00 73.31 O ATOM 0 H GLU A 21 -7.081 -19.271 -2.901 1.00 62.44 H new ATOM 0 HA GLU A 21 -5.418 -17.481 -4.323 1.00 65.01 H new ATOM 0 HB2 GLU A 21 -8.035 -17.005 -2.812 1.00 33.04 H new ATOM 0 HB3 GLU A 21 -7.377 -15.960 -4.055 1.00 33.04 H new ATOM 0 HG2 GLU A 21 -7.628 -17.729 -5.739 1.00 73.45 H new ATOM 0 HG3 GLU A 21 -8.159 -18.864 -4.514 1.00 73.45 H new ATOM 333 N GLN A 22 -5.711 -16.805 -1.107 1.00 51.44 N ATOM 334 CA GLN A 22 -5.112 -16.028 -0.012 1.00 5.01 C ATOM 335 C GLN A 22 -4.904 -16.884 1.252 1.00 30.43 C ATOM 336 O GLN A 22 -5.833 -17.116 2.027 1.00 71.40 O ATOM 337 CB GLN A 22 -5.967 -14.774 0.301 1.00 64.51 C ATOM 338 CG GLN A 22 -7.460 -14.907 -0.031 1.00 52.21 C ATOM 339 CD GLN A 22 -8.150 -16.054 0.693 1.00 53.52 C ATOM 340 OE1 GLN A 22 -8.212 -17.173 0.190 1.00 4.24 O ATOM 341 NE2 GLN A 22 -8.668 -15.793 1.878 1.00 31.32 N ATOM 0 H GLN A 22 -6.426 -17.468 -0.808 1.00 51.44 H new ATOM 0 HA GLN A 22 -4.127 -15.699 -0.344 1.00 5.01 H new ATOM 0 HB2 GLN A 22 -5.865 -14.539 1.360 1.00 64.51 H new ATOM 0 HB3 GLN A 22 -5.561 -13.928 -0.254 1.00 64.51 H new ATOM 0 HG2 GLN A 22 -7.964 -13.974 0.223 1.00 52.21 H new ATOM 0 HG3 GLN A 22 -7.573 -15.048 -1.106 1.00 52.21 H new ATOM 0 HE21 GLN A 22 -8.600 -14.853 2.269 1.00 31.32 H new ATOM 0 HE22 GLN A 22 -9.136 -16.531 2.404 1.00 31.32 H new ATOM 350 N PHE A 23 -3.673 -17.355 1.459 1.00 12.20 N ATOM 351 CA PHE A 23 -3.363 -18.195 2.624 1.00 71.14 C ATOM 352 C PHE A 23 -3.497 -17.429 3.958 1.00 64.54 C ATOM 353 O PHE A 23 -3.343 -16.206 4.020 1.00 3.40 O ATOM 354 CB PHE A 23 -1.972 -18.840 2.486 1.00 62.33 C ATOM 355 CG PHE A 23 -0.860 -17.888 2.118 1.00 34.14 C ATOM 356 CD1 PHE A 23 -0.249 -17.104 3.082 1.00 42.11 C ATOM 357 CD2 PHE A 23 -0.416 -17.794 0.806 1.00 60.13 C ATOM 358 CE1 PHE A 23 0.780 -16.245 2.747 1.00 3.14 C ATOM 359 CE2 PHE A 23 0.610 -16.936 0.467 1.00 74.41 C ATOM 360 CZ PHE A 23 1.209 -16.160 1.438 1.00 43.14 C ATOM 0 H PHE A 23 -2.880 -17.173 0.844 1.00 12.20 H new ATOM 0 HA PHE A 23 -4.107 -18.992 2.647 1.00 71.14 H new ATOM 0 HB2 PHE A 23 -1.718 -19.324 3.429 1.00 62.33 H new ATOM 0 HB3 PHE A 23 -2.025 -19.623 1.729 1.00 62.33 H new ATOM 0 HD1 PHE A 23 -0.581 -17.165 4.108 1.00 42.11 H new ATOM 0 HD2 PHE A 23 -0.879 -18.400 0.041 1.00 60.13 H new ATOM 0 HE1 PHE A 23 1.249 -15.640 3.509 1.00 3.14 H new ATOM 0 HE2 PHE A 23 0.944 -16.872 -0.558 1.00 74.41 H new ATOM 0 HZ PHE A 23 2.012 -15.488 1.174 1.00 43.14 H new ATOM 370 N LYS A 24 -3.757 -18.185 5.028 1.00 62.45 N ATOM 371 CA LYS A 24 -4.155 -17.630 6.332 1.00 62.10 C ATOM 372 C LYS A 24 -3.059 -16.763 6.992 1.00 54.44 C ATOM 373 O LYS A 24 -3.351 -15.960 7.885 1.00 42.35 O ATOM 374 CB LYS A 24 -4.558 -18.784 7.271 1.00 10.51 C ATOM 375 CG LYS A 24 -5.216 -18.332 8.574 1.00 51.25 C ATOM 376 CD LYS A 24 -6.565 -17.638 8.346 1.00 25.24 C ATOM 377 CE LYS A 24 -7.676 -18.611 7.942 1.00 52.25 C ATOM 378 NZ LYS A 24 -7.504 -19.159 6.567 1.00 32.20 N ATOM 0 H LYS A 24 -3.698 -19.203 5.018 1.00 62.45 H new ATOM 0 HA LYS A 24 -5.000 -16.965 6.155 1.00 62.10 H new ATOM 0 HB2 LYS A 24 -5.244 -19.446 6.741 1.00 10.51 H new ATOM 0 HB3 LYS A 24 -3.670 -19.370 7.510 1.00 10.51 H new ATOM 0 HG2 LYS A 24 -5.362 -19.197 9.222 1.00 51.25 H new ATOM 0 HG3 LYS A 24 -4.545 -17.651 9.098 1.00 51.25 H new ATOM 0 HD2 LYS A 24 -6.859 -17.118 9.258 1.00 25.24 H new ATOM 0 HD3 LYS A 24 -6.452 -16.881 7.570 1.00 25.24 H new ATOM 0 HE2 LYS A 24 -7.705 -19.436 8.654 1.00 52.25 H new ATOM 0 HE3 LYS A 24 -8.637 -18.101 8.006 1.00 52.25 H new ATOM 0 HZ1 LYS A 24 -8.427 -19.192 6.088 1.00 32.20 H new ATOM 0 HZ2 LYS A 24 -6.856 -18.549 6.029 1.00 32.20 H new ATOM 0 HZ3 LYS A 24 -7.109 -20.119 6.623 1.00 32.20 H new ATOM 392 N GLN A 25 -1.807 -16.910 6.550 1.00 23.14 N ATOM 393 CA GLN A 25 -0.684 -16.161 7.144 1.00 63.14 C ATOM 394 C GLN A 25 -0.969 -14.650 7.237 1.00 23.31 C ATOM 395 O GLN A 25 -0.701 -14.031 8.267 1.00 52.03 O ATOM 396 CB GLN A 25 0.606 -16.402 6.344 1.00 13.31 C ATOM 397 CG GLN A 25 1.827 -15.637 6.861 1.00 32.42 C ATOM 398 CD GLN A 25 2.196 -15.994 8.293 1.00 15.12 C ATOM 399 OE1 GLN A 25 2.970 -16.912 8.539 1.00 45.44 O ATOM 400 NE2 GLN A 25 1.654 -15.265 9.248 1.00 51.25 N ATOM 0 H GLN A 25 -1.541 -17.535 5.789 1.00 23.14 H new ATOM 0 HA GLN A 25 -0.558 -16.534 8.161 1.00 63.14 H new ATOM 0 HB2 GLN A 25 0.831 -17.469 6.354 1.00 13.31 H new ATOM 0 HB3 GLN A 25 0.431 -16.123 5.305 1.00 13.31 H new ATOM 0 HG2 GLN A 25 2.678 -15.842 6.211 1.00 32.42 H new ATOM 0 HG3 GLN A 25 1.630 -14.567 6.800 1.00 32.42 H new ATOM 0 HE21 GLN A 25 1.013 -14.508 9.010 1.00 51.25 H new ATOM 0 HE22 GLN A 25 1.875 -15.458 10.225 1.00 51.25 H new ATOM 409 N LEU A 26 -1.517 -14.058 6.172 1.00 13.41 N ATOM 410 CA LEU A 26 -1.852 -12.622 6.177 1.00 13.11 C ATOM 411 C LEU A 26 -2.828 -12.264 7.309 1.00 71.14 C ATOM 412 O LEU A 26 -2.734 -11.197 7.921 1.00 74.34 O ATOM 413 CB LEU A 26 -2.457 -12.192 4.833 1.00 13.41 C ATOM 414 CG LEU A 26 -1.469 -12.072 3.660 1.00 15.12 C ATOM 415 CD1 LEU A 26 -2.184 -11.559 2.412 1.00 31.42 C ATOM 416 CD2 LEU A 26 -0.302 -11.154 4.028 1.00 72.31 C ATOM 0 H LEU A 26 -1.738 -14.541 5.301 1.00 13.41 H new ATOM 0 HA LEU A 26 -0.918 -12.085 6.343 1.00 13.11 H new ATOM 0 HB2 LEU A 26 -3.231 -12.909 4.559 1.00 13.41 H new ATOM 0 HB3 LEU A 26 -2.948 -11.229 4.969 1.00 13.41 H new ATOM 0 HG LEU A 26 -1.068 -13.062 3.445 1.00 15.12 H new ATOM 0 HD11 LEU A 26 -1.471 -11.480 1.591 1.00 31.42 H new ATOM 0 HD12 LEU A 26 -2.979 -12.253 2.137 1.00 31.42 H new ATOM 0 HD13 LEU A 26 -2.613 -10.578 2.616 1.00 31.42 H new ATOM 0 HD21 LEU A 26 0.385 -11.083 3.185 1.00 72.31 H new ATOM 0 HD22 LEU A 26 -0.682 -10.162 4.271 1.00 72.31 H new ATOM 0 HD23 LEU A 26 0.224 -11.562 4.891 1.00 72.31 H new ATOM 428 N TYR A 27 -3.758 -13.165 7.584 1.00 70.34 N ATOM 429 CA TYR A 27 -4.789 -12.935 8.597 1.00 41.51 C ATOM 430 C TYR A 27 -4.208 -12.980 10.019 1.00 75.34 C ATOM 431 O TYR A 27 -4.671 -12.269 10.914 1.00 61.34 O ATOM 432 CB TYR A 27 -5.900 -13.985 8.446 1.00 65.22 C ATOM 433 CG TYR A 27 -6.665 -13.886 7.135 1.00 51.11 C ATOM 434 CD1 TYR A 27 -6.071 -14.221 5.920 1.00 13.52 C ATOM 435 CD2 TYR A 27 -7.980 -13.447 7.114 1.00 24.42 C ATOM 436 CE1 TYR A 27 -6.772 -14.122 4.730 1.00 42.11 C ATOM 437 CE2 TYR A 27 -8.686 -13.342 5.936 1.00 75.13 C ATOM 438 CZ TYR A 27 -8.079 -13.680 4.744 1.00 30.42 C ATOM 439 OH TYR A 27 -8.782 -13.574 3.564 1.00 60.40 O ATOM 0 H TYR A 27 -3.824 -14.070 7.119 1.00 70.34 H new ATOM 0 HA TYR A 27 -5.201 -11.938 8.442 1.00 41.51 H new ATOM 0 HB2 TYR A 27 -5.460 -14.979 8.525 1.00 65.22 H new ATOM 0 HB3 TYR A 27 -6.601 -13.880 9.274 1.00 65.22 H new ATOM 0 HD1 TYR A 27 -5.047 -14.564 5.906 1.00 13.52 H new ATOM 0 HD2 TYR A 27 -8.462 -13.181 8.043 1.00 24.42 H new ATOM 0 HE1 TYR A 27 -6.299 -14.389 3.797 1.00 42.11 H new ATOM 0 HE2 TYR A 27 -9.709 -12.997 5.945 1.00 75.13 H new ATOM 0 HH TYR A 27 -8.682 -12.668 3.204 1.00 60.40 H new ATOM 449 N GLU A 28 -3.183 -13.807 10.215 1.00 74.55 N ATOM 450 CA GLU A 28 -2.608 -14.033 11.549 1.00 34.01 C ATOM 451 C GLU A 28 -1.181 -13.463 11.678 1.00 32.45 C ATOM 452 O GLU A 28 -0.429 -13.859 12.567 1.00 10.32 O ATOM 453 CB GLU A 28 -2.613 -15.542 11.841 1.00 31.23 C ATOM 454 CG GLU A 28 -3.974 -16.194 11.601 1.00 35.40 C ATOM 455 CD GLU A 28 -4.013 -17.679 11.934 1.00 61.03 C ATOM 456 OE1 GLU A 28 -3.008 -18.383 11.697 1.00 42.14 O ATOM 457 OE2 GLU A 28 -5.071 -18.154 12.406 1.00 43.30 O ATOM 0 H GLU A 28 -2.730 -14.335 9.469 1.00 74.55 H new ATOM 0 HA GLU A 28 -3.220 -13.504 12.280 1.00 34.01 H new ATOM 0 HB2 GLU A 28 -1.867 -16.030 11.213 1.00 31.23 H new ATOM 0 HB3 GLU A 28 -2.315 -15.707 12.877 1.00 31.23 H new ATOM 0 HG2 GLU A 28 -4.724 -15.677 12.200 1.00 35.40 H new ATOM 0 HG3 GLU A 28 -4.252 -16.058 10.556 1.00 35.40 H new ATOM 464 N LEU A 29 -0.831 -12.510 10.807 1.00 32.25 N ATOM 465 CA LEU A 29 0.512 -11.893 10.797 1.00 32.20 C ATOM 466 C LEU A 29 0.993 -11.458 12.194 1.00 13.33 C ATOM 467 O LEU A 29 2.085 -11.838 12.624 1.00 33.43 O ATOM 468 CB LEU A 29 0.527 -10.670 9.867 1.00 10.43 C ATOM 469 CG LEU A 29 0.382 -10.971 8.369 1.00 43.04 C ATOM 470 CD1 LEU A 29 0.205 -9.680 7.570 1.00 15.44 C ATOM 471 CD2 LEU A 29 1.584 -11.764 7.855 1.00 23.51 C ATOM 0 H LEU A 29 -1.460 -12.143 10.093 1.00 32.25 H new ATOM 0 HA LEU A 29 1.195 -12.663 10.438 1.00 32.20 H new ATOM 0 HB2 LEU A 29 -0.280 -10.001 10.164 1.00 10.43 H new ATOM 0 HB3 LEU A 29 1.461 -10.130 10.022 1.00 10.43 H new ATOM 0 HG LEU A 29 -0.511 -11.581 8.232 1.00 43.04 H new ATOM 0 HD11 LEU A 29 0.104 -9.918 6.511 1.00 15.44 H new ATOM 0 HD12 LEU A 29 -0.690 -9.160 7.912 1.00 15.44 H new ATOM 0 HD13 LEU A 29 1.075 -9.039 7.717 1.00 15.44 H new ATOM 0 HD21 LEU A 29 1.459 -11.966 6.791 1.00 23.51 H new ATOM 0 HD22 LEU A 29 2.495 -11.186 8.010 1.00 23.51 H new ATOM 0 HD23 LEU A 29 1.656 -12.707 8.397 1.00 23.51 H new ATOM 483 N ASP A 30 0.181 -10.668 12.899 1.00 32.14 N ATOM 484 CA ASP A 30 0.606 -10.081 14.181 1.00 23.23 C ATOM 485 C ASP A 30 -0.261 -10.572 15.361 1.00 33.20 C ATOM 486 O ASP A 30 0.247 -10.784 16.462 1.00 0.13 O ATOM 487 CB ASP A 30 0.569 -8.553 14.078 1.00 73.35 C ATOM 488 CG ASP A 30 1.385 -7.866 15.159 1.00 21.33 C ATOM 489 OD1 ASP A 30 2.624 -7.801 15.020 1.00 41.01 O ATOM 490 OD2 ASP A 30 0.794 -7.381 16.144 1.00 51.32 O ATOM 0 H ASP A 30 -0.766 -10.419 12.612 1.00 32.14 H new ATOM 0 HA ASP A 30 1.626 -10.409 14.384 1.00 23.23 H new ATOM 0 HB2 ASP A 30 0.944 -8.251 13.100 1.00 73.35 H new ATOM 0 HB3 ASP A 30 -0.465 -8.215 14.141 1.00 73.35 H new ATOM 495 N GLY A 31 -1.569 -10.736 15.140 1.00 0.32 N ATOM 496 CA GLY A 31 -2.431 -11.302 16.184 1.00 43.42 C ATOM 497 C GLY A 31 -3.768 -10.584 16.385 1.00 15.53 C ATOM 498 O GLY A 31 -4.653 -11.110 17.057 1.00 43.04 O ATOM 0 H GLY A 31 -2.045 -10.492 14.272 1.00 0.32 H new ATOM 0 HA2 GLY A 31 -2.630 -12.346 15.942 1.00 43.42 H new ATOM 0 HA3 GLY A 31 -1.886 -11.292 17.128 1.00 43.42 H new ATOM 502 N ASP A 32 -3.930 -9.388 15.817 1.00 31.23 N ATOM 503 CA ASP A 32 -5.165 -8.615 16.011 1.00 74.21 C ATOM 504 C ASP A 32 -6.363 -9.241 15.273 1.00 23.11 C ATOM 505 O ASP A 32 -6.277 -9.525 14.076 1.00 51.34 O ATOM 506 CB ASP A 32 -4.976 -7.176 15.522 1.00 21.01 C ATOM 507 CG ASP A 32 -3.816 -6.482 16.204 1.00 51.43 C ATOM 508 OD1 ASP A 32 -4.024 -5.878 17.277 1.00 24.03 O ATOM 509 OD2 ASP A 32 -2.696 -6.538 15.662 1.00 72.25 O ATOM 0 H ASP A 32 -3.233 -8.935 15.226 1.00 31.23 H new ATOM 0 HA ASP A 32 -5.378 -8.623 17.080 1.00 74.21 H new ATOM 0 HB2 ASP A 32 -4.811 -7.180 14.445 1.00 21.01 H new ATOM 0 HB3 ASP A 32 -5.891 -6.611 15.702 1.00 21.01 H new ATOM 514 N PRO A 33 -7.506 -9.443 15.968 1.00 52.45 N ATOM 515 CA PRO A 33 -8.754 -9.905 15.329 1.00 34.53 C ATOM 516 C PRO A 33 -9.225 -8.935 14.232 1.00 33.34 C ATOM 517 O PRO A 33 -9.845 -9.334 13.248 1.00 20.45 O ATOM 518 CB PRO A 33 -9.768 -9.956 16.489 1.00 35.23 C ATOM 519 CG PRO A 33 -9.167 -9.117 17.570 1.00 0.24 C ATOM 520 CD PRO A 33 -7.676 -9.260 17.423 1.00 42.34 C ATOM 0 HA PRO A 33 -8.629 -10.866 14.830 1.00 34.53 H new ATOM 0 HB2 PRO A 33 -10.738 -9.566 16.181 1.00 35.23 H new ATOM 0 HB3 PRO A 33 -9.928 -10.980 16.828 1.00 35.23 H new ATOM 0 HG2 PRO A 33 -9.471 -8.075 17.470 1.00 0.24 H new ATOM 0 HG3 PRO A 33 -9.496 -9.452 18.553 1.00 0.24 H new ATOM 0 HD2 PRO A 33 -7.148 -8.378 17.784 1.00 42.34 H new ATOM 0 HD3 PRO A 33 -7.294 -10.112 17.985 1.00 42.34 H new ATOM 528 N LYS A 34 -8.892 -7.659 14.400 1.00 15.34 N ATOM 529 CA LYS A 34 -9.238 -6.629 13.418 1.00 41.02 C ATOM 530 C LYS A 34 -8.381 -6.740 12.147 1.00 62.32 C ATOM 531 O LYS A 34 -8.715 -6.161 11.119 1.00 30.14 O ATOM 532 CB LYS A 34 -9.090 -5.235 14.045 1.00 13.01 C ATOM 533 CG LYS A 34 -10.041 -5.007 15.218 1.00 74.41 C ATOM 534 CD LYS A 34 -11.494 -5.150 14.777 1.00 64.25 C ATOM 535 CE LYS A 34 -12.454 -5.221 15.957 1.00 40.25 C ATOM 536 NZ LYS A 34 -13.861 -5.394 15.502 1.00 61.41 N ATOM 0 H LYS A 34 -8.380 -7.309 15.210 1.00 15.34 H new ATOM 0 HA LYS A 34 -10.276 -6.783 13.124 1.00 41.02 H new ATOM 0 HB2 LYS A 34 -8.063 -5.102 14.385 1.00 13.01 H new ATOM 0 HB3 LYS A 34 -9.273 -4.478 13.283 1.00 13.01 H new ATOM 0 HG2 LYS A 34 -9.825 -5.723 16.011 1.00 74.41 H new ATOM 0 HG3 LYS A 34 -9.879 -4.013 15.634 1.00 74.41 H new ATOM 0 HD2 LYS A 34 -11.763 -4.305 14.143 1.00 64.25 H new ATOM 0 HD3 LYS A 34 -11.600 -6.050 14.171 1.00 64.25 H new ATOM 0 HE2 LYS A 34 -12.175 -6.051 16.606 1.00 40.25 H new ATOM 0 HE3 LYS A 34 -12.371 -4.311 16.551 1.00 40.25 H new ATOM 0 HZ1 LYS A 34 -14.344 -6.077 16.120 1.00 61.41 H new ATOM 0 HZ2 LYS A 34 -14.354 -4.479 15.544 1.00 61.41 H new ATOM 0 HZ3 LYS A 34 -13.869 -5.747 14.524 1.00 61.41 H new ATOM 550 N ARG A 35 -7.288 -7.502 12.217 1.00 31.31 N ATOM 551 CA ARG A 35 -6.417 -7.699 11.054 1.00 24.33 C ATOM 552 C ARG A 35 -7.123 -8.526 9.968 1.00 60.01 C ATOM 553 O ARG A 35 -7.117 -8.160 8.793 1.00 64.02 O ATOM 554 CB ARG A 35 -5.098 -8.365 11.469 1.00 50.11 C ATOM 555 CG ARG A 35 -4.192 -8.741 10.296 1.00 74.31 C ATOM 556 CD ARG A 35 -2.783 -9.110 10.756 1.00 0.13 C ATOM 557 NE ARG A 35 -1.951 -7.926 11.013 1.00 40.04 N ATOM 558 CZ ARG A 35 -1.853 -7.311 12.167 1.00 4.33 C ATOM 559 NH1 ARG A 35 -2.565 -7.688 13.181 1.00 11.52 N ATOM 560 NH2 ARG A 35 -1.043 -6.307 12.302 1.00 44.43 N ATOM 0 H ARG A 35 -6.985 -7.990 13.060 1.00 31.31 H new ATOM 0 HA ARG A 35 -6.190 -6.718 10.636 1.00 24.33 H new ATOM 0 HB2 ARG A 35 -4.556 -7.690 12.131 1.00 50.11 H new ATOM 0 HB3 ARG A 35 -5.322 -9.264 12.043 1.00 50.11 H new ATOM 0 HG2 ARG A 35 -4.628 -9.581 9.756 1.00 74.31 H new ATOM 0 HG3 ARG A 35 -4.138 -7.906 9.597 1.00 74.31 H new ATOM 0 HD2 ARG A 35 -2.845 -9.711 11.663 1.00 0.13 H new ATOM 0 HD3 ARG A 35 -2.306 -9.729 9.996 1.00 0.13 H new ATOM 0 HE ARG A 35 -1.408 -7.554 10.234 1.00 40.04 H new ATOM 0 HH11 ARG A 35 -3.211 -8.472 13.087 1.00 11.52 H new ATOM 0 HH12 ARG A 35 -2.480 -7.201 14.073 1.00 11.52 H new ATOM 0 HH21 ARG A 35 -0.481 -5.995 11.510 1.00 44.43 H new ATOM 0 HH22 ARG A 35 -0.968 -5.830 13.200 1.00 44.43 H new ATOM 574 N LYS A 36 -7.740 -9.635 10.371 1.00 65.01 N ATOM 575 CA LYS A 36 -8.499 -10.471 9.435 1.00 5.01 C ATOM 576 C LYS A 36 -9.807 -9.786 9.015 1.00 4.03 C ATOM 577 O LYS A 36 -10.236 -9.911 7.868 1.00 51.33 O ATOM 578 CB LYS A 36 -8.781 -11.877 10.008 1.00 14.33 C ATOM 579 CG LYS A 36 -9.483 -11.921 11.367 1.00 54.22 C ATOM 580 CD LYS A 36 -8.498 -11.930 12.540 1.00 52.23 C ATOM 581 CE LYS A 36 -7.577 -13.141 12.518 1.00 33.33 C ATOM 582 NZ LYS A 36 -8.311 -14.402 12.796 1.00 73.12 N ATOM 0 H LYS A 36 -7.731 -9.976 11.332 1.00 65.01 H new ATOM 0 HA LYS A 36 -7.876 -10.598 8.549 1.00 5.01 H new ATOM 0 HB2 LYS A 36 -9.390 -12.425 9.289 1.00 14.33 H new ATOM 0 HB3 LYS A 36 -7.834 -12.409 10.094 1.00 14.33 H new ATOM 0 HG2 LYS A 36 -10.143 -11.059 11.459 1.00 54.22 H new ATOM 0 HG3 LYS A 36 -10.111 -12.810 11.418 1.00 54.22 H new ATOM 0 HD2 LYS A 36 -7.898 -11.021 12.513 1.00 52.23 H new ATOM 0 HD3 LYS A 36 -9.054 -11.917 13.477 1.00 52.23 H new ATOM 0 HE2 LYS A 36 -7.092 -13.211 11.544 1.00 33.33 H new ATOM 0 HE3 LYS A 36 -6.788 -13.010 13.258 1.00 33.33 H new ATOM 0 HZ1 LYS A 36 -7.640 -15.196 12.822 1.00 73.12 H new ATOM 0 HZ2 LYS A 36 -8.795 -14.327 13.714 1.00 73.12 H new ATOM 0 HZ3 LYS A 36 -9.013 -14.567 12.047 1.00 73.12 H new ATOM 596 N GLU A 37 -10.436 -9.059 9.943 1.00 44.02 N ATOM 597 CA GLU A 37 -11.623 -8.252 9.619 1.00 45.42 C ATOM 598 C GLU A 37 -11.292 -7.204 8.539 1.00 34.13 C ATOM 599 O GLU A 37 -12.042 -7.027 7.574 1.00 34.41 O ATOM 600 CB GLU A 37 -12.164 -7.559 10.885 1.00 22.14 C ATOM 601 CG GLU A 37 -12.657 -8.530 11.959 1.00 22.13 C ATOM 602 CD GLU A 37 -13.221 -7.825 13.191 1.00 1.55 C ATOM 603 OE1 GLU A 37 -14.068 -6.923 13.036 1.00 62.50 O ATOM 604 OE2 GLU A 37 -12.838 -8.189 14.325 1.00 62.45 O ATOM 0 H GLU A 37 -10.148 -9.010 10.920 1.00 44.02 H new ATOM 0 HA GLU A 37 -12.392 -8.919 9.228 1.00 45.42 H new ATOM 0 HB2 GLU A 37 -11.379 -6.932 11.308 1.00 22.14 H new ATOM 0 HB3 GLU A 37 -12.983 -6.897 10.603 1.00 22.14 H new ATOM 0 HG2 GLU A 37 -13.426 -9.174 11.533 1.00 22.13 H new ATOM 0 HG3 GLU A 37 -11.833 -9.176 12.263 1.00 22.13 H new ATOM 611 N PHE A 38 -10.159 -6.525 8.718 1.00 24.42 N ATOM 612 CA PHE A 38 -9.651 -5.551 7.742 1.00 33.51 C ATOM 613 C PHE A 38 -9.434 -6.199 6.366 1.00 12.52 C ATOM 614 O PHE A 38 -9.973 -5.739 5.358 1.00 15.12 O ATOM 615 CB PHE A 38 -8.329 -4.958 8.263 1.00 51.41 C ATOM 616 CG PHE A 38 -7.674 -3.948 7.346 1.00 3.52 C ATOM 617 CD1 PHE A 38 -6.859 -4.363 6.297 1.00 11.15 C ATOM 618 CD2 PHE A 38 -7.856 -2.587 7.544 1.00 73.54 C ATOM 619 CE1 PHE A 38 -6.246 -3.444 5.469 1.00 52.35 C ATOM 620 CE2 PHE A 38 -7.243 -1.664 6.716 1.00 51.13 C ATOM 621 CZ PHE A 38 -6.439 -2.094 5.679 1.00 33.21 C ATOM 0 H PHE A 38 -9.566 -6.632 9.541 1.00 24.42 H new ATOM 0 HA PHE A 38 -10.391 -4.760 7.621 1.00 33.51 H new ATOM 0 HB2 PHE A 38 -8.516 -4.483 9.226 1.00 51.41 H new ATOM 0 HB3 PHE A 38 -7.628 -5.773 8.440 1.00 51.41 H new ATOM 0 HD1 PHE A 38 -6.704 -5.418 6.128 1.00 11.15 H new ATOM 0 HD2 PHE A 38 -8.483 -2.244 8.354 1.00 73.54 H new ATOM 0 HE1 PHE A 38 -5.617 -3.781 4.659 1.00 52.35 H new ATOM 0 HE2 PHE A 38 -7.393 -0.607 6.881 1.00 51.13 H new ATOM 0 HZ PHE A 38 -5.961 -1.373 5.032 1.00 33.21 H new ATOM 631 N LEU A 39 -8.639 -7.270 6.336 1.00 40.00 N ATOM 632 CA LEU A 39 -8.332 -7.981 5.088 1.00 41.22 C ATOM 633 C LEU A 39 -9.599 -8.504 4.397 1.00 74.13 C ATOM 634 O LEU A 39 -9.707 -8.458 3.173 1.00 24.51 O ATOM 635 CB LEU A 39 -7.370 -9.142 5.363 1.00 2.51 C ATOM 636 CG LEU A 39 -5.982 -8.734 5.879 1.00 62.32 C ATOM 637 CD1 LEU A 39 -5.147 -9.968 6.191 1.00 74.11 C ATOM 638 CD2 LEU A 39 -5.267 -7.839 4.867 1.00 4.13 C ATOM 0 H LEU A 39 -8.194 -7.667 7.163 1.00 40.00 H new ATOM 0 HA LEU A 39 -7.859 -7.267 4.414 1.00 41.22 H new ATOM 0 HB2 LEU A 39 -7.830 -9.808 6.093 1.00 2.51 H new ATOM 0 HB3 LEU A 39 -7.244 -9.714 4.444 1.00 2.51 H new ATOM 0 HG LEU A 39 -6.113 -8.165 6.799 1.00 62.32 H new ATOM 0 HD11 LEU A 39 -4.167 -9.661 6.555 1.00 74.11 H new ATOM 0 HD12 LEU A 39 -5.648 -10.563 6.955 1.00 74.11 H new ATOM 0 HD13 LEU A 39 -5.028 -10.565 5.287 1.00 74.11 H new ATOM 0 HD21 LEU A 39 -4.286 -7.563 5.254 1.00 4.13 H new ATOM 0 HD22 LEU A 39 -5.147 -8.377 3.926 1.00 4.13 H new ATOM 0 HD23 LEU A 39 -5.857 -6.938 4.697 1.00 4.13 H new ATOM 650 N ASP A 40 -10.553 -8.998 5.180 1.00 1.01 N ATOM 651 CA ASP A 40 -11.811 -9.501 4.627 1.00 32.21 C ATOM 652 C ASP A 40 -12.583 -8.386 3.899 1.00 2.44 C ATOM 653 O ASP A 40 -13.016 -8.564 2.756 1.00 34.34 O ATOM 654 CB ASP A 40 -12.674 -10.110 5.735 1.00 60.41 C ATOM 655 CG ASP A 40 -13.939 -10.743 5.186 1.00 20.34 C ATOM 656 OD1 ASP A 40 -13.851 -11.845 4.608 1.00 65.41 O ATOM 657 OD2 ASP A 40 -15.023 -10.135 5.312 1.00 63.21 O ATOM 0 H ASP A 40 -10.482 -9.062 6.196 1.00 1.01 H new ATOM 0 HA ASP A 40 -11.573 -10.277 3.899 1.00 32.21 H new ATOM 0 HB2 ASP A 40 -12.096 -10.862 6.273 1.00 60.41 H new ATOM 0 HB3 ASP A 40 -12.939 -9.336 6.455 1.00 60.41 H new ATOM 662 N ASP A 41 -12.743 -7.238 4.561 1.00 51.41 N ATOM 663 CA ASP A 41 -13.410 -6.079 3.956 1.00 4.44 C ATOM 664 C ASP A 41 -12.597 -5.539 2.766 1.00 35.04 C ATOM 665 O ASP A 41 -13.163 -5.088 1.772 1.00 33.23 O ATOM 666 CB ASP A 41 -13.618 -4.979 5.005 1.00 4.02 C ATOM 667 CG ASP A 41 -14.413 -3.798 4.464 1.00 20.31 C ATOM 668 OD1 ASP A 41 -15.664 -3.889 4.416 1.00 11.11 O ATOM 669 OD2 ASP A 41 -13.802 -2.782 4.075 1.00 33.13 O ATOM 0 H ASP A 41 -12.420 -7.084 5.516 1.00 51.41 H new ATOM 0 HA ASP A 41 -14.384 -6.399 3.585 1.00 4.44 H new ATOM 0 HB2 ASP A 41 -14.137 -5.398 5.867 1.00 4.02 H new ATOM 0 HB3 ASP A 41 -12.647 -4.629 5.356 1.00 4.02 H new ATOM 674 N LEU A 42 -11.270 -5.596 2.885 1.00 33.11 N ATOM 675 CA LEU A 42 -10.353 -5.185 1.812 1.00 43.00 C ATOM 676 C LEU A 42 -10.557 -6.022 0.537 1.00 15.12 C ATOM 677 O LEU A 42 -10.869 -5.484 -0.532 1.00 3.34 O ATOM 678 CB LEU A 42 -8.903 -5.324 2.303 1.00 62.55 C ATOM 679 CG LEU A 42 -7.808 -5.159 1.237 1.00 34.23 C ATOM 680 CD1 LEU A 42 -7.808 -3.745 0.660 1.00 70.30 C ATOM 681 CD2 LEU A 42 -6.441 -5.518 1.819 1.00 35.03 C ATOM 0 H LEU A 42 -10.797 -5.928 3.726 1.00 33.11 H new ATOM 0 HA LEU A 42 -10.566 -4.146 1.561 1.00 43.00 H new ATOM 0 HB2 LEU A 42 -8.734 -4.584 3.086 1.00 62.55 H new ATOM 0 HB3 LEU A 42 -8.789 -6.306 2.762 1.00 62.55 H new ATOM 0 HG LEU A 42 -8.022 -5.845 0.418 1.00 34.23 H new ATOM 0 HD11 LEU A 42 -7.023 -3.659 -0.091 1.00 70.30 H new ATOM 0 HD12 LEU A 42 -8.775 -3.540 0.200 1.00 70.30 H new ATOM 0 HD13 LEU A 42 -7.626 -3.026 1.459 1.00 70.30 H new ATOM 0 HD21 LEU A 42 -5.676 -5.396 1.052 1.00 35.03 H new ATOM 0 HD22 LEU A 42 -6.220 -4.861 2.660 1.00 35.03 H new ATOM 0 HD23 LEU A 42 -6.451 -6.553 2.160 1.00 35.03 H new ATOM 693 N PHE A 43 -10.388 -7.339 0.660 1.00 44.34 N ATOM 694 CA PHE A 43 -10.563 -8.249 -0.476 1.00 5.02 C ATOM 695 C PHE A 43 -11.991 -8.166 -1.028 1.00 34.55 C ATOM 696 O PHE A 43 -12.203 -8.166 -2.241 1.00 63.44 O ATOM 697 CB PHE A 43 -10.239 -9.696 -0.070 1.00 42.12 C ATOM 698 CG PHE A 43 -8.833 -9.892 0.451 1.00 43.34 C ATOM 699 CD1 PHE A 43 -7.763 -9.194 -0.097 1.00 62.41 C ATOM 700 CD2 PHE A 43 -8.579 -10.784 1.487 1.00 64.33 C ATOM 701 CE1 PHE A 43 -6.478 -9.378 0.378 1.00 33.23 C ATOM 702 CE2 PHE A 43 -7.294 -10.968 1.963 1.00 75.13 C ATOM 703 CZ PHE A 43 -6.244 -10.264 1.409 1.00 20.02 C ATOM 0 H PHE A 43 -10.131 -7.800 1.533 1.00 44.34 H new ATOM 0 HA PHE A 43 -9.870 -7.942 -1.259 1.00 5.02 H new ATOM 0 HB2 PHE A 43 -10.946 -10.014 0.696 1.00 42.12 H new ATOM 0 HB3 PHE A 43 -10.389 -10.346 -0.932 1.00 42.12 H new ATOM 0 HD1 PHE A 43 -7.938 -8.499 -0.905 1.00 62.41 H new ATOM 0 HD2 PHE A 43 -9.395 -11.340 1.925 1.00 64.33 H new ATOM 0 HE1 PHE A 43 -5.657 -8.828 -0.058 1.00 33.23 H new ATOM 0 HE2 PHE A 43 -7.112 -11.663 2.769 1.00 75.13 H new ATOM 0 HZ PHE A 43 -5.241 -10.407 1.782 1.00 20.02 H new ATOM 713 N SER A 44 -12.964 -8.077 -0.124 1.00 11.54 N ATOM 714 CA SER A 44 -14.372 -7.939 -0.512 1.00 0.50 C ATOM 715 C SER A 44 -14.610 -6.628 -1.276 1.00 20.12 C ATOM 716 O SER A 44 -15.241 -6.622 -2.327 1.00 64.14 O ATOM 717 CB SER A 44 -15.280 -7.994 0.726 1.00 60.41 C ATOM 718 OG SER A 44 -16.651 -7.900 0.372 1.00 44.34 O ATOM 0 H SER A 44 -12.806 -8.098 0.884 1.00 11.54 H new ATOM 0 HA SER A 44 -14.618 -8.772 -1.171 1.00 0.50 H new ATOM 0 HB2 SER A 44 -15.106 -8.925 1.265 1.00 60.41 H new ATOM 0 HB3 SER A 44 -15.022 -7.180 1.404 1.00 60.41 H new ATOM 0 HG SER A 44 -17.201 -7.940 1.182 1.00 44.34 H new ATOM 724 N PHE A 45 -14.068 -5.524 -0.758 1.00 31.54 N ATOM 725 CA PHE A 45 -14.251 -4.200 -1.370 1.00 71.40 C ATOM 726 C PHE A 45 -13.717 -4.163 -2.807 1.00 32.32 C ATOM 727 O PHE A 45 -14.427 -3.770 -3.737 1.00 14.41 O ATOM 728 CB PHE A 45 -13.562 -3.118 -0.525 1.00 50.45 C ATOM 729 CG PHE A 45 -13.632 -1.733 -1.128 1.00 45.12 C ATOM 730 CD1 PHE A 45 -14.819 -1.014 -1.111 1.00 50.21 C ATOM 731 CD2 PHE A 45 -12.513 -1.155 -1.714 1.00 15.41 C ATOM 732 CE1 PHE A 45 -14.888 0.250 -1.668 1.00 44.31 C ATOM 733 CE2 PHE A 45 -12.578 0.108 -2.269 1.00 42.24 C ATOM 734 CZ PHE A 45 -13.767 0.811 -2.247 1.00 20.24 C ATOM 0 H PHE A 45 -13.496 -5.518 0.087 1.00 31.54 H new ATOM 0 HA PHE A 45 -15.322 -4.000 -1.404 1.00 71.40 H new ATOM 0 HB2 PHE A 45 -14.020 -3.097 0.464 1.00 50.45 H new ATOM 0 HB3 PHE A 45 -12.516 -3.391 -0.386 1.00 50.45 H new ATOM 0 HD1 PHE A 45 -15.699 -1.446 -0.658 1.00 50.21 H new ATOM 0 HD2 PHE A 45 -11.581 -1.700 -1.736 1.00 15.41 H new ATOM 0 HE1 PHE A 45 -15.818 0.798 -1.650 1.00 44.31 H new ATOM 0 HE2 PHE A 45 -11.700 0.546 -2.720 1.00 42.24 H new ATOM 0 HZ PHE A 45 -13.820 1.798 -2.682 1.00 20.24 H new ATOM 744 N MET A 46 -12.465 -4.571 -2.989 1.00 24.32 N ATOM 745 CA MET A 46 -11.861 -4.593 -4.323 1.00 34.13 C ATOM 746 C MET A 46 -12.583 -5.600 -5.239 1.00 53.34 C ATOM 747 O MET A 46 -12.673 -5.399 -6.449 1.00 15.54 O ATOM 748 CB MET A 46 -10.357 -4.889 -4.240 1.00 13.22 C ATOM 749 CG MET A 46 -10.008 -6.257 -3.671 1.00 13.13 C ATOM 750 SD MET A 46 -8.235 -6.454 -3.391 1.00 44.21 S ATOM 751 CE MET A 46 -7.577 -6.037 -5.006 1.00 62.42 C ATOM 0 H MET A 46 -11.851 -4.889 -2.239 1.00 24.32 H new ATOM 0 HA MET A 46 -11.979 -3.603 -4.764 1.00 34.13 H new ATOM 0 HB2 MET A 46 -9.929 -4.806 -5.239 1.00 13.22 H new ATOM 0 HB3 MET A 46 -9.883 -4.123 -3.625 1.00 13.22 H new ATOM 0 HG2 MET A 46 -10.540 -6.403 -2.731 1.00 13.13 H new ATOM 0 HG3 MET A 46 -10.353 -7.031 -4.356 1.00 13.13 H new ATOM 0 HE1 MET A 46 -6.489 -6.097 -4.982 1.00 62.42 H new ATOM 0 HE2 MET A 46 -7.963 -6.736 -5.748 1.00 62.42 H new ATOM 0 HE3 MET A 46 -7.879 -5.024 -5.271 1.00 62.42 H new ATOM 761 N GLN A 47 -13.119 -6.672 -4.649 1.00 74.25 N ATOM 762 CA GLN A 47 -13.933 -7.643 -5.395 1.00 14.34 C ATOM 763 C GLN A 47 -15.250 -7.006 -5.871 1.00 11.05 C ATOM 764 O GLN A 47 -15.677 -7.208 -7.010 1.00 33.11 O ATOM 765 CB GLN A 47 -14.225 -8.874 -4.521 1.00 51.01 C ATOM 766 CG GLN A 47 -15.007 -9.976 -5.231 1.00 62.21 C ATOM 767 CD GLN A 47 -15.190 -11.218 -4.370 1.00 21.44 C ATOM 768 OE1 GLN A 47 -15.269 -11.140 -3.148 1.00 50.23 O ATOM 769 NE2 GLN A 47 -15.255 -12.375 -5.003 1.00 52.31 N ATOM 0 H GLN A 47 -13.006 -6.892 -3.659 1.00 74.25 H new ATOM 0 HA GLN A 47 -13.369 -7.957 -6.273 1.00 14.34 H new ATOM 0 HB2 GLN A 47 -13.280 -9.286 -4.166 1.00 51.01 H new ATOM 0 HB3 GLN A 47 -14.785 -8.556 -3.641 1.00 51.01 H new ATOM 0 HG2 GLN A 47 -15.986 -9.592 -5.520 1.00 62.21 H new ATOM 0 HG3 GLN A 47 -14.488 -10.250 -6.150 1.00 62.21 H new ATOM 0 HE21 GLN A 47 -15.186 -12.404 -6.020 1.00 52.31 H new ATOM 0 HE22 GLN A 47 -15.374 -13.239 -4.475 1.00 52.31 H new ATOM 778 N LYS A 48 -15.881 -6.226 -4.995 1.00 44.22 N ATOM 779 CA LYS A 48 -17.132 -5.521 -5.318 1.00 51.33 C ATOM 780 C LYS A 48 -16.963 -4.598 -6.534 1.00 72.23 C ATOM 781 O LYS A 48 -17.823 -4.552 -7.413 1.00 51.44 O ATOM 782 CB LYS A 48 -17.602 -4.694 -4.111 1.00 14.54 C ATOM 783 CG LYS A 48 -17.960 -5.525 -2.885 1.00 44.35 C ATOM 784 CD LYS A 48 -18.188 -4.643 -1.659 1.00 32.32 C ATOM 785 CE LYS A 48 -18.415 -5.469 -0.399 1.00 31.51 C ATOM 786 NZ LYS A 48 -18.573 -4.616 0.808 1.00 4.50 N ATOM 0 H LYS A 48 -15.547 -6.062 -4.045 1.00 44.22 H new ATOM 0 HA LYS A 48 -17.880 -6.276 -5.562 1.00 51.33 H new ATOM 0 HB2 LYS A 48 -16.817 -3.988 -3.841 1.00 14.54 H new ATOM 0 HB3 LYS A 48 -18.472 -4.106 -4.404 1.00 14.54 H new ATOM 0 HG2 LYS A 48 -18.859 -6.107 -3.088 1.00 44.35 H new ATOM 0 HG3 LYS A 48 -17.160 -6.236 -2.680 1.00 44.35 H new ATOM 0 HD2 LYS A 48 -17.326 -3.991 -1.515 1.00 32.32 H new ATOM 0 HD3 LYS A 48 -19.050 -3.998 -1.831 1.00 32.32 H new ATOM 0 HE2 LYS A 48 -19.305 -6.085 -0.526 1.00 31.51 H new ATOM 0 HE3 LYS A 48 -17.575 -6.148 -0.255 1.00 31.51 H new ATOM 0 HZ1 LYS A 48 -18.725 -5.219 1.642 1.00 4.50 H new ATOM 0 HZ2 LYS A 48 -17.714 -4.046 0.945 1.00 4.50 H new ATOM 0 HZ3 LYS A 48 -19.391 -3.985 0.683 1.00 4.50 H new ATOM 800 N ARG A 49 -15.842 -3.877 -6.588 1.00 43.04 N ATOM 801 CA ARG A 49 -15.585 -2.926 -7.679 1.00 45.23 C ATOM 802 C ARG A 49 -15.067 -3.635 -8.949 1.00 52.42 C ATOM 803 O ARG A 49 -14.762 -2.986 -9.953 1.00 52.12 O ATOM 804 CB ARG A 49 -14.590 -1.846 -7.217 1.00 54.12 C ATOM 805 CG ARG A 49 -13.147 -2.330 -7.105 1.00 55.00 C ATOM 806 CD ARG A 49 -12.245 -1.302 -6.426 1.00 72.55 C ATOM 807 NE ARG A 49 -12.437 0.050 -6.953 1.00 31.33 N ATOM 808 CZ ARG A 49 -11.759 0.571 -7.942 1.00 62.52 C ATOM 809 NH1 ARG A 49 -10.859 -0.113 -8.575 1.00 65.02 N ATOM 810 NH2 ARG A 49 -11.995 1.789 -8.300 1.00 1.34 N ATOM 0 H ARG A 49 -15.097 -3.931 -5.893 1.00 43.04 H new ATOM 0 HA ARG A 49 -16.532 -2.451 -7.937 1.00 45.23 H new ATOM 0 HB2 ARG A 49 -14.628 -1.011 -7.916 1.00 54.12 H new ATOM 0 HB3 ARG A 49 -14.910 -1.465 -6.247 1.00 54.12 H new ATOM 0 HG2 ARG A 49 -13.121 -3.262 -6.541 1.00 55.00 H new ATOM 0 HG3 ARG A 49 -12.761 -2.549 -8.100 1.00 55.00 H new ATOM 0 HD2 ARG A 49 -12.443 -1.302 -5.354 1.00 72.55 H new ATOM 0 HD3 ARG A 49 -11.203 -1.595 -6.558 1.00 72.55 H new ATOM 0 HE ARG A 49 -13.154 0.629 -6.516 1.00 31.33 H new ATOM 0 HH11 ARG A 49 -10.668 -1.078 -8.305 1.00 65.02 H new ATOM 0 HH12 ARG A 49 -10.342 0.313 -9.344 1.00 65.02 H new ATOM 0 HH21 ARG A 49 -12.705 2.335 -7.812 1.00 1.34 H new ATOM 0 HH22 ARG A 49 -11.471 2.205 -9.070 1.00 1.34 H new ATOM 824 N GLY A 50 -14.970 -4.965 -8.900 1.00 42.44 N ATOM 825 CA GLY A 50 -14.585 -5.741 -10.078 1.00 24.42 C ATOM 826 C GLY A 50 -13.081 -5.986 -10.210 1.00 40.33 C ATOM 827 O GLY A 50 -12.541 -5.952 -11.318 1.00 41.43 O ATOM 0 H GLY A 50 -15.151 -5.522 -8.065 1.00 42.44 H new ATOM 0 HA2 GLY A 50 -15.096 -6.703 -10.047 1.00 24.42 H new ATOM 0 HA3 GLY A 50 -14.936 -5.222 -10.970 1.00 24.42 H new ATOM 831 N THR A 51 -12.399 -6.230 -9.091 1.00 43.33 N ATOM 832 CA THR A 51 -10.970 -6.597 -9.117 1.00 23.21 C ATOM 833 C THR A 51 -10.507 -7.236 -7.792 1.00 14.24 C ATOM 834 O THR A 51 -9.928 -6.567 -6.936 1.00 33.21 O ATOM 835 CB THR A 51 -10.054 -5.386 -9.457 1.00 71.21 C ATOM 836 OG1 THR A 51 -8.674 -5.748 -9.297 1.00 13.24 O ATOM 837 CG2 THR A 51 -10.368 -4.172 -8.587 1.00 4.40 C ATOM 0 H THR A 51 -12.804 -6.182 -8.156 1.00 43.33 H new ATOM 0 HA THR A 51 -10.874 -7.337 -9.912 1.00 23.21 H new ATOM 0 HB THR A 51 -10.246 -5.115 -10.495 1.00 71.21 H new ATOM 0 HG1 THR A 51 -8.107 -4.979 -9.515 1.00 13.24 H new ATOM 0 HG21 THR A 51 -9.706 -3.350 -8.857 1.00 4.40 H new ATOM 0 HG22 THR A 51 -11.404 -3.870 -8.743 1.00 4.40 H new ATOM 0 HG23 THR A 51 -10.219 -4.428 -7.538 1.00 4.40 H new ATOM 845 N PRO A 52 -10.780 -8.542 -7.593 1.00 33.42 N ATOM 846 CA PRO A 52 -10.368 -9.266 -6.377 1.00 72.25 C ATOM 847 C PRO A 52 -8.915 -9.778 -6.435 1.00 42.23 C ATOM 848 O PRO A 52 -8.281 -9.773 -7.492 1.00 34.11 O ATOM 849 CB PRO A 52 -11.346 -10.441 -6.347 1.00 12.10 C ATOM 850 CG PRO A 52 -11.611 -10.738 -7.787 1.00 2.43 C ATOM 851 CD PRO A 52 -11.528 -9.417 -8.521 1.00 30.31 C ATOM 0 HA PRO A 52 -10.392 -8.628 -5.494 1.00 72.25 H new ATOM 0 HB2 PRO A 52 -10.917 -11.303 -5.836 1.00 12.10 H new ATOM 0 HB3 PRO A 52 -12.264 -10.181 -5.819 1.00 12.10 H new ATOM 0 HG2 PRO A 52 -10.880 -11.446 -8.178 1.00 2.43 H new ATOM 0 HG3 PRO A 52 -12.594 -11.192 -7.915 1.00 2.43 H new ATOM 0 HD2 PRO A 52 -11.012 -9.522 -9.475 1.00 30.31 H new ATOM 0 HD3 PRO A 52 -12.519 -9.017 -8.737 1.00 30.31 H new ATOM 859 N VAL A 53 -8.399 -10.223 -5.289 1.00 74.20 N ATOM 860 CA VAL A 53 -7.045 -10.793 -5.211 1.00 11.25 C ATOM 861 C VAL A 53 -7.053 -12.294 -5.549 1.00 1.12 C ATOM 862 O VAL A 53 -7.718 -13.083 -4.878 1.00 42.05 O ATOM 863 CB VAL A 53 -6.434 -10.599 -3.795 1.00 52.42 C ATOM 864 CG1 VAL A 53 -5.025 -11.189 -3.709 1.00 2.25 C ATOM 865 CG2 VAL A 53 -6.421 -9.122 -3.409 1.00 41.22 C ATOM 0 H VAL A 53 -8.896 -10.202 -4.398 1.00 74.20 H new ATOM 0 HA VAL A 53 -6.435 -10.262 -5.942 1.00 11.25 H new ATOM 0 HB VAL A 53 -7.065 -11.137 -3.087 1.00 52.42 H new ATOM 0 HG11 VAL A 53 -4.627 -11.036 -2.706 1.00 2.25 H new ATOM 0 HG12 VAL A 53 -5.064 -12.257 -3.925 1.00 2.25 H new ATOM 0 HG13 VAL A 53 -4.379 -10.695 -4.435 1.00 2.25 H new ATOM 0 HG21 VAL A 53 -5.989 -9.010 -2.414 1.00 41.22 H new ATOM 0 HG22 VAL A 53 -5.824 -8.563 -4.129 1.00 41.22 H new ATOM 0 HG23 VAL A 53 -7.441 -8.737 -3.407 1.00 41.22 H new ATOM 875 N ASN A 54 -6.320 -12.683 -6.595 1.00 62.42 N ATOM 876 CA ASN A 54 -6.233 -14.097 -6.990 1.00 61.21 C ATOM 877 C ASN A 54 -5.020 -14.781 -6.340 1.00 71.11 C ATOM 878 O ASN A 54 -5.094 -15.940 -5.934 1.00 74.12 O ATOM 879 CB ASN A 54 -6.151 -14.229 -8.514 1.00 15.41 C ATOM 880 CG ASN A 54 -7.312 -13.554 -9.221 1.00 33.24 C ATOM 881 OD1 ASN A 54 -8.363 -14.149 -9.427 1.00 53.13 O ATOM 882 ND2 ASN A 54 -7.129 -12.310 -9.614 1.00 51.42 N ATOM 0 H ASN A 54 -5.781 -12.047 -7.182 1.00 62.42 H new ATOM 0 HA ASN A 54 -7.138 -14.594 -6.640 1.00 61.21 H new ATOM 0 HB2 ASN A 54 -5.215 -13.793 -8.863 1.00 15.41 H new ATOM 0 HB3 ASN A 54 -6.131 -15.285 -8.783 1.00 15.41 H new ATOM 0 HD21 ASN A 54 -7.874 -11.815 -10.105 1.00 51.42 H new ATOM 0 HD22 ASN A 54 -6.242 -11.841 -9.428 1.00 51.42 H new ATOM 889 N ARG A 55 -3.898 -14.063 -6.266 1.00 54.11 N ATOM 890 CA ARG A 55 -2.687 -14.567 -5.604 1.00 35.00 C ATOM 891 C ARG A 55 -1.951 -13.447 -4.853 1.00 5.11 C ATOM 892 O ARG A 55 -1.933 -12.293 -5.287 1.00 44.01 O ATOM 893 CB ARG A 55 -1.738 -15.231 -6.619 1.00 15.44 C ATOM 894 CG ARG A 55 -2.218 -16.594 -7.119 1.00 61.44 C ATOM 895 CD ARG A 55 -2.329 -17.606 -5.980 1.00 24.22 C ATOM 896 NE ARG A 55 -2.764 -18.921 -6.448 1.00 23.11 N ATOM 897 CZ ARG A 55 -2.425 -20.050 -5.885 1.00 74.50 C ATOM 898 NH1 ARG A 55 -1.685 -20.065 -4.822 1.00 53.12 N ATOM 899 NH2 ARG A 55 -2.841 -21.167 -6.377 1.00 72.03 N ATOM 0 H ARG A 55 -3.800 -13.126 -6.657 1.00 54.11 H new ATOM 0 HA ARG A 55 -3.004 -15.316 -4.878 1.00 35.00 H new ATOM 0 HB2 ARG A 55 -1.613 -14.566 -7.473 1.00 15.44 H new ATOM 0 HB3 ARG A 55 -0.756 -15.349 -6.160 1.00 15.44 H new ATOM 0 HG2 ARG A 55 -3.188 -16.483 -7.603 1.00 61.44 H new ATOM 0 HG3 ARG A 55 -1.526 -16.969 -7.873 1.00 61.44 H new ATOM 0 HD2 ARG A 55 -1.363 -17.700 -5.485 1.00 24.22 H new ATOM 0 HD3 ARG A 55 -3.034 -17.236 -5.235 1.00 24.22 H new ATOM 0 HE ARG A 55 -3.371 -18.959 -7.267 1.00 23.11 H new ATOM 0 HH11 ARG A 55 -1.360 -19.188 -4.415 1.00 53.12 H new ATOM 0 HH12 ARG A 55 -1.428 -20.954 -4.392 1.00 53.12 H new ATOM 0 HH21 ARG A 55 -3.435 -21.169 -7.206 1.00 72.03 H new ATOM 0 HH22 ARG A 55 -2.576 -22.048 -5.937 1.00 72.03 H new ATOM 913 N ILE A 56 -1.343 -13.805 -3.727 1.00 10.03 N ATOM 914 CA ILE A 56 -0.652 -12.841 -2.861 1.00 4.23 C ATOM 915 C ILE A 56 0.744 -12.464 -3.406 1.00 1.33 C ATOM 916 O ILE A 56 1.506 -13.333 -3.835 1.00 40.14 O ATOM 917 CB ILE A 56 -0.513 -13.416 -1.425 1.00 20.31 C ATOM 918 CG1 ILE A 56 -1.903 -13.773 -0.866 1.00 20.14 C ATOM 919 CG2 ILE A 56 0.207 -12.430 -0.500 1.00 52.31 C ATOM 920 CD1 ILE A 56 -1.871 -14.418 0.504 1.00 72.55 C ATOM 0 H ILE A 56 -1.312 -14.766 -3.385 1.00 10.03 H new ATOM 0 HA ILE A 56 -1.257 -11.935 -2.840 1.00 4.23 H new ATOM 0 HB ILE A 56 0.091 -14.322 -1.474 1.00 20.31 H new ATOM 0 HG12 ILE A 56 -2.506 -12.867 -0.815 1.00 20.14 H new ATOM 0 HG13 ILE A 56 -2.400 -14.448 -1.562 1.00 20.14 H new ATOM 0 HG21 ILE A 56 0.289 -12.861 0.498 1.00 52.31 H new ATOM 0 HG22 ILE A 56 1.204 -12.227 -0.891 1.00 52.31 H new ATOM 0 HG23 ILE A 56 -0.359 -11.500 -0.448 1.00 52.31 H new ATOM 0 HD11 ILE A 56 -2.889 -14.638 0.826 1.00 72.55 H new ATOM 0 HD12 ILE A 56 -1.297 -15.343 0.457 1.00 72.55 H new ATOM 0 HD13 ILE A 56 -1.404 -13.737 1.216 1.00 72.55 H new ATOM 932 N PRO A 57 1.091 -11.155 -3.413 1.00 40.11 N ATOM 933 CA PRO A 57 2.431 -10.690 -3.826 1.00 35.24 C ATOM 934 C PRO A 57 3.544 -11.124 -2.854 1.00 24.53 C ATOM 935 O PRO A 57 3.403 -11.019 -1.632 1.00 21.44 O ATOM 936 CB PRO A 57 2.289 -9.159 -3.844 1.00 50.04 C ATOM 937 CG PRO A 57 1.162 -8.868 -2.912 1.00 63.12 C ATOM 938 CD PRO A 57 0.209 -10.029 -3.041 1.00 21.42 C ATOM 0 HA PRO A 57 2.726 -11.116 -4.785 1.00 35.24 H new ATOM 0 HB2 PRO A 57 3.208 -8.673 -3.517 1.00 50.04 H new ATOM 0 HB3 PRO A 57 2.076 -8.794 -4.849 1.00 50.04 H new ATOM 0 HG2 PRO A 57 1.519 -8.768 -1.887 1.00 63.12 H new ATOM 0 HG3 PRO A 57 0.672 -7.930 -3.172 1.00 63.12 H new ATOM 0 HD2 PRO A 57 -0.318 -10.223 -2.106 1.00 21.42 H new ATOM 0 HD3 PRO A 57 -0.549 -9.844 -3.802 1.00 21.42 H new ATOM 946 N ILE A 58 4.655 -11.609 -3.407 1.00 24.24 N ATOM 947 CA ILE A 58 5.785 -12.087 -2.602 1.00 63.13 C ATOM 948 C ILE A 58 7.052 -11.251 -2.861 1.00 62.34 C ATOM 949 O ILE A 58 7.374 -10.931 -4.007 1.00 51.23 O ATOM 950 CB ILE A 58 6.091 -13.580 -2.905 1.00 44.41 C ATOM 951 CG1 ILE A 58 4.835 -14.451 -2.701 1.00 71.12 C ATOM 952 CG2 ILE A 58 7.245 -14.088 -2.039 1.00 25.13 C ATOM 953 CD1 ILE A 58 4.288 -14.434 -1.286 1.00 22.33 C ATOM 0 H ILE A 58 4.800 -11.683 -4.414 1.00 24.24 H new ATOM 0 HA ILE A 58 5.498 -11.981 -1.556 1.00 63.13 H new ATOM 0 HB ILE A 58 6.392 -13.655 -3.950 1.00 44.41 H new ATOM 0 HG12 ILE A 58 4.056 -14.111 -3.383 1.00 71.12 H new ATOM 0 HG13 ILE A 58 5.072 -15.479 -2.975 1.00 71.12 H new ATOM 0 HG21 ILE A 58 7.440 -15.135 -2.270 1.00 25.13 H new ATOM 0 HG22 ILE A 58 8.139 -13.499 -2.243 1.00 25.13 H new ATOM 0 HG23 ILE A 58 6.979 -13.992 -0.986 1.00 25.13 H new ATOM 0 HD11 ILE A 58 3.406 -15.072 -1.229 1.00 22.33 H new ATOM 0 HD12 ILE A 58 5.048 -14.804 -0.598 1.00 22.33 H new ATOM 0 HD13 ILE A 58 4.017 -13.414 -1.013 1.00 22.33 H new ATOM 965 N MET A 59 7.767 -10.903 -1.791 1.00 42.35 N ATOM 966 CA MET A 59 9.016 -10.136 -1.899 1.00 32.42 C ATOM 967 C MET A 59 10.104 -10.712 -0.975 1.00 54.20 C ATOM 968 O MET A 59 9.867 -10.926 0.213 1.00 5.42 O ATOM 969 CB MET A 59 8.763 -8.656 -1.564 1.00 74.15 C ATOM 970 CG MET A 59 10.030 -7.808 -1.513 1.00 12.40 C ATOM 971 SD MET A 59 9.706 -6.053 -1.252 1.00 31.23 S ATOM 972 CE MET A 59 8.870 -5.620 -2.773 1.00 21.51 C ATOM 0 H MET A 59 7.504 -11.140 -0.834 1.00 42.35 H new ATOM 0 HA MET A 59 9.371 -10.212 -2.927 1.00 32.42 H new ATOM 0 HB2 MET A 59 8.086 -8.236 -2.308 1.00 74.15 H new ATOM 0 HB3 MET A 59 8.257 -8.593 -0.601 1.00 74.15 H new ATOM 0 HG2 MET A 59 10.672 -8.175 -0.712 1.00 12.40 H new ATOM 0 HG3 MET A 59 10.580 -7.934 -2.445 1.00 12.40 H new ATOM 0 HE1 MET A 59 8.953 -4.546 -2.941 1.00 21.51 H new ATOM 0 HE2 MET A 59 9.329 -6.154 -3.605 1.00 21.51 H new ATOM 0 HE3 MET A 59 7.818 -5.895 -2.701 1.00 21.51 H new ATOM 982 N ALA A 60 11.292 -10.969 -1.535 1.00 52.33 N ATOM 983 CA ALA A 60 12.433 -11.495 -0.765 1.00 3.10 C ATOM 984 C ALA A 60 12.135 -12.876 -0.162 1.00 21.11 C ATOM 985 O ALA A 60 12.624 -13.209 0.918 1.00 53.42 O ATOM 986 CB ALA A 60 12.830 -10.511 0.332 1.00 42.12 C ATOM 0 H ALA A 60 11.492 -10.821 -2.524 1.00 52.33 H new ATOM 0 HA ALA A 60 13.266 -11.616 -1.458 1.00 3.10 H new ATOM 0 HB1 ALA A 60 13.674 -10.912 0.893 1.00 42.12 H new ATOM 0 HB2 ALA A 60 13.113 -9.559 -0.118 1.00 42.12 H new ATOM 0 HB3 ALA A 60 11.987 -10.357 1.006 1.00 42.12 H new ATOM 992 N LYS A 61 11.343 -13.681 -0.882 1.00 62.45 N ATOM 993 CA LYS A 61 10.906 -15.008 -0.406 1.00 42.33 C ATOM 994 C LYS A 61 9.952 -14.896 0.802 1.00 60.20 C ATOM 995 O LYS A 61 9.560 -15.902 1.397 1.00 75.32 O ATOM 996 CB LYS A 61 12.117 -15.890 -0.045 1.00 63.04 C ATOM 997 CG LYS A 61 13.096 -16.121 -1.196 1.00 44.34 C ATOM 998 CD LYS A 61 12.464 -16.904 -2.347 1.00 2.05 C ATOM 999 CE LYS A 61 12.016 -18.300 -1.917 1.00 73.32 C ATOM 1000 NZ LYS A 61 13.152 -19.146 -1.454 1.00 32.50 N ATOM 0 H LYS A 61 10.987 -13.437 -1.806 1.00 62.45 H new ATOM 0 HA LYS A 61 10.360 -15.478 -1.224 1.00 42.33 H new ATOM 0 HB2 LYS A 61 12.653 -15.428 0.784 1.00 63.04 H new ATOM 0 HB3 LYS A 61 11.755 -16.856 0.307 1.00 63.04 H new ATOM 0 HG2 LYS A 61 13.452 -15.159 -1.566 1.00 44.34 H new ATOM 0 HG3 LYS A 61 13.967 -16.662 -0.826 1.00 44.34 H new ATOM 0 HD2 LYS A 61 11.607 -16.352 -2.733 1.00 2.05 H new ATOM 0 HD3 LYS A 61 13.181 -16.990 -3.163 1.00 2.05 H new ATOM 0 HE2 LYS A 61 11.282 -18.212 -1.116 1.00 73.32 H new ATOM 0 HE3 LYS A 61 11.518 -18.792 -2.753 1.00 73.32 H new ATOM 0 HZ1 LYS A 61 12.820 -20.120 -1.303 1.00 32.50 H new ATOM 0 HZ2 LYS A 61 13.903 -19.144 -2.174 1.00 32.50 H new ATOM 0 HZ3 LYS A 61 13.527 -18.766 -0.562 1.00 32.50 H new ATOM 1014 N GLN A 62 9.582 -13.667 1.154 1.00 24.14 N ATOM 1015 CA GLN A 62 8.655 -13.409 2.257 1.00 3.40 C ATOM 1016 C GLN A 62 7.301 -12.912 1.731 1.00 11.12 C ATOM 1017 O GLN A 62 7.233 -12.209 0.721 1.00 74.23 O ATOM 1018 CB GLN A 62 9.259 -12.371 3.222 1.00 60.53 C ATOM 1019 CG GLN A 62 8.297 -11.872 4.305 1.00 71.14 C ATOM 1020 CD GLN A 62 7.865 -12.952 5.291 1.00 2.32 C ATOM 1021 OE1 GLN A 62 7.810 -14.136 4.966 1.00 64.13 O ATOM 1022 NE2 GLN A 62 7.535 -12.545 6.501 1.00 74.23 N ATOM 0 H GLN A 62 9.914 -12.824 0.686 1.00 24.14 H new ATOM 0 HA GLN A 62 8.492 -14.344 2.792 1.00 3.40 H new ATOM 0 HB2 GLN A 62 10.133 -12.808 3.704 1.00 60.53 H new ATOM 0 HB3 GLN A 62 9.609 -11.516 2.643 1.00 60.53 H new ATOM 0 HG2 GLN A 62 8.774 -11.061 4.855 1.00 71.14 H new ATOM 0 HG3 GLN A 62 7.411 -11.455 3.826 1.00 71.14 H new ATOM 0 HE21 GLN A 62 7.592 -11.555 6.739 1.00 74.23 H new ATOM 0 HE22 GLN A 62 7.223 -13.220 7.199 1.00 74.23 H new ATOM 1031 N VAL A 63 6.224 -13.290 2.413 1.00 73.43 N ATOM 1032 CA VAL A 63 4.889 -12.799 2.066 1.00 51.03 C ATOM 1033 C VAL A 63 4.759 -11.303 2.395 1.00 34.51 C ATOM 1034 O VAL A 63 5.109 -10.865 3.491 1.00 55.13 O ATOM 1035 CB VAL A 63 3.779 -13.596 2.802 1.00 53.32 C ATOM 1036 CG1 VAL A 63 3.963 -13.535 4.319 1.00 40.43 C ATOM 1037 CG2 VAL A 63 2.396 -13.085 2.397 1.00 41.31 C ATOM 0 H VAL A 63 6.246 -13.931 3.206 1.00 73.43 H new ATOM 0 HA VAL A 63 4.759 -12.943 0.993 1.00 51.03 H new ATOM 0 HB VAL A 63 3.860 -14.641 2.504 1.00 53.32 H new ATOM 0 HG11 VAL A 63 3.170 -14.103 4.805 1.00 40.43 H new ATOM 0 HG12 VAL A 63 4.930 -13.961 4.586 1.00 40.43 H new ATOM 0 HG13 VAL A 63 3.921 -12.497 4.649 1.00 40.43 H new ATOM 0 HG21 VAL A 63 1.629 -13.655 2.922 1.00 41.31 H new ATOM 0 HG22 VAL A 63 2.307 -12.030 2.658 1.00 41.31 H new ATOM 0 HG23 VAL A 63 2.264 -13.205 1.322 1.00 41.31 H new ATOM 1047 N LEU A 64 4.275 -10.521 1.438 1.00 63.42 N ATOM 1048 CA LEU A 64 4.145 -9.077 1.628 1.00 1.23 C ATOM 1049 C LEU A 64 2.968 -8.742 2.562 1.00 11.43 C ATOM 1050 O LEU A 64 1.802 -8.869 2.178 1.00 74.24 O ATOM 1051 CB LEU A 64 3.972 -8.382 0.269 1.00 11.51 C ATOM 1052 CG LEU A 64 4.005 -6.843 0.304 1.00 41.11 C ATOM 1053 CD1 LEU A 64 5.330 -6.345 0.876 1.00 41.11 C ATOM 1054 CD2 LEU A 64 3.774 -6.267 -1.093 1.00 40.54 C ATOM 0 H LEU A 64 3.967 -10.858 0.526 1.00 63.42 H new ATOM 0 HA LEU A 64 5.057 -8.710 2.100 1.00 1.23 H new ATOM 0 HB2 LEU A 64 4.759 -8.730 -0.400 1.00 11.51 H new ATOM 0 HB3 LEU A 64 3.023 -8.698 -0.163 1.00 11.51 H new ATOM 0 HG LEU A 64 3.200 -6.500 0.954 1.00 41.11 H new ATOM 0 HD11 LEU A 64 5.333 -5.255 0.892 1.00 41.11 H new ATOM 0 HD12 LEU A 64 5.453 -6.723 1.891 1.00 41.11 H new ATOM 0 HD13 LEU A 64 6.151 -6.701 0.254 1.00 41.11 H new ATOM 0 HD21 LEU A 64 3.801 -5.178 -1.047 1.00 40.54 H new ATOM 0 HD22 LEU A 64 4.555 -6.621 -1.766 1.00 40.54 H new ATOM 0 HD23 LEU A 64 2.801 -6.590 -1.464 1.00 40.54 H new ATOM 1066 N ASP A 65 3.284 -8.344 3.798 1.00 52.34 N ATOM 1067 CA ASP A 65 2.269 -7.929 4.773 1.00 41.41 C ATOM 1068 C ASP A 65 1.363 -6.814 4.209 1.00 41.03 C ATOM 1069 O ASP A 65 1.633 -5.632 4.406 1.00 34.31 O ATOM 1070 CB ASP A 65 2.935 -7.427 6.064 1.00 70.22 C ATOM 1071 CG ASP A 65 3.794 -8.471 6.755 1.00 73.54 C ATOM 1072 OD1 ASP A 65 4.888 -8.778 6.240 1.00 71.42 O ATOM 1073 OD2 ASP A 65 3.392 -8.964 7.833 1.00 62.11 O ATOM 0 H ASP A 65 4.241 -8.300 4.149 1.00 52.34 H new ATOM 0 HA ASP A 65 1.655 -8.803 4.990 1.00 41.41 H new ATOM 0 HB2 ASP A 65 3.552 -6.559 5.830 1.00 70.22 H new ATOM 0 HB3 ASP A 65 2.161 -7.091 6.754 1.00 70.22 H new ATOM 1078 N LEU A 66 0.300 -7.193 3.503 1.00 1.54 N ATOM 1079 CA LEU A 66 -0.644 -6.216 2.935 1.00 63.41 C ATOM 1080 C LEU A 66 -1.245 -5.301 4.019 1.00 52.22 C ATOM 1081 O LEU A 66 -1.362 -4.089 3.827 1.00 71.14 O ATOM 1082 CB LEU A 66 -1.767 -6.936 2.172 1.00 54.55 C ATOM 1083 CG LEU A 66 -1.317 -7.738 0.936 1.00 32.14 C ATOM 1084 CD1 LEU A 66 -2.510 -8.420 0.267 1.00 42.53 C ATOM 1085 CD2 LEU A 66 -0.580 -6.837 -0.058 1.00 54.52 C ATOM 0 H LEU A 66 0.066 -8.166 3.307 1.00 1.54 H new ATOM 0 HA LEU A 66 -0.084 -5.588 2.243 1.00 63.41 H new ATOM 0 HB2 LEU A 66 -2.274 -7.614 2.859 1.00 54.55 H new ATOM 0 HB3 LEU A 66 -2.501 -6.195 1.856 1.00 54.55 H new ATOM 0 HG LEU A 66 -0.626 -8.513 1.269 1.00 32.14 H new ATOM 0 HD11 LEU A 66 -2.168 -8.980 -0.603 1.00 42.53 H new ATOM 0 HD12 LEU A 66 -2.983 -9.101 0.974 1.00 42.53 H new ATOM 0 HD13 LEU A 66 -3.231 -7.666 -0.048 1.00 42.53 H new ATOM 0 HD21 LEU A 66 -0.272 -7.425 -0.923 1.00 54.52 H new ATOM 0 HD22 LEU A 66 -1.243 -6.035 -0.382 1.00 54.52 H new ATOM 0 HD23 LEU A 66 0.300 -6.409 0.422 1.00 54.52 H new ATOM 1097 N PHE A 67 -1.612 -5.887 5.162 1.00 44.22 N ATOM 1098 CA PHE A 67 -2.167 -5.114 6.285 1.00 63.04 C ATOM 1099 C PHE A 67 -1.147 -4.090 6.810 1.00 72.01 C ATOM 1100 O PHE A 67 -1.455 -2.908 6.957 1.00 54.22 O ATOM 1101 CB PHE A 67 -2.592 -6.057 7.425 1.00 22.34 C ATOM 1102 CG PHE A 67 -3.173 -5.345 8.627 1.00 44.21 C ATOM 1103 CD1 PHE A 67 -2.351 -4.878 9.646 1.00 21.51 C ATOM 1104 CD2 PHE A 67 -4.540 -5.139 8.736 1.00 62.13 C ATOM 1105 CE1 PHE A 67 -2.882 -4.223 10.742 1.00 21.13 C ATOM 1106 CE2 PHE A 67 -5.073 -4.486 9.829 1.00 64.21 C ATOM 1107 CZ PHE A 67 -4.243 -4.027 10.833 1.00 64.34 C ATOM 0 H PHE A 67 -1.537 -6.889 5.337 1.00 44.22 H new ATOM 0 HA PHE A 67 -3.041 -4.574 5.920 1.00 63.04 H new ATOM 0 HB2 PHE A 67 -3.329 -6.764 7.043 1.00 22.34 H new ATOM 0 HB3 PHE A 67 -1.727 -6.639 7.743 1.00 22.34 H new ATOM 0 HD1 PHE A 67 -1.284 -5.029 9.581 1.00 21.51 H new ATOM 0 HD2 PHE A 67 -5.196 -5.494 7.955 1.00 62.13 H new ATOM 0 HE1 PHE A 67 -2.231 -3.865 11.526 1.00 21.13 H new ATOM 0 HE2 PHE A 67 -6.140 -4.334 9.899 1.00 64.21 H new ATOM 0 HZ PHE A 67 -4.660 -3.515 11.688 1.00 64.34 H new ATOM 1117 N MET A 68 0.072 -4.554 7.081 1.00 1.33 N ATOM 1118 CA MET A 68 1.122 -3.688 7.630 1.00 0.41 C ATOM 1119 C MET A 68 1.591 -2.664 6.585 1.00 65.32 C ATOM 1120 O MET A 68 1.959 -1.543 6.926 1.00 10.22 O ATOM 1121 CB MET A 68 2.308 -4.524 8.122 1.00 61.11 C ATOM 1122 CG MET A 68 1.917 -5.654 9.068 1.00 12.24 C ATOM 1123 SD MET A 68 1.005 -5.084 10.520 1.00 1.43 S ATOM 1124 CE MET A 68 2.231 -4.033 11.299 1.00 63.13 C ATOM 0 H MET A 68 0.359 -5.521 6.931 1.00 1.33 H new ATOM 0 HA MET A 68 0.702 -3.146 8.477 1.00 0.41 H new ATOM 0 HB2 MET A 68 2.824 -4.947 7.260 1.00 61.11 H new ATOM 0 HB3 MET A 68 3.017 -3.869 8.628 1.00 61.11 H new ATOM 0 HG2 MET A 68 1.309 -6.378 8.526 1.00 12.24 H new ATOM 0 HG3 MET A 68 2.818 -6.174 9.394 1.00 12.24 H new ATOM 0 HE1 MET A 68 1.921 -3.807 12.319 1.00 63.13 H new ATOM 0 HE2 MET A 68 3.192 -4.547 11.318 1.00 63.13 H new ATOM 0 HE3 MET A 68 2.327 -3.105 10.735 1.00 63.13 H new ATOM 1134 N LEU A 69 1.563 -3.063 5.315 1.00 23.45 N ATOM 1135 CA LEU A 69 1.910 -2.169 4.206 1.00 75.33 C ATOM 1136 C LEU A 69 1.020 -0.918 4.231 1.00 33.11 C ATOM 1137 O LEU A 69 1.509 0.212 4.188 1.00 23.23 O ATOM 1138 CB LEU A 69 1.749 -2.911 2.868 1.00 40.04 C ATOM 1139 CG LEU A 69 2.255 -2.161 1.626 1.00 42.30 C ATOM 1140 CD1 LEU A 69 3.755 -1.907 1.729 1.00 0.13 C ATOM 1141 CD2 LEU A 69 1.922 -2.942 0.355 1.00 63.43 C ATOM 0 H LEU A 69 1.302 -4.005 5.025 1.00 23.45 H new ATOM 0 HA LEU A 69 2.948 -1.856 4.315 1.00 75.33 H new ATOM 0 HB2 LEU A 69 2.276 -3.862 2.935 1.00 40.04 H new ATOM 0 HB3 LEU A 69 0.693 -3.141 2.726 1.00 40.04 H new ATOM 0 HG LEU A 69 1.749 -1.197 1.575 1.00 42.30 H new ATOM 0 HD11 LEU A 69 4.096 -1.375 0.841 1.00 0.13 H new ATOM 0 HD12 LEU A 69 3.962 -1.306 2.614 1.00 0.13 H new ATOM 0 HD13 LEU A 69 4.281 -2.859 1.806 1.00 0.13 H new ATOM 0 HD21 LEU A 69 2.288 -2.396 -0.514 1.00 63.43 H new ATOM 0 HD22 LEU A 69 2.398 -3.922 0.395 1.00 63.43 H new ATOM 0 HD23 LEU A 69 0.842 -3.067 0.277 1.00 63.43 H new ATOM 1153 N TYR A 70 -0.291 -1.138 4.324 1.00 72.51 N ATOM 1154 CA TYR A 70 -1.260 -0.047 4.463 1.00 72.34 C ATOM 1155 C TYR A 70 -0.925 0.840 5.678 1.00 13.03 C ATOM 1156 O TYR A 70 -0.855 2.063 5.565 1.00 44.11 O ATOM 1157 CB TYR A 70 -2.678 -0.628 4.598 1.00 64.41 C ATOM 1158 CG TYR A 70 -3.765 0.401 4.885 1.00 43.34 C ATOM 1159 CD1 TYR A 70 -4.373 1.118 3.855 1.00 33.44 C ATOM 1160 CD2 TYR A 70 -4.190 0.646 6.189 1.00 34.32 C ATOM 1161 CE1 TYR A 70 -5.367 2.044 4.121 1.00 11.44 C ATOM 1162 CE2 TYR A 70 -5.180 1.570 6.458 1.00 33.14 C ATOM 1163 CZ TYR A 70 -5.766 2.266 5.422 1.00 0.32 C ATOM 1164 OH TYR A 70 -6.755 3.187 5.693 1.00 54.20 O ATOM 0 H TYR A 70 -0.710 -2.068 4.306 1.00 72.51 H new ATOM 0 HA TYR A 70 -1.211 0.577 3.571 1.00 72.34 H new ATOM 0 HB2 TYR A 70 -2.929 -1.154 3.677 1.00 64.41 H new ATOM 0 HB3 TYR A 70 -2.678 -1.368 5.398 1.00 64.41 H new ATOM 0 HD1 TYR A 70 -4.064 0.948 2.834 1.00 33.44 H new ATOM 0 HD2 TYR A 70 -3.736 0.103 7.005 1.00 34.32 H new ATOM 0 HE1 TYR A 70 -5.828 2.591 3.312 1.00 11.44 H new ATOM 0 HE2 TYR A 70 -5.494 1.747 7.476 1.00 33.14 H new ATOM 0 HH TYR A 70 -7.432 2.779 6.273 1.00 54.20 H new ATOM 1174 N VAL A 71 -0.710 0.210 6.835 1.00 53.52 N ATOM 1175 CA VAL A 71 -0.388 0.940 8.073 1.00 31.54 C ATOM 1176 C VAL A 71 0.846 1.846 7.907 1.00 63.42 C ATOM 1177 O VAL A 71 0.770 3.055 8.131 1.00 2.13 O ATOM 1178 CB VAL A 71 -0.149 -0.031 9.259 1.00 44.54 C ATOM 1179 CG1 VAL A 71 0.218 0.734 10.533 1.00 43.15 C ATOM 1180 CG2 VAL A 71 -1.378 -0.910 9.488 1.00 44.23 C ATOM 0 H VAL A 71 -0.752 -0.803 6.945 1.00 53.52 H new ATOM 0 HA VAL A 71 -1.254 1.566 8.289 1.00 31.54 H new ATOM 0 HB VAL A 71 0.692 -0.676 9.004 1.00 44.54 H new ATOM 0 HG11 VAL A 71 0.380 0.028 11.348 1.00 43.15 H new ATOM 0 HG12 VAL A 71 1.129 1.307 10.363 1.00 43.15 H new ATOM 0 HG13 VAL A 71 -0.593 1.412 10.797 1.00 43.15 H new ATOM 0 HG21 VAL A 71 -1.192 -1.585 10.324 1.00 44.23 H new ATOM 0 HG22 VAL A 71 -2.239 -0.280 9.714 1.00 44.23 H new ATOM 0 HG23 VAL A 71 -1.581 -1.493 8.589 1.00 44.23 H new ATOM 1190 N LEU A 72 1.971 1.258 7.495 1.00 70.20 N ATOM 1191 CA LEU A 72 3.227 2.003 7.331 1.00 51.41 C ATOM 1192 C LEU A 72 3.102 3.133 6.291 1.00 44.32 C ATOM 1193 O LEU A 72 3.482 4.273 6.558 1.00 21.51 O ATOM 1194 CB LEU A 72 4.384 1.056 6.949 1.00 13.32 C ATOM 1195 CG LEU A 72 5.065 0.315 8.119 1.00 10.13 C ATOM 1196 CD1 LEU A 72 5.727 1.306 9.074 1.00 1.01 C ATOM 1197 CD2 LEU A 72 4.074 -0.570 8.872 1.00 71.44 C ATOM 0 H LEU A 72 2.041 0.266 7.268 1.00 70.20 H new ATOM 0 HA LEU A 72 3.448 2.463 8.294 1.00 51.41 H new ATOM 0 HB2 LEU A 72 4.003 0.314 6.247 1.00 13.32 H new ATOM 0 HB3 LEU A 72 5.142 1.635 6.421 1.00 13.32 H new ATOM 0 HG LEU A 72 5.836 -0.330 7.696 1.00 10.13 H new ATOM 0 HD11 LEU A 72 6.201 0.762 9.891 1.00 1.01 H new ATOM 0 HD12 LEU A 72 6.480 1.882 8.536 1.00 1.01 H new ATOM 0 HD13 LEU A 72 4.973 1.982 9.477 1.00 1.01 H new ATOM 0 HD21 LEU A 72 4.587 -1.077 9.689 1.00 71.44 H new ATOM 0 HD22 LEU A 72 3.270 0.046 9.275 1.00 71.44 H new ATOM 0 HD23 LEU A 72 3.657 -1.311 8.190 1.00 71.44 H new ATOM 1209 N VAL A 73 2.570 2.823 5.110 1.00 74.32 N ATOM 1210 CA VAL A 73 2.428 3.827 4.048 1.00 42.44 C ATOM 1211 C VAL A 73 1.521 4.997 4.482 1.00 31.21 C ATOM 1212 O VAL A 73 1.811 6.161 4.190 1.00 33.32 O ATOM 1213 CB VAL A 73 1.879 3.198 2.740 1.00 64.52 C ATOM 1214 CG1 VAL A 73 1.633 4.266 1.672 1.00 73.41 C ATOM 1215 CG2 VAL A 73 2.838 2.129 2.215 1.00 43.42 C ATOM 0 H VAL A 73 2.232 1.893 4.862 1.00 74.32 H new ATOM 0 HA VAL A 73 3.427 4.218 3.857 1.00 42.44 H new ATOM 0 HB VAL A 73 0.923 2.727 2.971 1.00 64.52 H new ATOM 0 HG11 VAL A 73 1.249 3.794 0.768 1.00 73.41 H new ATOM 0 HG12 VAL A 73 0.906 4.989 2.041 1.00 73.41 H new ATOM 0 HG13 VAL A 73 2.569 4.776 1.445 1.00 73.41 H new ATOM 0 HG21 VAL A 73 2.436 1.699 1.297 1.00 43.42 H new ATOM 0 HG22 VAL A 73 3.809 2.580 2.010 1.00 43.42 H new ATOM 0 HG23 VAL A 73 2.953 1.345 2.963 1.00 43.42 H new ATOM 1225 N THR A 74 0.430 4.689 5.190 1.00 70.40 N ATOM 1226 CA THR A 74 -0.511 5.727 5.647 1.00 0.03 C ATOM 1227 C THR A 74 0.091 6.619 6.745 1.00 42.32 C ATOM 1228 O THR A 74 -0.011 7.844 6.674 1.00 65.42 O ATOM 1229 CB THR A 74 -1.850 5.137 6.158 1.00 3.41 C ATOM 1230 OG1 THR A 74 -1.619 4.199 7.221 1.00 72.11 O ATOM 1231 CG2 THR A 74 -2.617 4.459 5.026 1.00 73.32 C ATOM 0 H THR A 74 0.174 3.739 5.459 1.00 70.40 H new ATOM 0 HA THR A 74 -0.711 6.334 4.764 1.00 0.03 H new ATOM 0 HB THR A 74 -2.451 5.962 6.540 1.00 3.41 H new ATOM 0 HG1 THR A 74 -1.331 3.342 6.844 1.00 72.11 H new ATOM 0 HG21 THR A 74 -3.552 4.054 5.412 1.00 73.32 H new ATOM 0 HG22 THR A 74 -2.832 5.188 4.245 1.00 73.32 H new ATOM 0 HG23 THR A 74 -2.015 3.650 4.612 1.00 73.32 H new ATOM 1239 N GLU A 75 0.723 6.013 7.755 1.00 15.44 N ATOM 1240 CA GLU A 75 1.332 6.785 8.852 1.00 10.01 C ATOM 1241 C GLU A 75 2.452 7.710 8.340 1.00 10.14 C ATOM 1242 O GLU A 75 2.676 8.795 8.884 1.00 24.15 O ATOM 1243 CB GLU A 75 1.887 5.853 9.947 1.00 3.10 C ATOM 1244 CG GLU A 75 3.037 4.959 9.489 1.00 61.42 C ATOM 1245 CD GLU A 75 3.688 4.198 10.635 1.00 14.15 C ATOM 1246 OE1 GLU A 75 3.088 3.217 11.123 1.00 32.42 O ATOM 1247 OE2 GLU A 75 4.796 4.590 11.065 1.00 40.34 O ATOM 0 H GLU A 75 0.828 5.002 7.839 1.00 15.44 H new ATOM 0 HA GLU A 75 0.543 7.403 9.281 1.00 10.01 H new ATOM 0 HB2 GLU A 75 2.226 6.460 10.786 1.00 3.10 H new ATOM 0 HB3 GLU A 75 1.078 5.223 10.316 1.00 3.10 H new ATOM 0 HG2 GLU A 75 2.666 4.247 8.751 1.00 61.42 H new ATOM 0 HG3 GLU A 75 3.790 5.570 8.991 1.00 61.42 H new ATOM 1254 N LYS A 76 3.153 7.275 7.290 1.00 33.13 N ATOM 1255 CA LYS A 76 4.219 8.083 6.682 1.00 42.25 C ATOM 1256 C LYS A 76 3.646 9.232 5.832 1.00 42.42 C ATOM 1257 O LYS A 76 4.372 10.153 5.457 1.00 0.11 O ATOM 1258 CB LYS A 76 5.147 7.205 5.827 1.00 13.34 C ATOM 1259 CG LYS A 76 5.884 6.118 6.611 1.00 13.45 C ATOM 1260 CD LYS A 76 6.811 6.696 7.683 1.00 21.44 C ATOM 1261 CE LYS A 76 7.615 5.602 8.381 1.00 11.30 C ATOM 1262 NZ LYS A 76 8.562 6.152 9.393 1.00 63.24 N ATOM 0 H LYS A 76 3.004 6.371 6.842 1.00 33.13 H new ATOM 0 HA LYS A 76 4.797 8.522 7.495 1.00 42.25 H new ATOM 0 HB2 LYS A 76 4.558 6.733 5.040 1.00 13.34 H new ATOM 0 HB3 LYS A 76 5.881 7.844 5.336 1.00 13.34 H new ATOM 0 HG2 LYS A 76 5.156 5.457 7.082 1.00 13.45 H new ATOM 0 HG3 LYS A 76 6.467 5.509 5.921 1.00 13.45 H new ATOM 0 HD2 LYS A 76 7.492 7.414 7.227 1.00 21.44 H new ATOM 0 HD3 LYS A 76 6.221 7.241 8.420 1.00 21.44 H new ATOM 0 HE2 LYS A 76 6.931 4.906 8.867 1.00 11.30 H new ATOM 0 HE3 LYS A 76 8.172 5.033 7.637 1.00 11.30 H new ATOM 0 HZ1 LYS A 76 9.460 5.630 9.348 1.00 63.24 H new ATOM 0 HZ2 LYS A 76 8.736 7.158 9.195 1.00 63.24 H new ATOM 0 HZ3 LYS A 76 8.151 6.052 10.343 1.00 63.24 H new ATOM 1276 N GLY A 77 2.344 9.184 5.535 1.00 44.30 N ATOM 1277 CA GLY A 77 1.707 10.275 4.798 1.00 34.41 C ATOM 1278 C GLY A 77 0.775 9.821 3.674 1.00 24.45 C ATOM 1279 O GLY A 77 -0.079 10.587 3.226 1.00 20.03 O ATOM 0 H GLY A 77 1.722 8.416 5.788 1.00 44.30 H new ATOM 0 HA2 GLY A 77 1.139 10.887 5.499 1.00 34.41 H new ATOM 0 HA3 GLY A 77 2.483 10.912 4.374 1.00 34.41 H new ATOM 1283 N GLY A 78 0.937 8.588 3.206 1.00 70.14 N ATOM 1284 CA GLY A 78 0.126 8.088 2.095 1.00 60.51 C ATOM 1285 C GLY A 78 0.965 7.730 0.875 1.00 45.22 C ATOM 1286 O GLY A 78 2.135 8.095 0.801 1.00 61.40 O ATOM 0 H GLY A 78 1.615 7.920 3.572 1.00 70.14 H new ATOM 0 HA2 GLY A 78 -0.429 7.208 2.421 1.00 60.51 H new ATOM 0 HA3 GLY A 78 -0.609 8.843 1.817 1.00 60.51 H new ATOM 1290 N LEU A 79 0.365 7.033 -0.094 1.00 72.40 N ATOM 1291 CA LEU A 79 1.102 6.513 -1.262 1.00 42.02 C ATOM 1292 C LEU A 79 2.000 7.580 -1.919 1.00 40.21 C ATOM 1293 O LEU A 79 3.222 7.432 -1.960 1.00 45.02 O ATOM 1294 CB LEU A 79 0.119 5.944 -2.298 1.00 62.20 C ATOM 1295 CG LEU A 79 0.763 5.368 -3.576 1.00 13.41 C ATOM 1296 CD1 LEU A 79 1.771 4.271 -3.236 1.00 31.14 C ATOM 1297 CD2 LEU A 79 -0.308 4.838 -4.530 1.00 40.14 C ATOM 0 H LEU A 79 -0.631 6.813 -0.098 1.00 72.40 H new ATOM 0 HA LEU A 79 1.756 5.720 -0.899 1.00 42.02 H new ATOM 0 HB2 LEU A 79 -0.469 5.159 -1.823 1.00 62.20 H new ATOM 0 HB3 LEU A 79 -0.576 6.733 -2.586 1.00 62.20 H new ATOM 0 HG LEU A 79 1.299 6.176 -4.075 1.00 13.41 H new ATOM 0 HD11 LEU A 79 2.210 3.883 -4.155 1.00 31.14 H new ATOM 0 HD12 LEU A 79 2.558 4.683 -2.604 1.00 31.14 H new ATOM 0 HD13 LEU A 79 1.265 3.464 -2.706 1.00 31.14 H new ATOM 0 HD21 LEU A 79 0.168 4.436 -5.425 1.00 40.14 H new ATOM 0 HD22 LEU A 79 -0.877 4.050 -4.037 1.00 40.14 H new ATOM 0 HD23 LEU A 79 -0.980 5.649 -4.810 1.00 40.14 H new ATOM 1309 N VAL A 80 1.394 8.654 -2.422 1.00 14.43 N ATOM 1310 CA VAL A 80 2.149 9.705 -3.118 1.00 63.35 C ATOM 1311 C VAL A 80 3.185 10.379 -2.204 1.00 32.23 C ATOM 1312 O VAL A 80 4.326 10.604 -2.611 1.00 21.21 O ATOM 1313 CB VAL A 80 1.209 10.779 -3.706 1.00 41.32 C ATOM 1314 CG1 VAL A 80 2.009 11.883 -4.402 1.00 22.14 C ATOM 1315 CG2 VAL A 80 0.219 10.136 -4.669 1.00 42.42 C ATOM 0 H VAL A 80 0.390 8.823 -2.364 1.00 14.43 H new ATOM 0 HA VAL A 80 2.680 9.210 -3.931 1.00 63.35 H new ATOM 0 HB VAL A 80 0.652 11.238 -2.889 1.00 41.32 H new ATOM 0 HG11 VAL A 80 1.324 12.628 -4.808 1.00 22.14 H new ATOM 0 HG12 VAL A 80 2.676 12.358 -3.683 1.00 22.14 H new ATOM 0 HG13 VAL A 80 2.597 11.451 -5.212 1.00 22.14 H new ATOM 0 HG21 VAL A 80 -0.440 10.902 -5.079 1.00 42.42 H new ATOM 0 HG22 VAL A 80 0.763 9.653 -5.481 1.00 42.42 H new ATOM 0 HG23 VAL A 80 -0.375 9.393 -4.137 1.00 42.42 H new ATOM 1325 N GLU A 81 2.789 10.692 -0.971 1.00 65.21 N ATOM 1326 CA GLU A 81 3.711 11.298 -0.002 1.00 10.14 C ATOM 1327 C GLU A 81 4.961 10.424 0.189 1.00 42.32 C ATOM 1328 O GLU A 81 6.083 10.921 0.185 1.00 24.44 O ATOM 1329 CB GLU A 81 3.011 11.522 1.348 1.00 74.44 C ATOM 1330 CG GLU A 81 3.895 12.179 2.412 1.00 41.30 C ATOM 1331 CD GLU A 81 4.267 13.623 2.085 1.00 21.14 C ATOM 1332 OE1 GLU A 81 5.109 13.843 1.190 1.00 10.44 O ATOM 1333 OE2 GLU A 81 3.720 14.546 2.730 1.00 23.43 O ATOM 0 H GLU A 81 1.844 10.539 -0.618 1.00 65.21 H new ATOM 0 HA GLU A 81 4.023 12.264 -0.398 1.00 10.14 H new ATOM 0 HB2 GLU A 81 2.130 12.144 1.189 1.00 74.44 H new ATOM 0 HB3 GLU A 81 2.659 10.562 1.726 1.00 74.44 H new ATOM 0 HG2 GLU A 81 3.377 12.153 3.371 1.00 41.30 H new ATOM 0 HG3 GLU A 81 4.807 11.594 2.527 1.00 41.30 H new ATOM 1340 N VAL A 82 4.762 9.115 0.336 1.00 64.05 N ATOM 1341 CA VAL A 82 5.878 8.174 0.475 1.00 73.53 C ATOM 1342 C VAL A 82 6.754 8.145 -0.794 1.00 25.33 C ATOM 1343 O VAL A 82 7.983 8.039 -0.715 1.00 44.14 O ATOM 1344 CB VAL A 82 5.371 6.740 0.797 1.00 2.04 C ATOM 1345 CG1 VAL A 82 6.530 5.751 0.897 1.00 31.21 C ATOM 1346 CG2 VAL A 82 4.559 6.740 2.091 1.00 13.55 C ATOM 0 H VAL A 82 3.840 8.680 0.362 1.00 64.05 H new ATOM 0 HA VAL A 82 6.487 8.525 1.308 1.00 73.53 H new ATOM 0 HB VAL A 82 4.728 6.421 -0.023 1.00 2.04 H new ATOM 0 HG11 VAL A 82 6.142 4.758 1.123 1.00 31.21 H new ATOM 0 HG12 VAL A 82 7.068 5.724 -0.051 1.00 31.21 H new ATOM 0 HG13 VAL A 82 7.209 6.065 1.690 1.00 31.21 H new ATOM 0 HG21 VAL A 82 4.211 5.729 2.302 1.00 13.55 H new ATOM 0 HG22 VAL A 82 5.185 7.088 2.913 1.00 13.55 H new ATOM 0 HG23 VAL A 82 3.701 7.403 1.982 1.00 13.55 H new ATOM 1356 N ILE A 83 6.119 8.258 -1.962 1.00 3.35 N ATOM 1357 CA ILE A 83 6.846 8.285 -3.236 1.00 2.24 C ATOM 1358 C ILE A 83 7.694 9.564 -3.372 1.00 42.31 C ATOM 1359 O ILE A 83 8.823 9.520 -3.870 1.00 43.41 O ATOM 1360 CB ILE A 83 5.877 8.171 -4.447 1.00 63.41 C ATOM 1361 CG1 ILE A 83 5.059 6.870 -4.366 1.00 3.42 C ATOM 1362 CG2 ILE A 83 6.646 8.234 -5.766 1.00 43.21 C ATOM 1363 CD1 ILE A 83 4.032 6.718 -5.472 1.00 63.13 C ATOM 0 H ILE A 83 5.106 8.332 -2.054 1.00 3.35 H new ATOM 0 HA ILE A 83 7.511 7.421 -3.238 1.00 2.24 H new ATOM 0 HB ILE A 83 5.189 9.016 -4.410 1.00 63.41 H new ATOM 0 HG12 ILE A 83 5.742 6.021 -4.399 1.00 3.42 H new ATOM 0 HG13 ILE A 83 4.549 6.832 -3.403 1.00 3.42 H new ATOM 0 HG21 ILE A 83 5.947 8.152 -6.599 1.00 43.21 H new ATOM 0 HG22 ILE A 83 7.179 9.182 -5.831 1.00 43.21 H new ATOM 0 HG23 ILE A 83 7.361 7.412 -5.810 1.00 43.21 H new ATOM 0 HD11 ILE A 83 3.497 5.777 -5.345 1.00 63.13 H new ATOM 0 HD12 ILE A 83 3.325 7.546 -5.428 1.00 63.13 H new ATOM 0 HD13 ILE A 83 4.535 6.722 -6.439 1.00 63.13 H new ATOM 1375 N ASN A 84 7.150 10.696 -2.914 1.00 13.13 N ATOM 1376 CA ASN A 84 7.867 11.983 -2.963 1.00 21.43 C ATOM 1377 C ASN A 84 8.955 12.069 -1.880 1.00 42.55 C ATOM 1378 O ASN A 84 10.076 12.507 -2.146 1.00 25.21 O ATOM 1379 CB ASN A 84 6.888 13.153 -2.812 1.00 54.12 C ATOM 1380 CG ASN A 84 5.906 13.240 -3.964 1.00 55.22 C ATOM 1381 OD1 ASN A 84 6.196 12.816 -5.076 1.00 14.15 O ATOM 1382 ND2 ASN A 84 4.747 13.812 -3.716 1.00 51.43 N ATOM 0 H ASN A 84 6.217 10.752 -2.505 1.00 13.13 H new ATOM 0 HA ASN A 84 8.353 12.046 -3.937 1.00 21.43 H new ATOM 0 HB2 ASN A 84 6.338 13.044 -1.877 1.00 54.12 H new ATOM 0 HB3 ASN A 84 7.449 14.085 -2.745 1.00 54.12 H new ATOM 0 HD21 ASN A 84 4.058 13.913 -4.462 1.00 51.43 H new ATOM 0 HD22 ASN A 84 4.537 14.154 -2.778 1.00 51.43 H new ATOM 1389 N LYS A 85 8.614 11.651 -0.661 1.00 1.54 N ATOM 1390 CA LYS A 85 9.574 11.605 0.453 1.00 41.20 C ATOM 1391 C LYS A 85 10.652 10.535 0.215 1.00 54.34 C ATOM 1392 O LYS A 85 11.688 10.530 0.876 1.00 62.32 O ATOM 1393 CB LYS A 85 8.842 11.309 1.775 1.00 45.15 C ATOM 1394 CG LYS A 85 7.917 12.426 2.269 1.00 13.44 C ATOM 1395 CD LYS A 85 8.592 13.365 3.273 1.00 21.34 C ATOM 1396 CE LYS A 85 9.809 14.071 2.691 1.00 13.34 C ATOM 1397 NZ LYS A 85 10.363 15.086 3.625 1.00 2.31 N ATOM 0 H LYS A 85 7.675 11.337 -0.414 1.00 1.54 H new ATOM 0 HA LYS A 85 10.059 12.579 0.514 1.00 41.20 H new ATOM 0 HB2 LYS A 85 8.254 10.400 1.651 1.00 45.15 H new ATOM 0 HB3 LYS A 85 9.585 11.106 2.546 1.00 45.15 H new ATOM 0 HG2 LYS A 85 7.570 13.007 1.414 1.00 13.44 H new ATOM 0 HG3 LYS A 85 7.036 11.982 2.732 1.00 13.44 H new ATOM 0 HD2 LYS A 85 7.871 14.110 3.609 1.00 21.34 H new ATOM 0 HD3 LYS A 85 8.894 12.795 4.152 1.00 21.34 H new ATOM 0 HE2 LYS A 85 10.578 13.335 2.458 1.00 13.34 H new ATOM 0 HE3 LYS A 85 9.534 14.553 1.753 1.00 13.34 H new ATOM 0 HZ1 LYS A 85 11.190 15.543 3.190 1.00 2.31 H new ATOM 0 HZ2 LYS A 85 9.638 15.803 3.828 1.00 2.31 H new ATOM 0 HZ3 LYS A 85 10.649 14.623 4.511 1.00 2.31 H new ATOM 1411 N LYS A 86 10.377 9.616 -0.720 1.00 2.12 N ATOM 1412 CA LYS A 86 11.345 8.588 -1.138 1.00 65.12 C ATOM 1413 C LYS A 86 11.680 7.594 -0.007 1.00 43.22 C ATOM 1414 O LYS A 86 12.486 6.680 -0.198 1.00 22.23 O ATOM 1415 CB LYS A 86 12.634 9.259 -1.648 1.00 64.53 C ATOM 1416 CG LYS A 86 12.401 10.275 -2.767 1.00 74.33 C ATOM 1417 CD LYS A 86 12.013 9.606 -4.082 1.00 3.32 C ATOM 1418 CE LYS A 86 13.208 8.932 -4.746 1.00 13.31 C ATOM 1419 NZ LYS A 86 14.219 9.926 -5.202 1.00 52.32 N ATOM 0 H LYS A 86 9.482 9.562 -1.207 1.00 2.12 H new ATOM 0 HA LYS A 86 10.881 8.015 -1.941 1.00 65.12 H new ATOM 0 HB2 LYS A 86 13.127 9.758 -0.814 1.00 64.53 H new ATOM 0 HB3 LYS A 86 13.316 8.488 -2.006 1.00 64.53 H new ATOM 0 HG2 LYS A 86 11.615 10.968 -2.468 1.00 74.33 H new ATOM 0 HG3 LYS A 86 13.306 10.864 -2.914 1.00 74.33 H new ATOM 0 HD2 LYS A 86 11.234 8.866 -3.898 1.00 3.32 H new ATOM 0 HD3 LYS A 86 11.593 10.350 -4.759 1.00 3.32 H new ATOM 0 HE2 LYS A 86 13.671 8.238 -4.044 1.00 13.31 H new ATOM 0 HE3 LYS A 86 12.867 8.343 -5.598 1.00 13.31 H new ATOM 0 HZ1 LYS A 86 14.681 9.579 -6.067 1.00 52.32 H new ATOM 0 HZ2 LYS A 86 13.750 10.833 -5.400 1.00 52.32 H new ATOM 0 HZ3 LYS A 86 14.933 10.061 -4.458 1.00 52.32 H new ATOM 1433 N LEU A 87 11.018 7.733 1.142 1.00 0.32 N ATOM 1434 CA LEU A 87 11.386 6.981 2.353 1.00 63.01 C ATOM 1435 C LEU A 87 10.832 5.535 2.354 1.00 63.43 C ATOM 1436 O LEU A 87 10.589 4.957 3.413 1.00 25.52 O ATOM 1437 CB LEU A 87 10.925 7.747 3.618 1.00 0.10 C ATOM 1438 CG LEU A 87 9.454 7.566 4.050 1.00 64.20 C ATOM 1439 CD1 LEU A 87 9.168 8.363 5.321 1.00 74.22 C ATOM 1440 CD2 LEU A 87 8.491 7.969 2.943 1.00 4.45 C ATOM 0 H LEU A 87 10.222 8.359 1.265 1.00 0.32 H new ATOM 0 HA LEU A 87 12.473 6.895 2.359 1.00 63.01 H new ATOM 0 HB2 LEU A 87 11.562 7.443 4.449 1.00 0.10 H new ATOM 0 HB3 LEU A 87 11.101 8.810 3.453 1.00 0.10 H new ATOM 0 HG LEU A 87 9.299 6.507 4.255 1.00 64.20 H new ATOM 0 HD11 LEU A 87 8.127 8.224 5.611 1.00 74.22 H new ATOM 0 HD12 LEU A 87 9.818 8.014 6.123 1.00 74.22 H new ATOM 0 HD13 LEU A 87 9.355 9.421 5.137 1.00 74.22 H new ATOM 0 HD21 LEU A 87 7.465 7.828 3.284 1.00 4.45 H new ATOM 0 HD22 LEU A 87 8.648 9.017 2.688 1.00 4.45 H new ATOM 0 HD23 LEU A 87 8.669 7.351 2.063 1.00 4.45 H new ATOM 1452 N TRP A 88 10.681 4.934 1.168 1.00 65.23 N ATOM 1453 CA TRP A 88 10.216 3.537 1.055 1.00 11.54 C ATOM 1454 C TRP A 88 11.082 2.571 1.889 1.00 20.52 C ATOM 1455 O TRP A 88 10.645 1.474 2.233 1.00 54.15 O ATOM 1456 CB TRP A 88 10.197 3.081 -0.416 1.00 51.52 C ATOM 1457 CG TRP A 88 9.035 3.613 -1.209 1.00 51.21 C ATOM 1458 CD1 TRP A 88 9.048 4.639 -2.111 1.00 23.45 C ATOM 1459 CD2 TRP A 88 7.684 3.135 -1.168 1.00 75.32 C ATOM 1460 NE1 TRP A 88 7.790 4.822 -2.636 1.00 51.42 N ATOM 1461 CE2 TRP A 88 6.936 3.912 -2.072 1.00 12.32 C ATOM 1462 CE3 TRP A 88 7.038 2.121 -0.458 1.00 2.44 C ATOM 1463 CZ2 TRP A 88 5.572 3.710 -2.277 1.00 51.55 C ATOM 1464 CZ3 TRP A 88 5.685 1.922 -0.663 1.00 52.55 C ATOM 1465 CH2 TRP A 88 4.966 2.712 -1.568 1.00 10.25 C ATOM 0 H TRP A 88 10.872 5.386 0.274 1.00 65.23 H new ATOM 0 HA TRP A 88 9.201 3.509 1.452 1.00 11.54 H new ATOM 0 HB2 TRP A 88 11.124 3.396 -0.895 1.00 51.52 H new ATOM 0 HB3 TRP A 88 10.176 1.992 -0.447 1.00 51.52 H new ATOM 0 HD1 TRP A 88 9.919 5.221 -2.373 1.00 23.45 H new ATOM 0 HE1 TRP A 88 7.535 5.522 -3.333 1.00 51.42 H new ATOM 0 HE3 TRP A 88 7.585 1.503 0.239 1.00 2.44 H new ATOM 0 HZ2 TRP A 88 5.014 4.321 -2.972 1.00 51.55 H new ATOM 0 HZ3 TRP A 88 5.174 1.144 -0.116 1.00 52.55 H new ATOM 0 HH2 TRP A 88 3.911 2.529 -1.708 1.00 10.25 H new ATOM 1476 N ARG A 89 12.307 2.990 2.210 1.00 53.01 N ATOM 1477 CA ARG A 89 13.203 2.200 3.069 1.00 53.20 C ATOM 1478 C ARG A 89 12.585 1.967 4.462 1.00 44.41 C ATOM 1479 O ARG A 89 12.865 0.966 5.122 1.00 52.01 O ATOM 1480 CB ARG A 89 14.561 2.903 3.203 1.00 75.31 C ATOM 1481 CG ARG A 89 14.483 4.286 3.843 1.00 53.02 C ATOM 1482 CD ARG A 89 15.854 4.944 3.928 1.00 4.23 C ATOM 1483 NE ARG A 89 15.803 6.255 4.573 1.00 14.22 N ATOM 1484 CZ ARG A 89 16.855 6.969 4.868 1.00 44.24 C ATOM 1485 NH1 ARG A 89 18.045 6.554 4.565 1.00 74.21 N ATOM 1486 NH2 ARG A 89 16.710 8.107 5.462 1.00 55.44 N ATOM 0 H ARG A 89 12.706 3.873 1.890 1.00 53.01 H new ATOM 0 HA ARG A 89 13.347 1.227 2.600 1.00 53.20 H new ATOM 0 HB2 ARG A 89 15.226 2.276 3.797 1.00 75.31 H new ATOM 0 HB3 ARG A 89 15.010 2.996 2.214 1.00 75.31 H new ATOM 0 HG2 ARG A 89 13.811 4.918 3.263 1.00 53.02 H new ATOM 0 HG3 ARG A 89 14.057 4.201 4.843 1.00 53.02 H new ATOM 0 HD2 ARG A 89 16.532 4.295 4.483 1.00 4.23 H new ATOM 0 HD3 ARG A 89 16.265 5.051 2.924 1.00 4.23 H new ATOM 0 HE ARG A 89 14.886 6.636 4.808 1.00 14.22 H new ATOM 0 HH11 ARG A 89 18.168 5.660 4.090 1.00 74.21 H new ATOM 0 HH12 ARG A 89 18.859 7.122 4.801 1.00 74.21 H new ATOM 0 HH21 ARG A 89 15.777 8.444 5.698 1.00 55.44 H new ATOM 0 HH22 ARG A 89 17.529 8.669 5.695 1.00 55.44 H new ATOM 1500 N GLU A 90 11.754 2.912 4.904 1.00 64.24 N ATOM 1501 CA GLU A 90 10.990 2.762 6.149 1.00 72.11 C ATOM 1502 C GLU A 90 9.945 1.649 6.014 1.00 73.34 C ATOM 1503 O GLU A 90 9.715 0.875 6.944 1.00 71.30 O ATOM 1504 CB GLU A 90 10.286 4.082 6.500 1.00 51.15 C ATOM 1505 CG GLU A 90 11.223 5.186 6.977 1.00 34.04 C ATOM 1506 CD GLU A 90 11.801 4.905 8.355 1.00 14.35 C ATOM 1507 OE1 GLU A 90 11.025 4.901 9.336 1.00 72.14 O ATOM 1508 OE2 GLU A 90 13.024 4.680 8.464 1.00 24.22 O ATOM 0 H GLU A 90 11.591 3.794 4.418 1.00 64.24 H new ATOM 0 HA GLU A 90 11.687 2.498 6.945 1.00 72.11 H new ATOM 0 HB2 GLU A 90 9.744 4.435 5.623 1.00 51.15 H new ATOM 0 HB3 GLU A 90 9.545 3.890 7.276 1.00 51.15 H new ATOM 0 HG2 GLU A 90 12.037 5.301 6.262 1.00 34.04 H new ATOM 0 HG3 GLU A 90 10.682 6.132 6.999 1.00 34.04 H new ATOM 1515 N ILE A 91 9.321 1.575 4.841 1.00 20.04 N ATOM 1516 CA ILE A 91 8.299 0.565 4.569 1.00 1.44 C ATOM 1517 C ILE A 91 8.917 -0.842 4.558 1.00 53.40 C ATOM 1518 O ILE A 91 8.451 -1.739 5.261 1.00 73.10 O ATOM 1519 CB ILE A 91 7.595 0.831 3.213 1.00 2.12 C ATOM 1520 CG1 ILE A 91 7.131 2.297 3.119 1.00 33.11 C ATOM 1521 CG2 ILE A 91 6.415 -0.121 3.023 1.00 22.44 C ATOM 1522 CD1 ILE A 91 6.161 2.718 4.203 1.00 74.33 C ATOM 0 H ILE A 91 9.506 2.205 4.060 1.00 20.04 H new ATOM 0 HA ILE A 91 7.558 0.626 5.366 1.00 1.44 H new ATOM 0 HB ILE A 91 8.314 0.649 2.414 1.00 2.12 H new ATOM 0 HG12 ILE A 91 8.006 2.945 3.160 1.00 33.11 H new ATOM 0 HG13 ILE A 91 6.662 2.455 2.148 1.00 33.11 H new ATOM 0 HG21 ILE A 91 5.934 0.082 2.066 1.00 22.44 H new ATOM 0 HG22 ILE A 91 6.772 -1.151 3.039 1.00 22.44 H new ATOM 0 HG23 ILE A 91 5.696 0.026 3.829 1.00 22.44 H new ATOM 0 HD11 ILE A 91 5.887 3.763 4.060 1.00 74.33 H new ATOM 0 HD12 ILE A 91 5.266 2.098 4.151 1.00 74.33 H new ATOM 0 HD13 ILE A 91 6.631 2.596 5.179 1.00 74.33 H new ATOM 1534 N THR A 92 9.983 -1.021 3.771 1.00 61.45 N ATOM 1535 CA THR A 92 10.706 -2.302 3.725 1.00 21.31 C ATOM 1536 C THR A 92 11.167 -2.725 5.123 1.00 15.33 C ATOM 1537 O THR A 92 10.921 -3.850 5.561 1.00 73.25 O ATOM 1538 CB THR A 92 11.955 -2.238 2.806 1.00 43.32 C ATOM 1539 OG1 THR A 92 12.848 -1.209 3.260 1.00 74.42 O ATOM 1540 CG2 THR A 92 11.571 -1.971 1.355 1.00 30.33 C ATOM 0 H THR A 92 10.365 -0.300 3.159 1.00 61.45 H new ATOM 0 HA THR A 92 10.002 -3.030 3.322 1.00 21.31 H new ATOM 0 HB THR A 92 12.451 -3.207 2.856 1.00 43.32 H new ATOM 0 HG1 THR A 92 13.634 -1.177 2.675 1.00 74.42 H new ATOM 0 HG21 THR A 92 12.471 -1.933 0.742 1.00 30.33 H new ATOM 0 HG22 THR A 92 10.922 -2.770 0.997 1.00 30.33 H new ATOM 0 HG23 THR A 92 11.045 -1.019 1.287 1.00 30.33 H new ATOM 1548 N LYS A 93 11.827 -1.806 5.823 1.00 24.45 N ATOM 1549 CA LYS A 93 12.343 -2.068 7.171 1.00 33.03 C ATOM 1550 C LYS A 93 11.208 -2.469 8.131 1.00 14.43 C ATOM 1551 O LYS A 93 11.374 -3.351 8.978 1.00 73.25 O ATOM 1552 CB LYS A 93 13.077 -0.825 7.701 1.00 65.31 C ATOM 1553 CG LYS A 93 14.153 -1.129 8.739 1.00 41.42 C ATOM 1554 CD LYS A 93 15.281 -1.969 8.142 1.00 42.21 C ATOM 1555 CE LYS A 93 16.421 -2.184 9.130 1.00 13.44 C ATOM 1556 NZ LYS A 93 15.974 -2.899 10.359 1.00 61.12 N ATOM 0 H LYS A 93 12.020 -0.865 5.479 1.00 24.45 H new ATOM 0 HA LYS A 93 13.044 -2.901 7.115 1.00 33.03 H new ATOM 0 HB2 LYS A 93 13.535 -0.302 6.862 1.00 65.31 H new ATOM 0 HB3 LYS A 93 12.347 -0.145 8.140 1.00 65.31 H new ATOM 0 HG2 LYS A 93 14.559 -0.196 9.128 1.00 41.42 H new ATOM 0 HG3 LYS A 93 13.709 -1.659 9.581 1.00 41.42 H new ATOM 0 HD2 LYS A 93 14.886 -2.936 7.829 1.00 42.21 H new ATOM 0 HD3 LYS A 93 15.665 -1.477 7.248 1.00 42.21 H new ATOM 0 HE2 LYS A 93 17.214 -2.755 8.648 1.00 13.44 H new ATOM 0 HE3 LYS A 93 16.846 -1.219 9.407 1.00 13.44 H new ATOM 0 HZ1 LYS A 93 16.797 -3.098 10.963 1.00 61.12 H new ATOM 0 HZ2 LYS A 93 15.297 -2.305 10.880 1.00 61.12 H new ATOM 0 HZ3 LYS A 93 15.516 -3.794 10.093 1.00 61.12 H new ATOM 1570 N GLY A 94 10.052 -1.822 7.979 1.00 24.13 N ATOM 1571 CA GLY A 94 8.890 -2.149 8.797 1.00 30.53 C ATOM 1572 C GLY A 94 8.301 -3.521 8.476 1.00 73.43 C ATOM 1573 O GLY A 94 7.658 -4.145 9.322 1.00 60.52 O ATOM 0 H GLY A 94 9.898 -1.075 7.302 1.00 24.13 H new ATOM 0 HA2 GLY A 94 9.173 -2.118 9.849 1.00 30.53 H new ATOM 0 HA3 GLY A 94 8.124 -1.388 8.651 1.00 30.53 H new ATOM 1577 N LEU A 95 8.518 -3.997 7.247 1.00 61.51 N ATOM 1578 CA LEU A 95 8.030 -5.318 6.827 1.00 64.11 C ATOM 1579 C LEU A 95 9.149 -6.375 6.895 1.00 22.14 C ATOM 1580 O LEU A 95 8.978 -7.498 6.418 1.00 21.23 O ATOM 1581 CB LEU A 95 7.465 -5.240 5.399 1.00 34.13 C ATOM 1582 CG LEU A 95 6.408 -4.147 5.159 1.00 15.43 C ATOM 1583 CD1 LEU A 95 5.930 -4.169 3.710 1.00 4.42 C ATOM 1584 CD2 LEU A 95 5.232 -4.298 6.120 1.00 0.24 C ATOM 0 H LEU A 95 9.028 -3.489 6.524 1.00 61.51 H new ATOM 0 HA LEU A 95 7.239 -5.620 7.513 1.00 64.11 H new ATOM 0 HB2 LEU A 95 8.293 -5.077 4.709 1.00 34.13 H new ATOM 0 HB3 LEU A 95 7.026 -6.206 5.148 1.00 34.13 H new ATOM 0 HG LEU A 95 6.874 -3.181 5.351 1.00 15.43 H new ATOM 0 HD11 LEU A 95 5.183 -3.389 3.561 1.00 4.42 H new ATOM 0 HD12 LEU A 95 6.776 -3.993 3.045 1.00 4.42 H new ATOM 0 HD13 LEU A 95 5.489 -5.141 3.487 1.00 4.42 H new ATOM 0 HD21 LEU A 95 4.501 -3.512 5.927 1.00 0.24 H new ATOM 0 HD22 LEU A 95 4.765 -5.272 5.973 1.00 0.24 H new ATOM 0 HD23 LEU A 95 5.589 -4.218 7.147 1.00 0.24 H new ATOM 1596 N ASN A 96 10.290 -6.000 7.488 1.00 40.14 N ATOM 1597 CA ASN A 96 11.451 -6.901 7.645 1.00 3.31 C ATOM 1598 C ASN A 96 12.137 -7.197 6.289 1.00 22.51 C ATOM 1599 O ASN A 96 13.027 -8.044 6.192 1.00 1.30 O ATOM 1600 CB ASN A 96 11.018 -8.204 8.348 1.00 25.41 C ATOM 1601 CG ASN A 96 12.187 -9.011 8.887 1.00 42.25 C ATOM 1602 OD1 ASN A 96 12.718 -9.893 8.220 1.00 43.34 O ATOM 1603 ND2 ASN A 96 12.598 -8.714 10.104 1.00 20.54 N ATOM 0 H ASN A 96 10.439 -5.067 7.873 1.00 40.14 H new ATOM 0 HA ASN A 96 12.189 -6.396 8.268 1.00 3.31 H new ATOM 0 HB2 ASN A 96 10.344 -7.959 9.169 1.00 25.41 H new ATOM 0 HB3 ASN A 96 10.454 -8.818 7.646 1.00 25.41 H new ATOM 0 HD21 ASN A 96 13.379 -9.223 10.517 1.00 20.54 H new ATOM 0 HD22 ASN A 96 12.135 -7.975 10.633 1.00 20.54 H new ATOM 1610 N LEU A 97 11.747 -6.457 5.254 1.00 5.12 N ATOM 1611 CA LEU A 97 12.283 -6.656 3.902 1.00 4.43 C ATOM 1612 C LEU A 97 13.672 -6.005 3.742 1.00 63.45 C ATOM 1613 O LEU A 97 13.928 -4.921 4.275 1.00 42.12 O ATOM 1614 CB LEU A 97 11.310 -6.073 2.862 1.00 33.14 C ATOM 1615 CG LEU A 97 9.852 -6.538 2.993 1.00 13.04 C ATOM 1616 CD1 LEU A 97 8.982 -5.900 1.914 1.00 3.32 C ATOM 1617 CD2 LEU A 97 9.755 -8.063 2.943 1.00 64.44 C ATOM 0 H LEU A 97 11.057 -5.709 5.323 1.00 5.12 H new ATOM 0 HA LEU A 97 12.394 -7.728 3.740 1.00 4.43 H new ATOM 0 HB2 LEU A 97 11.335 -4.986 2.935 1.00 33.14 H new ATOM 0 HB3 LEU A 97 11.669 -6.334 1.867 1.00 33.14 H new ATOM 0 HG LEU A 97 9.480 -6.212 3.965 1.00 13.04 H new ATOM 0 HD11 LEU A 97 7.954 -6.243 2.026 1.00 3.32 H new ATOM 0 HD12 LEU A 97 9.015 -4.815 2.014 1.00 3.32 H new ATOM 0 HD13 LEU A 97 9.355 -6.185 0.930 1.00 3.32 H new ATOM 0 HD21 LEU A 97 8.712 -8.365 3.038 1.00 64.44 H new ATOM 0 HD22 LEU A 97 10.151 -8.422 1.993 1.00 64.44 H new ATOM 0 HD23 LEU A 97 10.333 -8.491 3.762 1.00 64.44 H new ATOM 1629 N PRO A 98 14.588 -6.658 2.998 1.00 10.33 N ATOM 1630 CA PRO A 98 15.941 -6.131 2.760 1.00 53.10 C ATOM 1631 C PRO A 98 15.983 -5.044 1.668 1.00 43.13 C ATOM 1632 O PRO A 98 15.506 -5.247 0.550 1.00 24.41 O ATOM 1633 CB PRO A 98 16.713 -7.376 2.312 1.00 62.15 C ATOM 1634 CG PRO A 98 15.692 -8.227 1.633 1.00 61.22 C ATOM 1635 CD PRO A 98 14.379 -7.960 2.336 1.00 12.02 C ATOM 0 HA PRO A 98 16.350 -5.641 3.643 1.00 53.10 H new ATOM 0 HB2 PRO A 98 17.526 -7.116 1.635 1.00 62.15 H new ATOM 0 HB3 PRO A 98 17.159 -7.893 3.162 1.00 62.15 H new ATOM 0 HG2 PRO A 98 15.623 -7.980 0.574 1.00 61.22 H new ATOM 0 HG3 PRO A 98 15.960 -9.282 1.698 1.00 61.22 H new ATOM 0 HD2 PRO A 98 13.549 -7.921 1.630 1.00 12.02 H new ATOM 0 HD3 PRO A 98 14.146 -8.742 3.058 1.00 12.02 H new ATOM 1643 N THR A 99 16.578 -3.895 1.995 1.00 33.25 N ATOM 1644 CA THR A 99 16.691 -2.770 1.047 1.00 15.30 C ATOM 1645 C THR A 99 17.628 -3.093 -0.133 1.00 31.34 C ATOM 1646 O THR A 99 17.731 -2.319 -1.086 1.00 44.20 O ATOM 1647 CB THR A 99 17.190 -1.479 1.752 1.00 42.13 C ATOM 1648 OG1 THR A 99 17.388 -0.420 0.797 1.00 42.13 O ATOM 1649 CG2 THR A 99 18.491 -1.730 2.512 1.00 12.25 C ATOM 0 H THR A 99 16.992 -3.713 2.909 1.00 33.25 H new ATOM 0 HA THR A 99 15.687 -2.604 0.658 1.00 15.30 H new ATOM 0 HB THR A 99 16.422 -1.180 2.465 1.00 42.13 H new ATOM 0 HG1 THR A 99 17.286 -0.775 -0.111 1.00 42.13 H new ATOM 0 HG21 THR A 99 18.814 -0.808 2.994 1.00 12.25 H new ATOM 0 HG22 THR A 99 18.328 -2.497 3.269 1.00 12.25 H new ATOM 0 HG23 THR A 99 19.260 -2.064 1.816 1.00 12.25 H new ATOM 1657 N SER A 100 18.306 -4.238 -0.053 1.00 5.43 N ATOM 1658 CA SER A 100 19.219 -4.707 -1.114 1.00 35.53 C ATOM 1659 C SER A 100 18.496 -4.963 -2.451 1.00 15.32 C ATOM 1660 O SER A 100 19.124 -4.963 -3.512 1.00 22.41 O ATOM 1661 CB SER A 100 19.927 -5.996 -0.663 1.00 4.22 C ATOM 1662 OG SER A 100 20.770 -6.519 -1.680 1.00 0.31 O ATOM 0 H SER A 100 18.243 -4.871 0.745 1.00 5.43 H new ATOM 0 HA SER A 100 19.946 -3.912 -1.281 1.00 35.53 H new ATOM 0 HB2 SER A 100 20.518 -5.793 0.230 1.00 4.22 H new ATOM 0 HB3 SER A 100 19.182 -6.743 -0.389 1.00 4.22 H new ATOM 0 HG SER A 100 21.204 -7.336 -1.357 1.00 0.31 H new ATOM 1668 N ILE A 101 17.181 -5.173 -2.398 1.00 30.24 N ATOM 1669 CA ILE A 101 16.399 -5.509 -3.596 1.00 52.24 C ATOM 1670 C ILE A 101 16.428 -4.381 -4.647 1.00 64.12 C ATOM 1671 O ILE A 101 16.033 -3.244 -4.375 1.00 24.30 O ATOM 1672 CB ILE A 101 14.932 -5.835 -3.229 1.00 10.02 C ATOM 1673 CG1 ILE A 101 14.889 -6.983 -2.211 1.00 32.14 C ATOM 1674 CG2 ILE A 101 14.124 -6.186 -4.481 1.00 44.42 C ATOM 1675 CD1 ILE A 101 13.500 -7.297 -1.705 1.00 12.25 C ATOM 0 H ILE A 101 16.632 -5.117 -1.540 1.00 30.24 H new ATOM 0 HA ILE A 101 16.867 -6.391 -4.033 1.00 52.24 H new ATOM 0 HB ILE A 101 14.480 -4.952 -2.778 1.00 10.02 H new ATOM 0 HG12 ILE A 101 15.310 -7.878 -2.669 1.00 32.14 H new ATOM 0 HG13 ILE A 101 15.526 -6.729 -1.364 1.00 32.14 H new ATOM 0 HG21 ILE A 101 13.096 -6.412 -4.199 1.00 44.42 H new ATOM 0 HG22 ILE A 101 14.134 -5.341 -5.169 1.00 44.42 H new ATOM 0 HG23 ILE A 101 14.566 -7.056 -4.967 1.00 44.42 H new ATOM 0 HD11 ILE A 101 13.550 -8.118 -0.990 1.00 12.25 H new ATOM 0 HD12 ILE A 101 13.083 -6.416 -1.217 1.00 12.25 H new ATOM 0 HD13 ILE A 101 12.864 -7.583 -2.542 1.00 12.25 H new ATOM 1687 N THR A 102 16.884 -4.724 -5.855 1.00 1.41 N ATOM 1688 CA THR A 102 17.047 -3.764 -6.964 1.00 22.44 C ATOM 1689 C THR A 102 15.775 -2.938 -7.244 1.00 32.32 C ATOM 1690 O THR A 102 15.859 -1.778 -7.662 1.00 31.43 O ATOM 1691 CB THR A 102 17.448 -4.502 -8.269 1.00 22.01 C ATOM 1692 OG1 THR A 102 18.543 -5.395 -8.017 1.00 45.32 O ATOM 1693 CG2 THR A 102 17.845 -3.522 -9.368 1.00 11.43 C ATOM 0 H THR A 102 17.153 -5.677 -6.098 1.00 1.41 H new ATOM 0 HA THR A 102 17.833 -3.078 -6.649 1.00 22.44 H new ATOM 0 HB THR A 102 16.578 -5.066 -8.605 1.00 22.01 H new ATOM 0 HG1 THR A 102 18.786 -5.856 -8.847 1.00 45.32 H new ATOM 0 HG21 THR A 102 18.119 -4.075 -10.267 1.00 11.43 H new ATOM 0 HG22 THR A 102 17.005 -2.864 -9.589 1.00 11.43 H new ATOM 0 HG23 THR A 102 18.695 -2.926 -9.035 1.00 11.43 H new ATOM 1701 N SER A 103 14.602 -3.534 -7.022 1.00 35.13 N ATOM 1702 CA SER A 103 13.317 -2.869 -7.315 1.00 51.15 C ATOM 1703 C SER A 103 12.393 -2.818 -6.089 1.00 12.25 C ATOM 1704 O SER A 103 11.171 -2.796 -6.233 1.00 64.12 O ATOM 1705 CB SER A 103 12.593 -3.599 -8.458 1.00 54.34 C ATOM 1706 OG SER A 103 12.264 -4.933 -8.093 1.00 32.12 O ATOM 0 H SER A 103 14.508 -4.475 -6.641 1.00 35.13 H new ATOM 0 HA SER A 103 13.549 -1.844 -7.606 1.00 51.15 H new ATOM 0 HB2 SER A 103 11.684 -3.057 -8.720 1.00 54.34 H new ATOM 0 HB3 SER A 103 13.226 -3.608 -9.345 1.00 54.34 H new ATOM 0 HG SER A 103 11.803 -5.372 -8.838 1.00 32.12 H new ATOM 1712 N ALA A 104 12.971 -2.764 -4.890 1.00 54.11 N ATOM 1713 CA ALA A 104 12.180 -2.749 -3.646 1.00 1.33 C ATOM 1714 C ALA A 104 11.114 -1.637 -3.642 1.00 23.12 C ATOM 1715 O ALA A 104 9.913 -1.913 -3.597 1.00 64.45 O ATOM 1716 CB ALA A 104 13.095 -2.595 -2.436 1.00 23.42 C ATOM 0 H ALA A 104 13.980 -2.730 -4.747 1.00 54.11 H new ATOM 0 HA ALA A 104 11.658 -3.704 -3.590 1.00 1.33 H new ATOM 0 HB1 ALA A 104 12.496 -2.586 -1.526 1.00 23.42 H new ATOM 0 HB2 ALA A 104 13.795 -3.429 -2.401 1.00 23.42 H new ATOM 0 HB3 ALA A 104 13.649 -1.660 -2.515 1.00 23.42 H new ATOM 1722 N ALA A 105 11.568 -0.387 -3.707 1.00 50.44 N ATOM 1723 CA ALA A 105 10.674 0.775 -3.649 1.00 65.33 C ATOM 1724 C ALA A 105 9.631 0.760 -4.777 1.00 50.20 C ATOM 1725 O ALA A 105 8.438 0.980 -4.542 1.00 70.02 O ATOM 1726 CB ALA A 105 11.492 2.062 -3.701 1.00 13.10 C ATOM 0 H ALA A 105 12.555 -0.149 -3.800 1.00 50.44 H new ATOM 0 HA ALA A 105 10.129 0.726 -2.706 1.00 65.33 H new ATOM 0 HB1 ALA A 105 10.822 2.921 -3.658 1.00 13.10 H new ATOM 0 HB2 ALA A 105 12.177 2.092 -2.853 1.00 13.10 H new ATOM 0 HB3 ALA A 105 12.062 2.093 -4.629 1.00 13.10 H new ATOM 1732 N PHE A 106 10.085 0.495 -6.000 1.00 40.30 N ATOM 1733 CA PHE A 106 9.197 0.477 -7.167 1.00 42.23 C ATOM 1734 C PHE A 106 8.136 -0.633 -7.058 1.00 22.44 C ATOM 1735 O PHE A 106 6.956 -0.409 -7.349 1.00 13.30 O ATOM 1736 CB PHE A 106 10.011 0.306 -8.458 1.00 45.34 C ATOM 1737 CG PHE A 106 9.177 0.415 -9.711 1.00 70.24 C ATOM 1738 CD1 PHE A 106 8.773 1.656 -10.184 1.00 63.32 C ATOM 1739 CD2 PHE A 106 8.789 -0.722 -10.412 1.00 13.42 C ATOM 1740 CE1 PHE A 106 8.002 1.762 -11.325 1.00 14.55 C ATOM 1741 CE2 PHE A 106 8.017 -0.619 -11.554 1.00 22.02 C ATOM 1742 CZ PHE A 106 7.623 0.624 -12.012 1.00 54.31 C ATOM 0 H PHE A 106 11.061 0.290 -6.212 1.00 40.30 H new ATOM 0 HA PHE A 106 8.676 1.434 -7.197 1.00 42.23 H new ATOM 0 HB2 PHE A 106 10.796 1.061 -8.486 1.00 45.34 H new ATOM 0 HB3 PHE A 106 10.504 -0.666 -8.442 1.00 45.34 H new ATOM 0 HD1 PHE A 106 9.065 2.550 -9.653 1.00 63.32 H new ATOM 0 HD2 PHE A 106 9.094 -1.696 -10.060 1.00 13.42 H new ATOM 0 HE1 PHE A 106 7.695 2.734 -11.681 1.00 14.55 H new ATOM 0 HE2 PHE A 106 7.722 -1.510 -12.088 1.00 22.02 H new ATOM 0 HZ PHE A 106 7.020 0.706 -12.905 1.00 54.31 H new ATOM 1752 N THR A 107 8.554 -1.824 -6.631 1.00 73.34 N ATOM 1753 CA THR A 107 7.637 -2.965 -6.489 1.00 42.52 C ATOM 1754 C THR A 107 6.587 -2.710 -5.398 1.00 51.52 C ATOM 1755 O THR A 107 5.403 -2.977 -5.601 1.00 72.02 O ATOM 1756 CB THR A 107 8.387 -4.287 -6.179 1.00 12.14 C ATOM 1757 OG1 THR A 107 9.346 -4.567 -7.210 1.00 3.24 O ATOM 1758 CG2 THR A 107 7.416 -5.460 -6.067 1.00 21.50 C ATOM 0 H THR A 107 9.520 -2.028 -6.376 1.00 73.34 H new ATOM 0 HA THR A 107 7.136 -3.071 -7.451 1.00 42.52 H new ATOM 0 HB THR A 107 8.897 -4.161 -5.224 1.00 12.14 H new ATOM 0 HG1 THR A 107 10.145 -4.016 -7.072 1.00 3.24 H new ATOM 0 HG21 THR A 107 7.971 -6.372 -5.849 1.00 21.50 H new ATOM 0 HG22 THR A 107 6.704 -5.268 -5.264 1.00 21.50 H new ATOM 0 HG23 THR A 107 6.878 -5.578 -7.008 1.00 21.50 H new ATOM 1766 N LEU A 108 7.019 -2.185 -4.246 1.00 21.22 N ATOM 1767 CA LEU A 108 6.084 -1.807 -3.172 1.00 50.31 C ATOM 1768 C LEU A 108 5.036 -0.812 -3.689 1.00 2.30 C ATOM 1769 O LEU A 108 3.834 -1.005 -3.498 1.00 53.11 O ATOM 1770 CB LEU A 108 6.837 -1.198 -1.980 1.00 63.32 C ATOM 1771 CG LEU A 108 7.721 -2.169 -1.183 1.00 22.00 C ATOM 1772 CD1 LEU A 108 8.428 -1.438 -0.045 1.00 73.45 C ATOM 1773 CD2 LEU A 108 6.894 -3.335 -0.642 1.00 34.20 C ATOM 0 H LEU A 108 8.001 -2.012 -4.031 1.00 21.22 H new ATOM 0 HA LEU A 108 5.576 -2.712 -2.839 1.00 50.31 H new ATOM 0 HB2 LEU A 108 7.462 -0.384 -2.347 1.00 63.32 H new ATOM 0 HB3 LEU A 108 6.108 -0.758 -1.300 1.00 63.32 H new ATOM 0 HG LEU A 108 8.478 -2.572 -1.856 1.00 22.00 H new ATOM 0 HD11 LEU A 108 9.050 -2.142 0.509 1.00 73.45 H new ATOM 0 HD12 LEU A 108 9.054 -0.645 -0.455 1.00 73.45 H new ATOM 0 HD13 LEU A 108 7.686 -1.004 0.625 1.00 73.45 H new ATOM 0 HD21 LEU A 108 7.540 -4.010 -0.081 1.00 34.20 H new ATOM 0 HD22 LEU A 108 6.112 -2.953 0.014 1.00 34.20 H new ATOM 0 HD23 LEU A 108 6.439 -3.875 -1.473 1.00 34.20 H new ATOM 1785 N ARG A 109 5.510 0.247 -4.348 1.00 23.04 N ATOM 1786 CA ARG A 109 4.626 1.228 -4.992 1.00 25.31 C ATOM 1787 C ARG A 109 3.626 0.540 -5.938 1.00 65.21 C ATOM 1788 O ARG A 109 2.437 0.865 -5.949 1.00 11.22 O ATOM 1789 CB ARG A 109 5.464 2.248 -5.780 1.00 51.53 C ATOM 1790 CG ARG A 109 4.634 3.255 -6.584 1.00 71.21 C ATOM 1791 CD ARG A 109 5.173 3.440 -8.001 1.00 3.44 C ATOM 1792 NE ARG A 109 5.118 2.195 -8.774 1.00 33.04 N ATOM 1793 CZ ARG A 109 4.365 2.012 -9.830 1.00 53.30 C ATOM 1794 NH1 ARG A 109 3.600 2.962 -10.271 1.00 74.23 N ATOM 1795 NH2 ARG A 109 4.372 0.873 -10.439 1.00 55.15 N ATOM 0 H ARG A 109 6.504 0.450 -4.451 1.00 23.04 H new ATOM 0 HA ARG A 109 4.063 1.739 -4.211 1.00 25.31 H new ATOM 0 HB2 ARG A 109 6.101 2.793 -5.084 1.00 51.53 H new ATOM 0 HB3 ARG A 109 6.123 1.711 -6.462 1.00 51.53 H new ATOM 0 HG2 ARG A 109 3.599 2.916 -6.631 1.00 71.21 H new ATOM 0 HG3 ARG A 109 4.631 4.216 -6.069 1.00 71.21 H new ATOM 0 HD2 ARG A 109 4.595 4.210 -8.512 1.00 3.44 H new ATOM 0 HD3 ARG A 109 6.203 3.793 -7.954 1.00 3.44 H new ATOM 0 HE ARG A 109 5.706 1.419 -8.469 1.00 33.04 H new ATOM 0 HH11 ARG A 109 3.580 3.864 -9.794 1.00 74.23 H new ATOM 0 HH12 ARG A 109 3.018 2.807 -11.094 1.00 74.23 H new ATOM 0 HH21 ARG A 109 4.964 0.116 -10.098 1.00 55.15 H new ATOM 0 HH22 ARG A 109 3.786 0.731 -11.261 1.00 55.15 H new ATOM 1809 N THR A 110 4.125 -0.411 -6.724 1.00 63.53 N ATOM 1810 CA THR A 110 3.302 -1.131 -7.706 1.00 43.43 C ATOM 1811 C THR A 110 2.207 -1.970 -7.030 1.00 41.12 C ATOM 1812 O THR A 110 1.019 -1.775 -7.286 1.00 53.45 O ATOM 1813 CB THR A 110 4.173 -2.054 -8.596 1.00 4.33 C ATOM 1814 OG1 THR A 110 5.230 -1.292 -9.204 1.00 22.24 O ATOM 1815 CG2 THR A 110 3.339 -2.717 -9.687 1.00 71.12 C ATOM 0 H THR A 110 5.101 -0.706 -6.703 1.00 63.53 H new ATOM 0 HA THR A 110 2.826 -0.373 -8.327 1.00 43.43 H new ATOM 0 HB THR A 110 4.594 -2.833 -7.960 1.00 4.33 H new ATOM 0 HG1 THR A 110 5.964 -1.182 -8.564 1.00 22.24 H new ATOM 0 HG21 THR A 110 3.978 -3.358 -10.294 1.00 71.12 H new ATOM 0 HG22 THR A 110 2.553 -3.317 -9.230 1.00 71.12 H new ATOM 0 HG23 THR A 110 2.889 -1.950 -10.318 1.00 71.12 H new ATOM 1823 N GLN A 111 2.610 -2.893 -6.152 1.00 15.04 N ATOM 1824 CA GLN A 111 1.655 -3.777 -5.467 1.00 73.15 C ATOM 1825 C GLN A 111 0.621 -2.973 -4.661 1.00 4.14 C ATOM 1826 O GLN A 111 -0.577 -3.267 -4.700 1.00 32.13 O ATOM 1827 CB GLN A 111 2.383 -4.766 -4.540 1.00 0.04 C ATOM 1828 CG GLN A 111 3.411 -5.660 -5.236 1.00 33.51 C ATOM 1829 CD GLN A 111 2.857 -6.407 -6.442 1.00 15.32 C ATOM 1830 OE1 GLN A 111 1.665 -6.678 -6.539 1.00 34.40 O ATOM 1831 NE2 GLN A 111 3.727 -6.780 -7.357 1.00 61.12 N ATOM 0 H GLN A 111 3.585 -3.049 -5.898 1.00 15.04 H new ATOM 0 HA GLN A 111 1.129 -4.339 -6.239 1.00 73.15 H new ATOM 0 HB2 GLN A 111 2.885 -4.203 -3.754 1.00 0.04 H new ATOM 0 HB3 GLN A 111 1.641 -5.400 -4.054 1.00 0.04 H new ATOM 0 HG2 GLN A 111 4.255 -5.048 -5.555 1.00 33.51 H new ATOM 0 HG3 GLN A 111 3.796 -6.383 -4.517 1.00 33.51 H new ATOM 0 HE21 GLN A 111 4.713 -6.541 -7.251 1.00 61.12 H new ATOM 0 HE22 GLN A 111 3.415 -7.308 -8.172 1.00 61.12 H new ATOM 1840 N TYR A 112 1.087 -1.956 -3.939 1.00 5.12 N ATOM 1841 CA TYR A 112 0.195 -1.086 -3.165 1.00 25.12 C ATOM 1842 C TYR A 112 -0.845 -0.427 -4.084 1.00 52.42 C ATOM 1843 O TYR A 112 -2.038 -0.382 -3.766 1.00 14.25 O ATOM 1844 CB TYR A 112 1.009 -0.007 -2.435 1.00 52.14 C ATOM 1845 CG TYR A 112 0.208 0.791 -1.414 1.00 63.25 C ATOM 1846 CD1 TYR A 112 -0.559 1.890 -1.792 1.00 13.42 C ATOM 1847 CD2 TYR A 112 0.224 0.439 -0.071 1.00 31.33 C ATOM 1848 CE1 TYR A 112 -1.284 2.610 -0.860 1.00 11.12 C ATOM 1849 CE2 TYR A 112 -0.499 1.154 0.865 1.00 4.42 C ATOM 1850 CZ TYR A 112 -1.250 2.237 0.467 1.00 42.21 C ATOM 1851 OH TYR A 112 -1.966 2.950 1.403 1.00 70.25 O ATOM 0 H TYR A 112 2.075 -1.712 -3.872 1.00 5.12 H new ATOM 0 HA TYR A 112 -0.327 -1.696 -2.428 1.00 25.12 H new ATOM 0 HB2 TYR A 112 1.851 -0.481 -1.930 1.00 52.14 H new ATOM 0 HB3 TYR A 112 1.425 0.680 -3.172 1.00 52.14 H new ATOM 0 HD1 TYR A 112 -0.588 2.185 -2.830 1.00 13.42 H new ATOM 0 HD2 TYR A 112 0.812 -0.409 0.248 1.00 31.33 H new ATOM 0 HE1 TYR A 112 -1.874 3.460 -1.170 1.00 11.12 H new ATOM 0 HE2 TYR A 112 -0.475 0.864 1.905 1.00 4.42 H new ATOM 0 HH TYR A 112 -1.832 2.553 2.289 1.00 70.25 H new ATOM 1861 N MET A 113 -0.380 0.061 -5.236 1.00 75.20 N ATOM 1862 CA MET A 113 -1.250 0.724 -6.210 1.00 11.24 C ATOM 1863 C MET A 113 -2.220 -0.274 -6.870 1.00 12.22 C ATOM 1864 O MET A 113 -3.275 0.105 -7.372 1.00 73.41 O ATOM 1865 CB MET A 113 -0.403 1.426 -7.282 1.00 35.42 C ATOM 1866 CG MET A 113 -1.193 2.378 -8.171 1.00 62.13 C ATOM 1867 SD MET A 113 -0.157 3.199 -9.399 1.00 70.23 S ATOM 1868 CE MET A 113 1.089 3.934 -8.342 1.00 31.22 C ATOM 0 H MET A 113 0.599 0.009 -5.518 1.00 75.20 H new ATOM 0 HA MET A 113 -1.845 1.466 -5.678 1.00 11.24 H new ATOM 0 HB2 MET A 113 0.396 1.982 -6.792 1.00 35.42 H new ATOM 0 HB3 MET A 113 0.071 0.670 -7.908 1.00 35.42 H new ATOM 0 HG2 MET A 113 -1.983 1.824 -8.679 1.00 62.13 H new ATOM 0 HG3 MET A 113 -1.680 3.130 -7.550 1.00 62.13 H new ATOM 0 HE1 MET A 113 1.656 4.674 -8.908 1.00 31.22 H new ATOM 0 HE2 MET A 113 0.606 4.418 -7.493 1.00 31.22 H new ATOM 0 HE3 MET A 113 1.764 3.158 -7.981 1.00 31.22 H new ATOM 1878 N LYS A 114 -1.852 -1.551 -6.868 1.00 11.13 N ATOM 1879 CA LYS A 114 -2.697 -2.601 -7.445 1.00 4.32 C ATOM 1880 C LYS A 114 -3.841 -3.007 -6.501 1.00 14.05 C ATOM 1881 O LYS A 114 -5.008 -3.037 -6.898 1.00 15.12 O ATOM 1882 CB LYS A 114 -1.845 -3.834 -7.777 1.00 12.11 C ATOM 1883 CG LYS A 114 -0.841 -3.611 -8.907 1.00 14.51 C ATOM 1884 CD LYS A 114 0.111 -4.797 -9.066 1.00 41.12 C ATOM 1885 CE LYS A 114 -0.639 -6.103 -9.296 1.00 54.13 C ATOM 1886 NZ LYS A 114 0.291 -7.245 -9.485 1.00 10.32 N ATOM 0 H LYS A 114 -0.974 -1.888 -6.474 1.00 11.13 H new ATOM 0 HA LYS A 114 -3.142 -2.197 -8.354 1.00 4.32 H new ATOM 0 HB2 LYS A 114 -1.306 -4.142 -6.881 1.00 12.11 H new ATOM 0 HB3 LYS A 114 -2.506 -4.657 -8.049 1.00 12.11 H new ATOM 0 HG2 LYS A 114 -1.377 -3.448 -9.842 1.00 14.51 H new ATOM 0 HG3 LYS A 114 -0.265 -2.707 -8.708 1.00 14.51 H new ATOM 0 HD2 LYS A 114 0.783 -4.613 -9.904 1.00 41.12 H new ATOM 0 HD3 LYS A 114 0.731 -4.887 -8.174 1.00 41.12 H new ATOM 0 HE2 LYS A 114 -1.292 -6.302 -8.446 1.00 54.13 H new ATOM 0 HE3 LYS A 114 -1.279 -6.006 -10.173 1.00 54.13 H new ATOM 0 HZ1 LYS A 114 -0.255 -8.124 -9.588 1.00 10.32 H new ATOM 0 HZ2 LYS A 114 0.862 -7.090 -10.340 1.00 10.32 H new ATOM 0 HZ3 LYS A 114 0.918 -7.322 -8.659 1.00 10.32 H new ATOM 1900 N TYR A 115 -3.502 -3.317 -5.251 1.00 41.01 N ATOM 1901 CA TYR A 115 -4.473 -3.890 -4.308 1.00 4.15 C ATOM 1902 C TYR A 115 -5.044 -2.847 -3.324 1.00 33.13 C ATOM 1903 O TYR A 115 -6.258 -2.732 -3.163 1.00 22.53 O ATOM 1904 CB TYR A 115 -3.817 -5.037 -3.523 1.00 31.42 C ATOM 1905 CG TYR A 115 -3.142 -6.082 -4.402 1.00 51.30 C ATOM 1906 CD1 TYR A 115 -3.884 -7.038 -5.089 1.00 15.50 C ATOM 1907 CD2 TYR A 115 -1.757 -6.105 -4.548 1.00 70.23 C ATOM 1908 CE1 TYR A 115 -3.266 -7.980 -5.895 1.00 63.22 C ATOM 1909 CE2 TYR A 115 -1.136 -7.045 -5.350 1.00 31.41 C ATOM 1910 CZ TYR A 115 -1.893 -7.980 -6.022 1.00 60.15 C ATOM 1911 OH TYR A 115 -1.277 -8.912 -6.829 1.00 70.41 O ATOM 0 H TYR A 115 -2.568 -3.183 -4.865 1.00 41.01 H new ATOM 0 HA TYR A 115 -5.310 -4.262 -4.899 1.00 4.15 H new ATOM 0 HB2 TYR A 115 -3.078 -4.620 -2.839 1.00 31.42 H new ATOM 0 HB3 TYR A 115 -4.576 -5.526 -2.912 1.00 31.42 H new ATOM 0 HD1 TYR A 115 -4.960 -7.046 -4.992 1.00 15.50 H new ATOM 0 HD2 TYR A 115 -1.157 -5.375 -4.025 1.00 70.23 H new ATOM 0 HE1 TYR A 115 -3.858 -8.713 -6.423 1.00 63.22 H new ATOM 0 HE2 TYR A 115 -0.061 -7.046 -5.449 1.00 31.41 H new ATOM 0 HH TYR A 115 -0.307 -8.773 -6.808 1.00 70.41 H new ATOM 1921 N LEU A 116 -4.167 -2.080 -2.678 1.00 61.23 N ATOM 1922 CA LEU A 116 -4.576 -1.188 -1.577 1.00 24.30 C ATOM 1923 C LEU A 116 -4.990 0.217 -2.058 1.00 25.15 C ATOM 1924 O LEU A 116 -5.563 0.994 -1.294 1.00 2.11 O ATOM 1925 CB LEU A 116 -3.431 -1.075 -0.560 1.00 45.51 C ATOM 1926 CG LEU A 116 -3.017 -2.400 0.108 1.00 70.24 C ATOM 1927 CD1 LEU A 116 -1.804 -2.202 1.015 1.00 34.42 C ATOM 1928 CD2 LEU A 116 -4.182 -2.994 0.894 1.00 51.30 C ATOM 0 H LEU A 116 -3.170 -2.053 -2.892 1.00 61.23 H new ATOM 0 HA LEU A 116 -5.457 -1.632 -1.114 1.00 24.30 H new ATOM 0 HB2 LEU A 116 -2.561 -0.652 -1.062 1.00 45.51 H new ATOM 0 HB3 LEU A 116 -3.725 -0.370 0.218 1.00 45.51 H new ATOM 0 HG LEU A 116 -2.739 -3.100 -0.680 1.00 70.24 H new ATOM 0 HD11 LEU A 116 -1.533 -3.153 1.474 1.00 34.42 H new ATOM 0 HD12 LEU A 116 -0.965 -1.832 0.425 1.00 34.42 H new ATOM 0 HD13 LEU A 116 -2.046 -1.480 1.794 1.00 34.42 H new ATOM 0 HD21 LEU A 116 -3.869 -3.929 1.358 1.00 51.30 H new ATOM 0 HD22 LEU A 116 -4.495 -2.292 1.667 1.00 51.30 H new ATOM 0 HD23 LEU A 116 -5.016 -3.185 0.219 1.00 51.30 H new ATOM 1940 N TYR A 117 -4.704 0.528 -3.320 1.00 50.43 N ATOM 1941 CA TYR A 117 -4.988 1.857 -3.895 1.00 75.31 C ATOM 1942 C TYR A 117 -6.455 2.310 -3.691 1.00 64.21 C ATOM 1943 O TYR A 117 -6.695 3.373 -3.110 1.00 2.25 O ATOM 1944 CB TYR A 117 -4.623 1.859 -5.385 1.00 12.02 C ATOM 1945 CG TYR A 117 -4.865 3.174 -6.102 1.00 1.12 C ATOM 1946 CD1 TYR A 117 -4.037 4.269 -5.884 1.00 25.20 C ATOM 1947 CD2 TYR A 117 -5.913 3.314 -7.008 1.00 63.43 C ATOM 1948 CE1 TYR A 117 -4.248 5.465 -6.543 1.00 74.44 C ATOM 1949 CE2 TYR A 117 -6.125 4.505 -7.672 1.00 11.03 C ATOM 1950 CZ TYR A 117 -5.292 5.576 -7.436 1.00 74.21 C ATOM 1951 OH TYR A 117 -5.501 6.760 -8.106 1.00 73.33 O ATOM 0 H TYR A 117 -4.272 -0.123 -3.976 1.00 50.43 H new ATOM 0 HA TYR A 117 -4.373 2.580 -3.359 1.00 75.31 H new ATOM 0 HB2 TYR A 117 -3.570 1.596 -5.486 1.00 12.02 H new ATOM 0 HB3 TYR A 117 -5.196 1.079 -5.885 1.00 12.02 H new ATOM 0 HD1 TYR A 117 -3.215 4.184 -5.188 1.00 25.20 H new ATOM 0 HD2 TYR A 117 -6.570 2.477 -7.194 1.00 63.43 H new ATOM 0 HE1 TYR A 117 -3.599 6.308 -6.359 1.00 74.44 H new ATOM 0 HE2 TYR A 117 -6.941 4.597 -8.374 1.00 11.03 H new ATOM 0 HH TYR A 117 -4.645 7.220 -8.231 1.00 73.33 H new ATOM 1961 N PRO A 118 -7.464 1.523 -4.147 1.00 14.01 N ATOM 1962 CA PRO A 118 -8.876 1.929 -4.019 1.00 12.42 C ATOM 1963 C PRO A 118 -9.324 2.008 -2.552 1.00 13.44 C ATOM 1964 O PRO A 118 -10.145 2.848 -2.181 1.00 1.25 O ATOM 1965 CB PRO A 118 -9.636 0.822 -4.768 1.00 4.24 C ATOM 1966 CG PRO A 118 -8.729 -0.362 -4.719 1.00 74.43 C ATOM 1967 CD PRO A 118 -7.332 0.193 -4.789 1.00 61.20 C ATOM 0 HA PRO A 118 -9.057 2.926 -4.422 1.00 12.42 H new ATOM 0 HB2 PRO A 118 -10.593 0.607 -4.292 1.00 4.24 H new ATOM 0 HB3 PRO A 118 -9.850 1.115 -5.796 1.00 4.24 H new ATOM 0 HG2 PRO A 118 -8.878 -0.932 -3.802 1.00 74.43 H new ATOM 0 HG3 PRO A 118 -8.924 -1.039 -5.551 1.00 74.43 H new ATOM 0 HD2 PRO A 118 -6.620 -0.441 -4.260 1.00 61.20 H new ATOM 0 HD3 PRO A 118 -6.982 0.275 -5.818 1.00 61.20 H new ATOM 1975 N TYR A 119 -8.760 1.136 -1.721 1.00 42.20 N ATOM 1976 CA TYR A 119 -9.106 1.078 -0.300 1.00 12.54 C ATOM 1977 C TYR A 119 -8.548 2.296 0.463 1.00 34.54 C ATOM 1978 O TYR A 119 -9.167 2.782 1.413 1.00 40.52 O ATOM 1979 CB TYR A 119 -8.584 -0.231 0.310 1.00 23.11 C ATOM 1980 CG TYR A 119 -9.110 -0.513 1.706 1.00 1.23 C ATOM 1981 CD1 TYR A 119 -10.328 -1.163 1.892 1.00 11.34 C ATOM 1982 CD2 TYR A 119 -8.399 -0.124 2.834 1.00 31.04 C ATOM 1983 CE1 TYR A 119 -10.816 -1.417 3.159 1.00 64.51 C ATOM 1984 CE2 TYR A 119 -8.882 -0.372 4.102 1.00 11.11 C ATOM 1985 CZ TYR A 119 -10.089 -1.019 4.261 1.00 40.13 C ATOM 1986 OH TYR A 119 -10.581 -1.255 5.525 1.00 63.35 O ATOM 0 H TYR A 119 -8.057 0.455 -2.008 1.00 42.20 H new ATOM 0 HA TYR A 119 -10.192 1.104 -0.209 1.00 12.54 H new ATOM 0 HB2 TYR A 119 -8.857 -1.059 -0.344 1.00 23.11 H new ATOM 0 HB3 TYR A 119 -7.495 -0.196 0.343 1.00 23.11 H new ATOM 0 HD1 TYR A 119 -10.901 -1.474 1.031 1.00 11.34 H new ATOM 0 HD2 TYR A 119 -7.452 0.381 2.716 1.00 31.04 H new ATOM 0 HE1 TYR A 119 -11.761 -1.924 3.286 1.00 64.51 H new ATOM 0 HE2 TYR A 119 -8.316 -0.060 4.968 1.00 11.11 H new ATOM 0 HH TYR A 119 -9.845 -1.509 6.120 1.00 63.35 H new ATOM 1996 N GLU A 120 -7.382 2.786 0.033 1.00 21.24 N ATOM 1997 CA GLU A 120 -6.757 3.970 0.642 1.00 63.24 C ATOM 1998 C GLU A 120 -7.648 5.204 0.436 1.00 42.32 C ATOM 1999 O GLU A 120 -8.098 5.824 1.398 1.00 64.15 O ATOM 2000 CB GLU A 120 -5.360 4.195 0.018 1.00 14.21 C ATOM 2001 CG GLU A 120 -4.424 5.121 0.808 1.00 22.52 C ATOM 2002 CD GLU A 120 -4.794 6.599 0.735 1.00 32.42 C ATOM 2003 OE1 GLU A 120 -4.358 7.290 -0.213 1.00 44.44 O ATOM 2004 OE2 GLU A 120 -5.505 7.080 1.636 1.00 31.04 O ATOM 0 H GLU A 120 -6.848 2.382 -0.736 1.00 21.24 H new ATOM 0 HA GLU A 120 -6.642 3.808 1.714 1.00 63.24 H new ATOM 0 HB2 GLU A 120 -4.873 3.227 -0.097 1.00 14.21 H new ATOM 0 HB3 GLU A 120 -5.490 4.607 -0.983 1.00 14.21 H new ATOM 0 HG2 GLU A 120 -4.422 4.810 1.853 1.00 22.52 H new ATOM 0 HG3 GLU A 120 -3.407 4.994 0.436 1.00 22.52 H new ATOM 2011 N CYS A 121 -7.936 5.523 -0.824 1.00 45.33 N ATOM 2012 CA CYS A 121 -8.763 6.689 -1.165 1.00 61.52 C ATOM 2013 C CYS A 121 -10.173 6.594 -0.552 1.00 53.01 C ATOM 2014 O CYS A 121 -10.802 7.610 -0.250 1.00 15.15 O ATOM 2015 CB CYS A 121 -8.861 6.837 -2.687 1.00 30.24 C ATOM 2016 SG CYS A 121 -9.708 8.338 -3.237 1.00 63.41 S ATOM 0 H CYS A 121 -7.610 4.991 -1.631 1.00 45.33 H new ATOM 0 HA CYS A 121 -8.279 7.570 -0.743 1.00 61.52 H new ATOM 0 HB2 CYS A 121 -7.855 6.827 -3.107 1.00 30.24 H new ATOM 0 HB3 CYS A 121 -9.384 5.970 -3.092 1.00 30.24 H new ATOM 0 HG CYS A 121 -10.513 8.749 -2.303 1.00 63.41 H new ATOM 2022 N GLU A 122 -10.660 5.365 -0.376 1.00 21.52 N ATOM 2023 CA GLU A 122 -11.975 5.117 0.234 1.00 44.53 C ATOM 2024 C GLU A 122 -11.965 5.349 1.761 1.00 72.45 C ATOM 2025 O GLU A 122 -12.645 6.241 2.276 1.00 24.25 O ATOM 2026 CB GLU A 122 -12.414 3.671 -0.070 1.00 64.20 C ATOM 2027 CG GLU A 122 -13.740 3.251 0.570 1.00 52.32 C ATOM 2028 CD GLU A 122 -14.940 3.994 0.003 1.00 21.11 C ATOM 2029 OE1 GLU A 122 -15.502 3.539 -1.016 1.00 62.45 O ATOM 2030 OE2 GLU A 122 -15.329 5.033 0.575 1.00 23.33 O ATOM 0 H GLU A 122 -10.162 4.517 -0.648 1.00 21.52 H new ATOM 0 HA GLU A 122 -12.681 5.827 -0.198 1.00 44.53 H new ATOM 0 HB2 GLU A 122 -12.495 3.551 -1.150 1.00 64.20 H new ATOM 0 HB3 GLU A 122 -11.632 2.991 0.269 1.00 64.20 H new ATOM 0 HG2 GLU A 122 -13.883 2.180 0.426 1.00 52.32 H new ATOM 0 HG3 GLU A 122 -13.688 3.424 1.645 1.00 52.32 H new ATOM 2037 N LYS A 123 -11.184 4.544 2.482 1.00 74.32 N ATOM 2038 CA LYS A 123 -11.213 4.538 3.955 1.00 61.32 C ATOM 2039 C LYS A 123 -10.345 5.645 4.583 1.00 24.12 C ATOM 2040 O LYS A 123 -10.660 6.151 5.663 1.00 63.31 O ATOM 2041 CB LYS A 123 -10.748 3.170 4.478 1.00 62.24 C ATOM 2042 CG LYS A 123 -11.629 1.992 4.053 1.00 21.20 C ATOM 2043 CD LYS A 123 -13.065 2.128 4.557 1.00 21.14 C ATOM 2044 CE LYS A 123 -13.902 0.883 4.259 1.00 13.33 C ATOM 2045 NZ LYS A 123 -13.472 -0.297 5.064 1.00 32.50 N ATOM 0 H LYS A 123 -10.521 3.885 2.074 1.00 74.32 H new ATOM 0 HA LYS A 123 -12.245 4.733 4.248 1.00 61.32 H new ATOM 0 HB2 LYS A 123 -9.731 2.990 4.131 1.00 62.24 H new ATOM 0 HB3 LYS A 123 -10.712 3.205 5.567 1.00 62.24 H new ATOM 0 HG2 LYS A 123 -11.634 1.919 2.965 1.00 21.20 H new ATOM 0 HG3 LYS A 123 -11.200 1.065 4.433 1.00 21.20 H new ATOM 0 HD2 LYS A 123 -13.055 2.309 5.632 1.00 21.14 H new ATOM 0 HD3 LYS A 123 -13.531 2.997 4.092 1.00 21.14 H new ATOM 0 HE2 LYS A 123 -14.951 1.096 4.464 1.00 13.33 H new ATOM 0 HE3 LYS A 123 -13.827 0.643 3.198 1.00 13.33 H new ATOM 0 HZ1 LYS A 123 -13.987 -1.142 4.744 1.00 32.50 H new ATOM 0 HZ2 LYS A 123 -12.450 -0.447 4.942 1.00 32.50 H new ATOM 0 HZ3 LYS A 123 -13.679 -0.126 6.069 1.00 32.50 H new ATOM 2059 N ARG A 124 -9.258 6.016 3.911 1.00 14.41 N ATOM 2060 CA ARG A 124 -8.286 6.968 4.471 1.00 44.54 C ATOM 2061 C ARG A 124 -8.307 8.312 3.711 1.00 13.24 C ATOM 2062 O ARG A 124 -8.714 9.336 4.259 1.00 71.53 O ATOM 2063 CB ARG A 124 -6.882 6.341 4.433 1.00 23.00 C ATOM 2064 CG ARG A 124 -5.840 7.061 5.284 1.00 42.13 C ATOM 2065 CD ARG A 124 -6.118 6.922 6.780 1.00 54.41 C ATOM 2066 NE ARG A 124 -6.204 5.519 7.198 1.00 1.40 N ATOM 2067 CZ ARG A 124 -5.643 5.028 8.273 1.00 23.14 C ATOM 2068 NH1 ARG A 124 -4.871 5.760 9.014 1.00 22.32 N ATOM 2069 NH2 ARG A 124 -5.846 3.791 8.596 1.00 4.24 N ATOM 0 H ARG A 124 -9.023 5.676 2.979 1.00 14.41 H new ATOM 0 HA ARG A 124 -8.561 7.180 5.504 1.00 44.54 H new ATOM 0 HB2 ARG A 124 -6.952 5.306 4.767 1.00 23.00 H new ATOM 0 HB3 ARG A 124 -6.536 6.320 3.400 1.00 23.00 H new ATOM 0 HG2 ARG A 124 -4.852 6.659 5.061 1.00 42.13 H new ATOM 0 HG3 ARG A 124 -5.822 8.117 5.016 1.00 42.13 H new ATOM 0 HD2 ARG A 124 -5.328 7.419 7.343 1.00 54.41 H new ATOM 0 HD3 ARG A 124 -7.051 7.430 7.023 1.00 54.41 H new ATOM 0 HE ARG A 124 -6.739 4.881 6.609 1.00 1.40 H new ATOM 0 HH11 ARG A 124 -4.694 6.732 8.762 1.00 22.32 H new ATOM 0 HH12 ARG A 124 -4.440 5.364 9.849 1.00 22.32 H new ATOM 0 HH21 ARG A 124 -6.442 3.203 8.013 1.00 4.24 H new ATOM 0 HH22 ARG A 124 -5.410 3.404 9.433 1.00 4.24 H new ATOM 2083 N GLY A 125 -7.854 8.305 2.456 1.00 64.51 N ATOM 2084 CA GLY A 125 -7.909 9.504 1.615 1.00 11.13 C ATOM 2085 C GLY A 125 -6.714 10.436 1.806 1.00 12.41 C ATOM 2086 O GLY A 125 -6.879 11.613 2.141 1.00 12.10 O ATOM 0 H GLY A 125 -7.447 7.488 2.001 1.00 64.51 H new ATOM 0 HA2 GLY A 125 -7.961 9.203 0.569 1.00 11.13 H new ATOM 0 HA3 GLY A 125 -8.826 10.051 1.835 1.00 11.13 H new ATOM 2090 N LEU A 126 -5.509 9.911 1.589 1.00 3.13 N ATOM 2091 CA LEU A 126 -4.271 10.682 1.767 1.00 41.10 C ATOM 2092 C LEU A 126 -3.687 11.180 0.435 1.00 33.21 C ATOM 2093 O LEU A 126 -3.014 12.217 0.396 1.00 75.31 O ATOM 2094 CB LEU A 126 -3.226 9.825 2.497 1.00 50.44 C ATOM 2095 CG LEU A 126 -3.593 9.435 3.938 1.00 70.43 C ATOM 2096 CD1 LEU A 126 -2.578 8.455 4.514 1.00 23.41 C ATOM 2097 CD2 LEU A 126 -3.698 10.673 4.823 1.00 12.40 C ATOM 0 H LEU A 126 -5.359 8.948 1.287 1.00 3.13 H new ATOM 0 HA LEU A 126 -4.523 11.561 2.360 1.00 41.10 H new ATOM 0 HB2 LEU A 126 -3.060 8.914 1.922 1.00 50.44 H new ATOM 0 HB3 LEU A 126 -2.281 10.368 2.514 1.00 50.44 H new ATOM 0 HG LEU A 126 -4.566 8.944 3.914 1.00 70.43 H new ATOM 0 HD11 LEU A 126 -2.861 8.196 5.534 1.00 23.41 H new ATOM 0 HD12 LEU A 126 -2.556 7.553 3.903 1.00 23.41 H new ATOM 0 HD13 LEU A 126 -1.590 8.915 4.518 1.00 23.41 H new ATOM 0 HD21 LEU A 126 -3.959 10.374 5.838 1.00 12.40 H new ATOM 0 HD22 LEU A 126 -2.741 11.195 4.833 1.00 12.40 H new ATOM 0 HD23 LEU A 126 -4.469 11.336 4.431 1.00 12.40 H new ATOM 2109 N SER A 127 -3.924 10.450 -0.655 1.00 72.05 N ATOM 2110 CA SER A 127 -3.304 10.794 -1.945 1.00 71.14 C ATOM 2111 C SER A 127 -4.306 10.834 -3.107 1.00 51.02 C ATOM 2112 O SER A 127 -5.394 10.260 -3.038 1.00 44.15 O ATOM 2113 CB SER A 127 -2.178 9.809 -2.274 1.00 1.12 C ATOM 2114 OG SER A 127 -2.653 8.475 -2.389 1.00 33.12 O ATOM 0 H SER A 127 -4.529 9.629 -0.677 1.00 72.05 H new ATOM 0 HA SER A 127 -2.903 11.801 -1.832 1.00 71.14 H new ATOM 0 HB2 SER A 127 -1.699 10.105 -3.207 1.00 1.12 H new ATOM 0 HB3 SER A 127 -1.416 9.857 -1.496 1.00 1.12 H new ATOM 0 HG SER A 127 -3.161 8.238 -1.585 1.00 33.12 H new ATOM 2120 N ASN A 128 -3.916 11.527 -4.180 1.00 74.14 N ATOM 2121 CA ASN A 128 -4.750 11.669 -5.384 1.00 33.43 C ATOM 2122 C ASN A 128 -4.040 11.084 -6.622 1.00 41.24 C ATOM 2123 O ASN A 128 -2.810 11.090 -6.698 1.00 31.21 O ATOM 2124 CB ASN A 128 -5.047 13.153 -5.643 1.00 11.12 C ATOM 2125 CG ASN A 128 -5.502 13.892 -4.402 1.00 54.31 C ATOM 2126 OD1 ASN A 128 -6.690 13.983 -4.108 1.00 43.35 O ATOM 2127 ND2 ASN A 128 -4.553 14.425 -3.662 1.00 72.41 N ATOM 0 H ASN A 128 -3.017 12.005 -4.242 1.00 74.14 H new ATOM 0 HA ASN A 128 -5.678 11.123 -5.214 1.00 33.43 H new ATOM 0 HB2 ASN A 128 -4.151 13.633 -6.037 1.00 11.12 H new ATOM 0 HB3 ASN A 128 -5.817 13.235 -6.410 1.00 11.12 H new ATOM 0 HD21 ASN A 128 -4.795 14.934 -2.812 1.00 72.41 H new ATOM 0 HD22 ASN A 128 -3.576 14.329 -3.938 1.00 72.41 H new ATOM 2134 N PRO A 129 -4.803 10.599 -7.626 1.00 15.01 N ATOM 2135 CA PRO A 129 -4.226 10.065 -8.880 1.00 0.44 C ATOM 2136 C PRO A 129 -3.444 11.123 -9.685 1.00 62.34 C ATOM 2137 O PRO A 129 -2.473 10.801 -10.376 1.00 42.21 O ATOM 2138 CB PRO A 129 -5.458 9.587 -9.668 1.00 0.14 C ATOM 2139 CG PRO A 129 -6.606 10.339 -9.081 1.00 61.13 C ATOM 2140 CD PRO A 129 -6.276 10.511 -7.622 1.00 43.55 C ATOM 0 HA PRO A 129 -3.497 9.280 -8.681 1.00 0.44 H new ATOM 0 HB2 PRO A 129 -5.352 9.796 -10.732 1.00 0.14 H new ATOM 0 HB3 PRO A 129 -5.598 8.511 -9.567 1.00 0.14 H new ATOM 0 HG2 PRO A 129 -6.733 11.305 -9.570 1.00 61.13 H new ATOM 0 HG3 PRO A 129 -7.540 9.791 -9.209 1.00 61.13 H new ATOM 0 HD2 PRO A 129 -6.733 11.409 -7.207 1.00 43.55 H new ATOM 0 HD3 PRO A 129 -6.629 9.669 -7.026 1.00 43.55 H new ATOM 2148 N ASN A 130 -3.871 12.385 -9.589 1.00 54.31 N ATOM 2149 CA ASN A 130 -3.211 13.487 -10.306 1.00 55.35 C ATOM 2150 C ASN A 130 -1.783 13.729 -9.787 1.00 73.03 C ATOM 2151 O ASN A 130 -0.818 13.693 -10.558 1.00 30.24 O ATOM 2152 CB ASN A 130 -4.046 14.769 -10.196 1.00 10.15 C ATOM 2153 CG ASN A 130 -5.386 14.634 -10.896 1.00 12.11 C ATOM 2154 OD1 ASN A 130 -5.517 13.909 -11.874 1.00 70.10 O ATOM 2155 ND2 ASN A 130 -6.391 15.320 -10.398 1.00 63.42 N ATOM 0 H ASN A 130 -4.670 12.672 -9.023 1.00 54.31 H new ATOM 0 HA ASN A 130 -3.135 13.201 -11.355 1.00 55.35 H new ATOM 0 HB2 ASN A 130 -4.208 15.008 -9.145 1.00 10.15 H new ATOM 0 HB3 ASN A 130 -3.492 15.601 -10.630 1.00 10.15 H new ATOM 0 HD21 ASN A 130 -7.314 15.257 -10.828 1.00 63.42 H new ATOM 0 HD22 ASN A 130 -6.248 15.915 -9.582 1.00 63.42 H new ATOM 2162 N GLU A 131 -1.647 13.971 -8.482 1.00 64.14 N ATOM 2163 CA GLU A 131 -0.324 14.143 -7.868 1.00 53.34 C ATOM 2164 C GLU A 131 0.511 12.852 -7.986 1.00 23.04 C ATOM 2165 O GLU A 131 1.739 12.897 -8.109 1.00 41.44 O ATOM 2166 CB GLU A 131 -0.463 14.564 -6.395 1.00 54.13 C ATOM 2167 CG GLU A 131 -1.056 13.495 -5.483 1.00 63.43 C ATOM 2168 CD GLU A 131 -1.057 13.904 -4.019 1.00 11.30 C ATOM 2169 OE1 GLU A 131 -0.163 14.669 -3.603 1.00 53.43 O ATOM 2170 OE2 GLU A 131 -1.953 13.462 -3.280 1.00 11.45 O ATOM 0 H GLU A 131 -2.429 14.052 -7.832 1.00 64.14 H new ATOM 0 HA GLU A 131 0.199 14.934 -8.406 1.00 53.34 H new ATOM 0 HB2 GLU A 131 0.520 14.842 -6.016 1.00 54.13 H new ATOM 0 HB3 GLU A 131 -1.088 15.455 -6.343 1.00 54.13 H new ATOM 0 HG2 GLU A 131 -2.078 13.282 -5.797 1.00 63.43 H new ATOM 0 HG3 GLU A 131 -0.489 12.571 -5.597 1.00 63.43 H new ATOM 2177 N LEU A 132 -0.175 11.706 -7.944 1.00 31.12 N ATOM 2178 CA LEU A 132 0.462 10.391 -8.104 1.00 53.40 C ATOM 2179 C LEU A 132 1.295 10.312 -9.394 1.00 41.24 C ATOM 2180 O LEU A 132 2.455 9.894 -9.371 1.00 1.22 O ATOM 2181 CB LEU A 132 -0.614 9.293 -8.105 1.00 60.21 C ATOM 2182 CG LEU A 132 -0.101 7.847 -8.222 1.00 32.14 C ATOM 2183 CD1 LEU A 132 0.803 7.491 -7.046 1.00 60.33 C ATOM 2184 CD2 LEU A 132 -1.271 6.869 -8.320 1.00 23.11 C ATOM 0 H LEU A 132 -1.184 11.661 -7.799 1.00 31.12 H new ATOM 0 HA LEU A 132 1.141 10.243 -7.265 1.00 53.40 H new ATOM 0 HB2 LEU A 132 -1.193 9.379 -7.186 1.00 60.21 H new ATOM 0 HB3 LEU A 132 -1.298 9.483 -8.932 1.00 60.21 H new ATOM 0 HG LEU A 132 0.490 7.770 -9.135 1.00 32.14 H new ATOM 0 HD11 LEU A 132 1.152 6.464 -7.153 1.00 60.33 H new ATOM 0 HD12 LEU A 132 1.659 8.165 -7.028 1.00 60.33 H new ATOM 0 HD13 LEU A 132 0.245 7.589 -6.115 1.00 60.33 H new ATOM 0 HD21 LEU A 132 -0.889 5.852 -8.402 1.00 23.11 H new ATOM 0 HD22 LEU A 132 -1.891 6.953 -7.427 1.00 23.11 H new ATOM 0 HD23 LEU A 132 -1.869 7.104 -9.201 1.00 23.11 H new ATOM 2196 N GLN A 133 0.699 10.717 -10.513 1.00 23.14 N ATOM 2197 CA GLN A 133 1.396 10.716 -11.805 1.00 2.00 C ATOM 2198 C GLN A 133 2.678 11.566 -11.758 1.00 13.51 C ATOM 2199 O GLN A 133 3.725 11.153 -12.265 1.00 72.44 O ATOM 2200 CB GLN A 133 0.459 11.224 -12.912 1.00 5.02 C ATOM 2201 CG GLN A 133 1.110 11.315 -14.291 1.00 35.34 C ATOM 2202 CD GLN A 133 1.639 9.981 -14.798 1.00 41.23 C ATOM 2203 OE1 GLN A 133 0.925 9.217 -15.439 1.00 63.02 O ATOM 2204 NE2 GLN A 133 2.898 9.694 -14.528 1.00 10.40 N ATOM 0 H GLN A 133 -0.264 11.050 -10.555 1.00 23.14 H new ATOM 0 HA GLN A 133 1.688 9.689 -12.026 1.00 2.00 H new ATOM 0 HB2 GLN A 133 -0.405 10.562 -12.973 1.00 5.02 H new ATOM 0 HB3 GLN A 133 0.086 12.209 -12.633 1.00 5.02 H new ATOM 0 HG2 GLN A 133 0.382 11.703 -15.003 1.00 35.34 H new ATOM 0 HG3 GLN A 133 1.931 12.031 -14.251 1.00 35.34 H new ATOM 0 HE21 GLN A 133 3.467 10.350 -13.993 1.00 10.40 H new ATOM 0 HE22 GLN A 133 3.302 8.816 -14.855 1.00 10.40 H new ATOM 2213 N ALA A 134 2.595 12.746 -11.142 1.00 23.44 N ATOM 2214 CA ALA A 134 3.761 13.627 -10.988 1.00 30.20 C ATOM 2215 C ALA A 134 4.865 12.947 -10.161 1.00 14.42 C ATOM 2216 O ALA A 134 6.054 13.050 -10.480 1.00 52.44 O ATOM 2217 CB ALA A 134 3.342 14.941 -10.337 1.00 23.52 C ATOM 0 H ALA A 134 1.734 13.117 -10.740 1.00 23.44 H new ATOM 0 HA ALA A 134 4.165 13.835 -11.979 1.00 30.20 H new ATOM 0 HB1 ALA A 134 4.213 15.587 -10.227 1.00 23.52 H new ATOM 0 HB2 ALA A 134 2.600 15.436 -10.963 1.00 23.52 H new ATOM 0 HB3 ALA A 134 2.913 14.740 -9.355 1.00 23.52 H new ATOM 2223 N ALA A 135 4.452 12.244 -9.107 1.00 34.45 N ATOM 2224 CA ALA A 135 5.373 11.497 -8.241 1.00 62.53 C ATOM 2225 C ALA A 135 6.117 10.401 -9.021 1.00 60.33 C ATOM 2226 O ALA A 135 7.349 10.317 -8.997 1.00 13.05 O ATOM 2227 CB ALA A 135 4.592 10.876 -7.085 1.00 42.44 C ATOM 0 H ALA A 135 3.474 12.174 -8.827 1.00 34.45 H new ATOM 0 HA ALA A 135 6.118 12.192 -7.854 1.00 62.53 H new ATOM 0 HB1 ALA A 135 5.275 10.321 -6.441 1.00 42.44 H new ATOM 0 HB2 ALA A 135 4.109 11.664 -6.508 1.00 42.44 H new ATOM 0 HB3 ALA A 135 3.835 10.199 -7.480 1.00 42.44 H new ATOM 2233 N ILE A 136 5.349 9.570 -9.720 1.00 20.14 N ATOM 2234 CA ILE A 136 5.901 8.447 -10.487 1.00 1.15 C ATOM 2235 C ILE A 136 6.817 8.927 -11.623 1.00 11.34 C ATOM 2236 O ILE A 136 7.889 8.359 -11.847 1.00 2.30 O ATOM 2237 CB ILE A 136 4.759 7.581 -11.068 1.00 55.12 C ATOM 2238 CG1 ILE A 136 3.840 7.110 -9.930 1.00 24.33 C ATOM 2239 CG2 ILE A 136 5.318 6.388 -11.851 1.00 14.43 C ATOM 2240 CD1 ILE A 136 2.534 6.521 -10.405 1.00 63.12 C ATOM 0 H ILE A 136 4.334 9.651 -9.774 1.00 20.14 H new ATOM 0 HA ILE A 136 6.501 7.848 -9.801 1.00 1.15 H new ATOM 0 HB ILE A 136 4.178 8.185 -11.765 1.00 55.12 H new ATOM 0 HG12 ILE A 136 4.368 6.366 -9.334 1.00 24.33 H new ATOM 0 HG13 ILE A 136 3.629 7.954 -9.273 1.00 24.33 H new ATOM 0 HG21 ILE A 136 4.494 5.796 -12.249 1.00 14.43 H new ATOM 0 HG22 ILE A 136 5.935 6.750 -12.673 1.00 14.43 H new ATOM 0 HG23 ILE A 136 5.923 5.769 -11.188 1.00 14.43 H new ATOM 0 HD11 ILE A 136 1.940 6.212 -9.545 1.00 63.12 H new ATOM 0 HD12 ILE A 136 1.984 7.269 -10.976 1.00 63.12 H new ATOM 0 HD13 ILE A 136 2.734 5.656 -11.038 1.00 63.12 H new ATOM 2252 N ASP A 137 6.393 9.973 -12.333 1.00 60.54 N ATOM 2253 CA ASP A 137 7.209 10.570 -13.395 1.00 31.44 C ATOM 2254 C ASP A 137 8.566 11.042 -12.845 1.00 75.25 C ATOM 2255 O ASP A 137 9.611 10.827 -13.467 1.00 12.01 O ATOM 2256 CB ASP A 137 6.458 11.738 -14.047 1.00 1.21 C ATOM 2257 CG ASP A 137 7.287 12.444 -15.108 1.00 34.33 C ATOM 2258 OD1 ASP A 137 7.467 11.876 -16.206 1.00 74.51 O ATOM 2259 OD2 ASP A 137 7.757 13.573 -14.850 1.00 32.45 O ATOM 0 H ASP A 137 5.490 10.426 -12.193 1.00 60.54 H new ATOM 0 HA ASP A 137 7.398 9.808 -14.152 1.00 31.44 H new ATOM 0 HB2 ASP A 137 5.537 11.367 -14.497 1.00 1.21 H new ATOM 0 HB3 ASP A 137 6.171 12.455 -13.278 1.00 1.21 H new ATOM 2264 N SER A 138 8.542 11.673 -11.669 1.00 31.35 N ATOM 2265 CA SER A 138 9.778 12.087 -10.992 1.00 52.23 C ATOM 2266 C SER A 138 10.680 10.875 -10.726 1.00 11.42 C ATOM 2267 O SER A 138 11.871 10.901 -11.024 1.00 24.42 O ATOM 2268 CB SER A 138 9.468 12.802 -9.668 1.00 75.34 C ATOM 2269 OG SER A 138 10.661 13.238 -9.025 1.00 15.52 O ATOM 0 H SER A 138 7.686 11.909 -11.166 1.00 31.35 H new ATOM 0 HA SER A 138 10.300 12.782 -11.650 1.00 52.23 H new ATOM 0 HB2 SER A 138 8.820 13.658 -9.857 1.00 75.34 H new ATOM 0 HB3 SER A 138 8.921 12.129 -9.008 1.00 75.34 H new ATOM 0 HG SER A 138 10.434 13.691 -8.186 1.00 15.52 H new ATOM 2275 N ASN A 139 10.092 9.799 -10.194 1.00 64.15 N ATOM 2276 CA ASN A 139 10.836 8.558 -9.925 1.00 43.21 C ATOM 2277 C ASN A 139 11.489 8.003 -11.204 1.00 61.40 C ATOM 2278 O ASN A 139 12.655 7.591 -11.190 1.00 41.20 O ATOM 2279 CB ASN A 139 9.910 7.495 -9.311 1.00 32.14 C ATOM 2280 CG ASN A 139 9.550 7.772 -7.859 1.00 74.33 C ATOM 2281 OD1 ASN A 139 9.326 6.848 -7.084 1.00 64.24 O ATOM 2282 ND2 ASN A 139 9.494 9.030 -7.471 1.00 12.01 N ATOM 0 H ASN A 139 9.105 9.759 -9.940 1.00 64.15 H new ATOM 0 HA ASN A 139 11.627 8.799 -9.215 1.00 43.21 H new ATOM 0 HB2 ASN A 139 8.995 7.438 -9.900 1.00 32.14 H new ATOM 0 HB3 ASN A 139 10.394 6.520 -9.378 1.00 32.14 H new ATOM 0 HD21 ASN A 139 9.260 9.256 -6.504 1.00 12.01 H new ATOM 0 HD22 ASN A 139 9.685 9.778 -8.137 1.00 12.01 H new ATOM 2289 N ARG A 140 10.728 8.000 -12.301 1.00 13.31 N ATOM 2290 CA ARG A 140 11.230 7.552 -13.608 1.00 75.31 C ATOM 2291 C ARG A 140 12.440 8.387 -14.054 1.00 0.44 C ATOM 2292 O ARG A 140 13.452 7.849 -14.509 1.00 72.14 O ATOM 2293 CB ARG A 140 10.116 7.665 -14.666 1.00 42.52 C ATOM 2294 CG ARG A 140 8.879 6.802 -14.393 1.00 70.24 C ATOM 2295 CD ARG A 140 9.037 5.359 -14.873 1.00 10.41 C ATOM 2296 NE ARG A 140 10.091 4.632 -14.167 1.00 64.22 N ATOM 2297 CZ ARG A 140 10.060 3.351 -13.916 1.00 14.33 C ATOM 2298 NH1 ARG A 140 9.044 2.627 -14.269 1.00 23.51 N ATOM 2299 NH2 ARG A 140 11.050 2.794 -13.308 1.00 53.24 N ATOM 0 H ARG A 140 9.755 8.305 -12.312 1.00 13.31 H new ATOM 0 HA ARG A 140 11.542 6.512 -13.509 1.00 75.31 H new ATOM 0 HB2 ARG A 140 9.806 8.708 -14.736 1.00 42.52 H new ATOM 0 HB3 ARG A 140 10.527 7.389 -15.637 1.00 42.52 H new ATOM 0 HG2 ARG A 140 8.672 6.802 -13.323 1.00 70.24 H new ATOM 0 HG3 ARG A 140 8.015 7.250 -14.885 1.00 70.24 H new ATOM 0 HD2 ARG A 140 8.091 4.833 -14.742 1.00 10.41 H new ATOM 0 HD3 ARG A 140 9.257 5.359 -15.941 1.00 10.41 H new ATOM 0 HE ARG A 140 10.904 5.160 -13.850 1.00 64.22 H new ATOM 0 HH11 ARG A 140 8.254 3.057 -14.750 1.00 23.51 H new ATOM 0 HH12 ARG A 140 9.035 1.627 -14.066 1.00 23.51 H new ATOM 0 HH21 ARG A 140 11.854 3.353 -13.024 1.00 53.24 H new ATOM 0 HH22 ARG A 140 11.029 1.794 -13.110 1.00 53.24 H new ATOM 2313 N ARG A 141 12.324 9.704 -13.907 1.00 20.14 N ATOM 2314 CA ARG A 141 13.355 10.638 -14.366 1.00 70.14 C ATOM 2315 C ARG A 141 14.589 10.645 -13.443 1.00 71.31 C ATOM 2316 O ARG A 141 15.718 10.835 -13.908 1.00 10.22 O ATOM 2317 CB ARG A 141 12.758 12.048 -14.469 1.00 3.43 C ATOM 2318 CG ARG A 141 13.681 13.075 -15.119 1.00 53.42 C ATOM 2319 CD ARG A 141 13.008 14.438 -15.227 1.00 4.32 C ATOM 2320 NE ARG A 141 13.855 15.423 -15.896 1.00 4.13 N ATOM 2321 CZ ARG A 141 13.582 16.696 -15.958 1.00 43.13 C ATOM 2322 NH1 ARG A 141 12.512 17.168 -15.406 1.00 32.14 N ATOM 2323 NH2 ARG A 141 14.386 17.498 -16.576 1.00 11.21 N ATOM 0 H ARG A 141 11.520 10.154 -13.470 1.00 20.14 H new ATOM 0 HA ARG A 141 13.694 10.306 -15.347 1.00 70.14 H new ATOM 0 HB2 ARG A 141 11.831 11.997 -15.041 1.00 3.43 H new ATOM 0 HB3 ARG A 141 12.497 12.393 -13.469 1.00 3.43 H new ATOM 0 HG2 ARG A 141 14.597 13.165 -14.534 1.00 53.42 H new ATOM 0 HG3 ARG A 141 13.969 12.730 -16.112 1.00 53.42 H new ATOM 0 HD2 ARG A 141 12.071 14.336 -15.775 1.00 4.32 H new ATOM 0 HD3 ARG A 141 12.756 14.797 -14.229 1.00 4.32 H new ATOM 0 HE ARG A 141 14.712 15.094 -16.341 1.00 4.13 H new ATOM 0 HH11 ARG A 141 11.872 16.542 -14.916 1.00 32.14 H new ATOM 0 HH12 ARG A 141 12.308 18.166 -15.460 1.00 32.14 H new ATOM 0 HH21 ARG A 141 15.232 17.134 -17.014 1.00 11.21 H new ATOM 0 HH22 ARG A 141 14.174 18.494 -16.626 1.00 11.21 H new ATOM 2337 N GLU A 142 14.377 10.453 -12.139 1.00 32.31 N ATOM 2338 CA GLU A 142 15.488 10.416 -11.173 1.00 63.31 C ATOM 2339 C GLU A 142 16.416 9.216 -11.416 1.00 5.43 C ATOM 2340 O GLU A 142 17.640 9.356 -11.420 1.00 4.21 O ATOM 2341 CB GLU A 142 14.964 10.372 -9.729 1.00 1.10 C ATOM 2342 CG GLU A 142 14.253 11.644 -9.274 1.00 12.40 C ATOM 2343 CD GLU A 142 13.840 11.577 -7.812 1.00 64.21 C ATOM 2344 OE1 GLU A 142 12.871 10.857 -7.492 1.00 21.34 O ATOM 2345 OE2 GLU A 142 14.505 12.215 -6.966 1.00 20.31 O ATOM 0 H GLU A 142 13.454 10.321 -11.725 1.00 32.31 H new ATOM 0 HA GLU A 142 16.061 11.331 -11.319 1.00 63.31 H new ATOM 0 HB2 GLU A 142 14.277 9.532 -9.631 1.00 1.10 H new ATOM 0 HB3 GLU A 142 15.801 10.179 -9.058 1.00 1.10 H new ATOM 0 HG2 GLU A 142 14.910 12.500 -9.426 1.00 12.40 H new ATOM 0 HG3 GLU A 142 13.370 11.806 -9.893 1.00 12.40 H new ATOM 2352 N GLY A 143 15.832 8.032 -11.608 1.00 44.03 N ATOM 2353 CA GLY A 143 16.639 6.839 -11.862 1.00 5.11 C ATOM 2354 C GLY A 143 16.075 5.544 -11.272 1.00 3.35 C ATOM 2355 O GLY A 143 16.758 4.519 -11.276 1.00 20.44 O ATOM 0 H GLY A 143 14.824 7.875 -11.593 1.00 44.03 H new ATOM 0 HA2 GLY A 143 16.747 6.714 -12.939 1.00 5.11 H new ATOM 0 HA3 GLY A 143 17.638 7.001 -11.458 1.00 5.11 H new ATOM 2359 N ARG A 144 14.839 5.569 -10.764 1.00 23.03 N ATOM 2360 CA ARG A 144 14.210 4.344 -10.243 1.00 72.52 C ATOM 2361 C ARG A 144 13.785 3.407 -11.387 1.00 54.04 C ATOM 2362 O ARG A 144 13.358 3.861 -12.452 1.00 23.32 O ATOM 2363 CB ARG A 144 13.008 4.665 -9.332 1.00 50.15 C ATOM 2364 CG ARG A 144 13.404 4.999 -7.893 1.00 30.12 C ATOM 2365 CD ARG A 144 12.186 5.187 -6.988 1.00 54.33 C ATOM 2366 NE ARG A 144 12.568 5.345 -5.582 1.00 24.31 N ATOM 2367 CZ ARG A 144 11.758 5.731 -4.631 1.00 70.15 C ATOM 2368 NH1 ARG A 144 10.532 6.057 -4.894 1.00 2.25 N ATOM 2369 NH2 ARG A 144 12.188 5.803 -3.414 1.00 5.41 N ATOM 0 H ARG A 144 14.260 6.406 -10.701 1.00 23.03 H new ATOM 0 HA ARG A 144 14.959 3.830 -9.640 1.00 72.52 H new ATOM 0 HB2 ARG A 144 12.458 5.506 -9.753 1.00 50.15 H new ATOM 0 HB3 ARG A 144 12.330 3.812 -9.325 1.00 50.15 H new ATOM 0 HG2 ARG A 144 14.030 4.200 -7.495 1.00 30.12 H new ATOM 0 HG3 ARG A 144 14.004 5.909 -7.885 1.00 30.12 H new ATOM 0 HD2 ARG A 144 11.625 6.063 -7.312 1.00 54.33 H new ATOM 0 HD3 ARG A 144 11.523 4.328 -7.089 1.00 54.33 H new ATOM 0 HE ARG A 144 13.534 5.139 -5.327 1.00 24.31 H new ATOM 0 HH11 ARG A 144 10.187 6.014 -5.853 1.00 2.25 H new ATOM 0 HH12 ARG A 144 9.911 6.356 -4.142 1.00 2.25 H new ATOM 0 HH21 ARG A 144 13.155 5.559 -3.200 1.00 5.41 H new ATOM 0 HH22 ARG A 144 11.560 6.104 -2.668 1.00 5.41 H new ATOM 2383 N ARG A 145 13.901 2.101 -11.146 1.00 3.22 N ATOM 2384 CA ARG A 145 13.661 1.075 -12.176 1.00 42.01 C ATOM 2385 C ARG A 145 12.491 0.143 -11.786 1.00 23.32 C ATOM 2386 O ARG A 145 11.380 0.312 -12.335 1.00 37.74 O ATOM 2387 CB ARG A 145 14.936 0.243 -12.362 1.00 70.35 C ATOM 2388 CG ARG A 145 16.197 1.074 -12.571 1.00 63.53 C ATOM 2389 CD ARG A 145 17.449 0.284 -12.209 1.00 4.23 C ATOM 2390 NE ARG A 145 17.392 -0.213 -10.830 1.00 44.44 N ATOM 2391 CZ ARG A 145 18.208 0.158 -9.877 1.00 1.21 C ATOM 2392 NH1 ARG A 145 19.119 1.054 -10.094 1.00 10.41 N ATOM 2393 NH2 ARG A 145 18.082 -0.345 -8.691 1.00 0.14 N ATOM 2394 OXT ARG A 145 12.703 -0.744 -10.922 1.00 37.74 O ATOM 0 H ARG A 145 14.163 1.720 -10.237 1.00 3.22 H new ATOM 0 HA ARG A 145 13.395 1.578 -13.106 1.00 42.01 H new ATOM 0 HB2 ARG A 145 15.073 -0.392 -11.487 1.00 70.35 H new ATOM 0 HB3 ARG A 145 14.804 -0.418 -13.218 1.00 70.35 H new ATOM 0 HG2 ARG A 145 16.255 1.395 -13.611 1.00 63.53 H new ATOM 0 HG3 ARG A 145 16.145 1.976 -11.962 1.00 63.53 H new ATOM 0 HD2 ARG A 145 17.562 -0.556 -12.895 1.00 4.23 H new ATOM 0 HD3 ARG A 145 18.328 0.917 -12.333 1.00 4.23 H new ATOM 0 HE ARG A 145 16.668 -0.893 -10.599 1.00 44.44 H new ATOM 0 HH11 ARG A 145 19.206 1.479 -11.017 1.00 10.41 H new ATOM 0 HH12 ARG A 145 19.749 1.334 -9.342 1.00 10.41 H new ATOM 0 HH21 ARG A 145 17.348 -1.028 -8.502 1.00 0.14 H new ATOM 0 HH22 ARG A 145 18.716 -0.058 -7.945 1.00 0.14 H new TER 2408 ARG A 145