USER MOD reduce.3.24.130724 H: found=0, std=0, add=1087, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 1084 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 63 LYS NZ :NH3+ -133:sc= -4.1! (180deg=-7!) USER MOD Set 1.2: A 65 THR OG1 : rot 180:sc= 0.0346 USER MOD Set 1.3: A 93 THR OG1 : rot 180:sc= -0.857 USER MOD Set 2.1: A 20 THR OG1 : rot 180:sc= 0.163 USER MOD Set 2.2: A 21 LYS NZ :NH3+ -128:sc= 0.574 (180deg=0) USER MOD Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 180:sc= 0.0231 USER MOD Single : A 9 HIS : no HD1:sc= -0.0215 X(o=-0.021,f=0) USER MOD Single : A 13 TYR OH : rot 30:sc= 0 USER MOD Single : A 15 SER OG : rot -80:sc= -0.971 USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.0946 USER MOD Single : A 33 ASN : amide:sc= -0.12 X(o=-0.12,f=-0.13) USER MOD Single : A 41 ASN : amide:sc= -0.315 X(o=-0.31,f=-0.5) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 LYS NZ :NH3+ 162:sc= -0.0976 (180deg=-0.852) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0.00558 USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 HIS : no HD1:sc= 0 X(o=0,f=-0.0099) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 31:sc= 0.779 USER MOD Single : A 99 HIS : no HD1:sc= -0.128 X(o=-0.13,f=-0.42) USER MOD Single : A 106 HIS : no HE2:sc= 0.765 K(o=0.76,f=-2.3!) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 ASN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : A 124 ASN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 125 GLN : amide:sc= -2.04 K(o=-2,f=-4.1!) USER MOD Single : A 130 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 GLN : amide:sc= -1.8 K(o=-1.8,f=-8.6!) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ -157:sc= -0.103 (180deg=-0.522) USER MOD Single : A 138 SER OG : rot 180:sc= -0.0684 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 3 -9.016 -14.616 2.153 1.00 63.21 N ATOM 2 CA ASP A 3 -9.892 -13.582 1.615 1.00 1.10 C ATOM 3 C ASP A 3 -9.092 -12.543 0.836 1.00 54.11 C ATOM 4 O ASP A 3 -7.927 -12.287 1.140 1.00 24.32 O ATOM 5 CB ASP A 3 -10.669 -12.904 2.745 1.00 23.13 C ATOM 6 CG ASP A 3 -9.774 -12.489 3.895 1.00 5.44 C ATOM 7 OD1 ASP A 3 -8.990 -11.534 3.723 1.00 40.21 O ATOM 8 OD2 ASP A 3 -9.856 -13.122 4.969 1.00 10.33 O1- ATOM 0 HA ASP A 3 -10.597 -14.056 0.933 1.00 1.10 H new ATOM 0 HB2 ASP A 3 -11.183 -12.026 2.353 1.00 23.13 H new ATOM 0 HB3 ASP A 3 -11.437 -13.584 3.113 1.00 23.13 H new ATOM 13 N VAL A 4 -9.726 -11.949 -0.171 1.00 1.21 N ATOM 14 CA VAL A 4 -9.073 -10.939 -0.994 1.00 45.01 C ATOM 15 C VAL A 4 -9.631 -9.549 -0.703 1.00 4.33 C ATOM 16 O VAL A 4 -10.843 -9.368 -0.589 1.00 12.14 O ATOM 17 CB VAL A 4 -9.239 -11.243 -2.494 1.00 11.04 C ATOM 18 CG1 VAL A 4 -10.710 -11.226 -2.883 1.00 11.12 C ATOM 19 CG2 VAL A 4 -8.446 -10.250 -3.330 1.00 24.21 C ATOM 0 H VAL A 4 -10.690 -12.150 -0.436 1.00 1.21 H new ATOM 0 HA VAL A 4 -8.013 -10.963 -0.742 1.00 45.01 H new ATOM 0 HB VAL A 4 -8.848 -12.241 -2.690 1.00 11.04 H new ATOM 0 HG11 VAL A 4 -10.808 -11.443 -3.947 1.00 11.12 H new ATOM 0 HG12 VAL A 4 -11.247 -11.980 -2.308 1.00 11.12 H new ATOM 0 HG13 VAL A 4 -11.130 -10.242 -2.673 1.00 11.12 H new ATOM 0 HG21 VAL A 4 -8.575 -10.480 -4.388 1.00 24.21 H new ATOM 0 HG22 VAL A 4 -8.804 -9.240 -3.132 1.00 24.21 H new ATOM 0 HG23 VAL A 4 -7.390 -10.318 -3.070 1.00 24.21 H new ATOM 29 N TYR A 5 -8.738 -8.573 -0.587 1.00 14.41 N ATOM 30 CA TYR A 5 -9.142 -7.199 -0.308 1.00 14.11 C ATOM 31 C TYR A 5 -8.961 -6.318 -1.540 1.00 34.31 C ATOM 32 O TYR A 5 -7.938 -6.384 -2.221 1.00 3.50 O ATOM 33 CB TYR A 5 -8.331 -6.634 0.860 1.00 22.13 C ATOM 34 CG TYR A 5 -6.844 -6.882 0.741 1.00 23.14 C ATOM 35 CD1 TYR A 5 -6.035 -6.032 -0.003 1.00 4.24 C ATOM 36 CD2 TYR A 5 -6.248 -7.969 1.370 1.00 11.34 C ATOM 37 CE1 TYR A 5 -4.676 -6.255 -0.115 1.00 42.42 C ATOM 38 CE2 TYR A 5 -4.890 -8.198 1.264 1.00 71.45 C ATOM 39 CZ TYR A 5 -4.108 -7.339 0.521 1.00 3.24 C ATOM 40 OH TYR A 5 -2.756 -7.566 0.411 1.00 3.20 O ATOM 0 H TYR A 5 -7.731 -8.707 -0.682 1.00 14.41 H new ATOM 0 HA TYR A 5 -10.198 -7.205 -0.039 1.00 14.11 H new ATOM 0 HB2 TYR A 5 -8.507 -5.561 0.928 1.00 22.13 H new ATOM 0 HB3 TYR A 5 -8.691 -7.076 1.789 1.00 22.13 H new ATOM 0 HD1 TYR A 5 -6.476 -5.182 -0.503 1.00 4.24 H new ATOM 0 HD2 TYR A 5 -6.857 -8.646 1.951 1.00 11.34 H new ATOM 0 HE1 TYR A 5 -4.062 -5.584 -0.697 1.00 42.42 H new ATOM 0 HE2 TYR A 5 -4.443 -9.046 1.761 1.00 71.45 H new ATOM 0 HH TYR A 5 -2.517 -8.369 0.919 1.00 3.20 H new ATOM 50 N THR A 6 -9.964 -5.491 -1.820 1.00 71.00 N ATOM 51 CA THR A 6 -9.918 -4.596 -2.969 1.00 14.31 C ATOM 52 C THR A 6 -9.852 -3.138 -2.528 1.00 73.50 C ATOM 53 O THR A 6 -9.763 -2.844 -1.337 1.00 43.33 O ATOM 54 CB THR A 6 -11.144 -4.789 -3.881 1.00 51.52 C ATOM 55 OG1 THR A 6 -12.309 -4.231 -3.262 1.00 70.22 O ATOM 56 CG2 THR A 6 -11.377 -6.265 -4.170 1.00 71.11 C ATOM 0 H THR A 6 -10.818 -5.423 -1.266 1.00 71.00 H new ATOM 0 HA THR A 6 -9.016 -4.845 -3.528 1.00 14.31 H new ATOM 0 HB THR A 6 -10.952 -4.275 -4.823 1.00 51.52 H new ATOM 0 HG1 THR A 6 -13.083 -4.357 -3.849 1.00 70.22 H new ATOM 0 HG21 THR A 6 -12.248 -6.376 -4.816 1.00 71.11 H new ATOM 0 HG22 THR A 6 -10.501 -6.681 -4.667 1.00 71.11 H new ATOM 0 HG23 THR A 6 -11.549 -6.796 -3.234 1.00 71.11 H new ATOM 64 N SER A 7 -9.896 -2.230 -3.497 1.00 24.13 N ATOM 65 CA SER A 7 -9.838 -0.801 -3.209 1.00 4.43 C ATOM 66 C SER A 7 -11.161 -0.310 -2.628 1.00 34.24 C ATOM 67 O SER A 7 -12.084 -1.095 -2.408 1.00 13.42 O ATOM 68 CB SER A 7 -9.504 -0.016 -4.479 1.00 10.54 C ATOM 69 OG SER A 7 -8.737 -0.800 -5.376 1.00 74.54 O ATOM 0 H SER A 7 -9.972 -2.458 -4.488 1.00 24.13 H new ATOM 0 HA SER A 7 -9.053 -0.636 -2.471 1.00 4.43 H new ATOM 0 HB2 SER A 7 -10.425 0.303 -4.966 1.00 10.54 H new ATOM 0 HB3 SER A 7 -8.953 0.887 -4.218 1.00 10.54 H new ATOM 0 HG SER A 7 -8.538 -0.276 -6.180 1.00 74.54 H new ATOM 75 N ILE A 8 -11.243 0.993 -2.381 1.00 55.43 N ATOM 76 CA ILE A 8 -12.451 1.590 -1.826 1.00 25.01 C ATOM 77 C ILE A 8 -13.375 2.089 -2.930 1.00 21.43 C ATOM 78 O ILE A 8 -12.966 2.867 -3.794 1.00 13.54 O ATOM 79 CB ILE A 8 -12.119 2.760 -0.882 1.00 54.34 C ATOM 80 CG1 ILE A 8 -11.182 2.293 0.235 1.00 4.33 C ATOM 81 CG2 ILE A 8 -13.395 3.349 -0.298 1.00 52.02 C ATOM 82 CD1 ILE A 8 -9.717 2.374 -0.131 1.00 12.02 C ATOM 0 H ILE A 8 -10.487 1.655 -2.556 1.00 55.43 H new ATOM 0 HA ILE A 8 -12.956 0.808 -1.258 1.00 25.01 H new ATOM 0 HB ILE A 8 -11.613 3.537 -1.455 1.00 54.34 H new ATOM 0 HG12 ILE A 8 -11.360 2.898 1.124 1.00 4.33 H new ATOM 0 HG13 ILE A 8 -11.426 1.263 0.496 1.00 4.33 H new ATOM 0 HG21 ILE A 8 -13.143 4.175 0.367 1.00 52.02 H new ATOM 0 HG22 ILE A 8 -14.030 3.714 -1.105 1.00 52.02 H new ATOM 0 HG23 ILE A 8 -13.927 2.581 0.263 1.00 52.02 H new ATOM 0 HD11 ILE A 8 -9.113 2.028 0.707 1.00 12.02 H new ATOM 0 HD12 ILE A 8 -9.524 1.746 -1.001 1.00 12.02 H new ATOM 0 HD13 ILE A 8 -9.457 3.407 -0.364 1.00 12.02 H new ATOM 94 N HIS A 9 -14.626 1.639 -2.898 1.00 22.41 N ATOM 95 CA HIS A 9 -15.610 2.043 -3.896 1.00 40.14 C ATOM 96 C HIS A 9 -16.832 2.669 -3.231 1.00 0.44 C ATOM 97 O HIS A 9 -17.086 2.451 -2.047 1.00 31.34 O ATOM 98 CB HIS A 9 -16.034 0.841 -4.740 1.00 13.31 C ATOM 99 CG HIS A 9 -15.212 0.659 -5.979 1.00 14.24 C ATOM 100 ND1 HIS A 9 -15.736 0.202 -7.170 1.00 60.14 N ATOM 101 CD2 HIS A 9 -13.896 0.877 -6.208 1.00 65.44 C ATOM 102 CE1 HIS A 9 -14.778 0.146 -8.078 1.00 42.51 C ATOM 103 NE2 HIS A 9 -13.651 0.550 -7.519 1.00 14.34 N ATOM 0 H HIS A 9 -14.982 0.995 -2.192 1.00 22.41 H new ATOM 0 HA HIS A 9 -15.149 2.788 -4.544 1.00 40.14 H new ATOM 0 HB2 HIS A 9 -15.965 -0.061 -4.133 1.00 13.31 H new ATOM 0 HB3 HIS A 9 -17.081 0.956 -5.022 1.00 13.31 H new ATOM 0 HD2 HIS A 9 -13.173 1.241 -5.493 1.00 65.44 H new ATOM 0 HE1 HIS A 9 -14.896 -0.175 -9.102 1.00 42.51 H new ATOM 0 HE2 HIS A 9 -12.746 0.609 -7.986 1.00 14.34 H new ATOM 111 N ILE A 10 -17.584 3.447 -4.002 1.00 62.41 N ATOM 112 CA ILE A 10 -18.779 4.105 -3.488 1.00 5.23 C ATOM 113 C ILE A 10 -20.038 3.555 -4.151 1.00 41.15 C ATOM 114 O ILE A 10 -20.205 3.657 -5.365 1.00 13.04 O ATOM 115 CB ILE A 10 -18.722 5.629 -3.705 1.00 51.44 C ATOM 116 CG1 ILE A 10 -17.541 6.230 -2.939 1.00 72.52 C ATOM 117 CG2 ILE A 10 -20.028 6.275 -3.268 1.00 54.40 C ATOM 118 CD1 ILE A 10 -17.680 6.127 -1.436 1.00 33.02 C ATOM 0 H ILE A 10 -17.387 3.637 -4.985 1.00 62.41 H new ATOM 0 HA ILE A 10 -18.815 3.900 -2.418 1.00 5.23 H new ATOM 0 HB ILE A 10 -18.580 5.826 -4.768 1.00 51.44 H new ATOM 0 HG12 ILE A 10 -16.625 5.726 -3.246 1.00 72.52 H new ATOM 0 HG13 ILE A 10 -17.436 7.279 -3.215 1.00 72.52 H new ATOM 0 HG21 ILE A 10 -19.972 7.352 -3.427 1.00 54.40 H new ATOM 0 HG22 ILE A 10 -20.851 5.864 -3.853 1.00 54.40 H new ATOM 0 HG23 ILE A 10 -20.198 6.073 -2.210 1.00 54.40 H new ATOM 0 HD11 ILE A 10 -16.807 6.573 -0.959 1.00 33.02 H new ATOM 0 HD12 ILE A 10 -18.578 6.656 -1.117 1.00 33.02 H new ATOM 0 HD13 ILE A 10 -17.755 5.078 -1.149 1.00 33.02 H new ATOM 130 N GLU A 11 -20.921 2.975 -3.344 1.00 14.33 N ATOM 131 CA GLU A 11 -22.165 2.410 -3.853 1.00 21.25 C ATOM 132 C GLU A 11 -23.255 3.475 -3.929 1.00 42.40 C ATOM 133 O GLU A 11 -23.165 4.515 -3.277 1.00 51.11 O ATOM 134 CB GLU A 11 -22.626 1.252 -2.966 1.00 50.43 C ATOM 135 CG GLU A 11 -21.977 -0.077 -3.312 1.00 44.11 C ATOM 136 CD GLU A 11 -22.921 -1.251 -3.139 1.00 11.42 C ATOM 137 OE1 GLU A 11 -23.082 -1.718 -1.992 1.00 55.02 O ATOM 138 OE2 GLU A 11 -23.499 -1.701 -4.150 1.00 31.51 O1- ATOM 0 H GLU A 11 -20.798 2.884 -2.336 1.00 14.33 H new ATOM 0 HA GLU A 11 -21.979 2.034 -4.859 1.00 21.25 H new ATOM 0 HB2 GLU A 11 -22.407 1.493 -1.926 1.00 50.43 H new ATOM 0 HB3 GLU A 11 -23.708 1.151 -3.049 1.00 50.43 H new ATOM 0 HG2 GLU A 11 -21.625 -0.048 -4.343 1.00 44.11 H new ATOM 0 HG3 GLU A 11 -21.101 -0.224 -2.681 1.00 44.11 H new ATOM 145 N GLU A 12 -24.283 3.206 -4.727 1.00 22.22 N ATOM 146 CA GLU A 12 -25.389 4.142 -4.888 1.00 35.34 C ATOM 147 C GLU A 12 -26.717 3.399 -5.008 1.00 30.44 C ATOM 148 O GLU A 12 -26.969 2.711 -5.998 1.00 41.32 O ATOM 149 CB GLU A 12 -25.171 5.018 -6.122 1.00 64.20 C ATOM 150 CG GLU A 12 -24.716 4.242 -7.347 1.00 75.35 C ATOM 151 CD GLU A 12 -25.170 4.881 -8.644 1.00 25.02 C ATOM 152 OE1 GLU A 12 -24.571 5.901 -9.047 1.00 51.50 O ATOM 153 OE2 GLU A 12 -26.125 4.362 -9.258 1.00 22.11 O1- ATOM 0 H GLU A 12 -24.373 2.348 -5.272 1.00 22.22 H new ATOM 0 HA GLU A 12 -25.425 4.777 -4.003 1.00 35.34 H new ATOM 0 HB2 GLU A 12 -26.100 5.538 -6.356 1.00 64.20 H new ATOM 0 HB3 GLU A 12 -24.428 5.781 -5.889 1.00 64.20 H new ATOM 0 HG2 GLU A 12 -23.628 4.170 -7.343 1.00 75.35 H new ATOM 0 HG3 GLU A 12 -25.103 3.225 -7.293 1.00 75.35 H new ATOM 160 N TYR A 13 -27.562 3.542 -3.992 1.00 22.50 N ATOM 161 CA TYR A 13 -28.862 2.882 -3.981 1.00 61.54 C ATOM 162 C TYR A 13 -29.989 3.897 -4.154 1.00 2.15 C ATOM 163 O TYR A 13 -29.908 5.020 -3.658 1.00 12.31 O ATOM 164 CB TYR A 13 -29.054 2.108 -2.676 1.00 3.33 C ATOM 165 CG TYR A 13 -28.300 0.799 -2.632 1.00 52.40 C ATOM 166 CD1 TYR A 13 -26.916 0.775 -2.511 1.00 2.40 C ATOM 167 CD2 TYR A 13 -28.971 -0.415 -2.714 1.00 44.14 C ATOM 168 CE1 TYR A 13 -26.222 -0.419 -2.471 1.00 40.42 C ATOM 169 CE2 TYR A 13 -28.286 -1.614 -2.674 1.00 2.10 C ATOM 170 CZ TYR A 13 -26.912 -1.611 -2.553 1.00 52.02 C ATOM 171 OH TYR A 13 -26.226 -2.803 -2.514 1.00 41.41 O ATOM 0 H TYR A 13 -27.370 4.109 -3.166 1.00 22.50 H new ATOM 0 HA TYR A 13 -28.894 2.184 -4.817 1.00 61.54 H new ATOM 0 HB2 TYR A 13 -28.731 2.732 -1.843 1.00 3.33 H new ATOM 0 HB3 TYR A 13 -30.116 1.911 -2.533 1.00 3.33 H new ATOM 0 HD1 TYR A 13 -26.373 1.706 -2.447 1.00 2.40 H new ATOM 0 HD2 TYR A 13 -30.047 -0.421 -2.811 1.00 44.14 H new ATOM 0 HE1 TYR A 13 -25.146 -0.419 -2.376 1.00 40.42 H new ATOM 0 HE2 TYR A 13 -28.823 -2.549 -2.737 1.00 2.10 H new ATOM 0 HH TYR A 13 -25.413 -2.695 -1.978 1.00 41.41 H new ATOM 181 N GLU A 14 -31.039 3.491 -4.861 1.00 51.13 N ATOM 182 CA GLU A 14 -32.182 4.364 -5.100 1.00 44.05 C ATOM 183 C GLU A 14 -33.440 3.804 -4.442 1.00 34.43 C ATOM 184 O GLU A 14 -33.597 2.590 -4.309 1.00 43.23 O ATOM 185 CB GLU A 14 -32.413 4.539 -6.602 1.00 41.01 C ATOM 186 CG GLU A 14 -32.921 5.920 -6.982 1.00 63.43 C ATOM 187 CD GLU A 14 -32.889 6.162 -8.479 1.00 53.14 C ATOM 188 OE1 GLU A 14 -32.877 5.172 -9.241 1.00 2.11 O ATOM 189 OE2 GLU A 14 -32.875 7.341 -8.889 1.00 40.11 O1- ATOM 0 H GLU A 14 -31.122 2.564 -5.278 1.00 51.13 H new ATOM 0 HA GLU A 14 -31.963 5.336 -4.658 1.00 44.05 H new ATOM 0 HB2 GLU A 14 -31.479 4.347 -7.130 1.00 41.01 H new ATOM 0 HB3 GLU A 14 -33.130 3.791 -6.941 1.00 41.01 H new ATOM 0 HG2 GLU A 14 -33.942 6.040 -6.620 1.00 63.43 H new ATOM 0 HG3 GLU A 14 -32.315 6.676 -6.482 1.00 63.43 H new ATOM 196 N SER A 15 -34.336 4.698 -4.033 1.00 45.22 N ATOM 197 CA SER A 15 -35.578 4.295 -3.386 1.00 21.12 C ATOM 198 C SER A 15 -36.582 5.444 -3.373 1.00 40.40 C ATOM 199 O SER A 15 -36.418 6.416 -2.637 1.00 61.11 O ATOM 200 CB SER A 15 -35.304 3.826 -1.956 1.00 50.55 C ATOM 201 OG SER A 15 -36.125 2.722 -1.615 1.00 60.35 O ATOM 0 H SER A 15 -34.224 5.706 -4.139 1.00 45.22 H new ATOM 0 HA SER A 15 -36.004 3.470 -3.956 1.00 21.12 H new ATOM 0 HB2 SER A 15 -34.255 3.548 -1.856 1.00 50.55 H new ATOM 0 HB3 SER A 15 -35.484 4.646 -1.260 1.00 50.55 H new ATOM 0 HG SER A 15 -37.019 3.042 -1.371 1.00 60.35 H new ATOM 207 N GLU A 16 -37.621 5.323 -4.196 1.00 11.34 N ATOM 208 CA GLU A 16 -38.650 6.352 -4.280 1.00 40.23 C ATOM 209 C GLU A 16 -40.037 5.751 -4.075 1.00 3.23 C ATOM 210 O GLU A 16 -40.304 4.623 -4.489 1.00 64.35 O ATOM 211 CB GLU A 16 -38.583 7.062 -5.633 1.00 4.30 C ATOM 212 CG GLU A 16 -39.098 6.220 -6.788 1.00 43.20 C ATOM 213 CD GLU A 16 -38.453 6.585 -8.111 1.00 63.23 C ATOM 214 OE1 GLU A 16 -37.813 7.655 -8.182 1.00 62.45 O ATOM 215 OE2 GLU A 16 -38.585 5.801 -9.073 1.00 71.20 O1- ATOM 0 H GLU A 16 -37.771 4.524 -4.812 1.00 11.34 H new ATOM 0 HA GLU A 16 -38.468 7.079 -3.488 1.00 40.23 H new ATOM 0 HB2 GLU A 16 -39.163 7.984 -5.579 1.00 4.30 H new ATOM 0 HB3 GLU A 16 -37.550 7.346 -5.834 1.00 4.30 H new ATOM 0 HG2 GLU A 16 -38.912 5.167 -6.576 1.00 43.20 H new ATOM 0 HG3 GLU A 16 -40.178 6.343 -6.869 1.00 43.20 H new ATOM 222 N ALA A 17 -40.918 6.513 -3.434 1.00 45.31 N ATOM 223 CA ALA A 17 -42.278 6.057 -3.176 1.00 31.31 C ATOM 224 C ALA A 17 -43.147 6.190 -4.423 1.00 53.14 C ATOM 225 O ALA A 17 -43.666 7.267 -4.717 1.00 52.54 O ATOM 226 CB ALA A 17 -42.886 6.837 -2.021 1.00 33.40 C ATOM 0 H ALA A 17 -40.714 7.449 -3.084 1.00 45.31 H new ATOM 0 HA ALA A 17 -42.236 5.002 -2.905 1.00 31.31 H new ATOM 0 HB1 ALA A 17 -43.902 6.486 -1.840 1.00 33.40 H new ATOM 0 HB2 ALA A 17 -42.285 6.687 -1.124 1.00 33.40 H new ATOM 0 HB3 ALA A 17 -42.908 7.898 -2.270 1.00 33.40 H new ATOM 232 N ARG A 18 -43.301 5.089 -5.151 1.00 33.11 N ATOM 233 CA ARG A 18 -44.106 5.084 -6.366 1.00 74.51 C ATOM 234 C ARG A 18 -45.584 4.891 -6.039 1.00 1.22 C ATOM 235 O ARG A 18 -45.947 4.024 -5.244 1.00 0.43 O ATOM 236 CB ARG A 18 -43.634 3.977 -7.312 1.00 24.01 C ATOM 237 CG ARG A 18 -42.130 3.964 -7.531 1.00 71.34 C ATOM 238 CD ARG A 18 -41.740 3.025 -8.662 1.00 21.32 C ATOM 239 NE ARG A 18 -41.967 3.623 -9.974 1.00 34.15 N ATOM 240 CZ ARG A 18 -41.829 2.961 -11.117 1.00 3.12 C ATOM 241 NH1 ARG A 18 -41.466 1.687 -11.110 1.00 25.32 N1+ ATOM 242 NH2 ARG A 18 -42.055 3.575 -12.272 1.00 33.24 N ATOM 0 H ARG A 18 -42.879 4.189 -4.921 1.00 33.11 H new ATOM 0 HA ARG A 18 -43.983 6.050 -6.857 1.00 74.51 H new ATOM 0 HB2 ARG A 18 -43.943 3.012 -6.911 1.00 24.01 H new ATOM 0 HB3 ARG A 18 -44.132 4.096 -8.274 1.00 24.01 H new ATOM 0 HG2 ARG A 18 -41.786 4.973 -7.759 1.00 71.34 H new ATOM 0 HG3 ARG A 18 -41.630 3.656 -6.613 1.00 71.34 H new ATOM 0 HD2 ARG A 18 -40.688 2.756 -8.563 1.00 21.32 H new ATOM 0 HD3 ARG A 18 -42.314 2.102 -8.580 1.00 21.32 H new ATOM 0 HE ARG A 18 -42.247 4.603 -10.015 1.00 34.15 H new ATOM 0 HH11 ARG A 18 -41.292 1.211 -10.225 1.00 25.32 H new ATOM 0 HH12 ARG A 18 -41.361 1.182 -11.990 1.00 25.32 H new ATOM 0 HH21 ARG A 18 -42.335 4.556 -12.282 1.00 33.24 H new ATOM 0 HH22 ARG A 18 -41.949 3.066 -13.150 1.00 33.24 H new ATOM 256 N ASP A 19 -46.433 5.705 -6.658 1.00 32.20 N ATOM 257 CA ASP A 19 -47.871 5.625 -6.433 1.00 41.34 C ATOM 258 C ASP A 19 -48.419 4.279 -6.898 1.00 44.41 C ATOM 259 O ASP A 19 -48.128 3.827 -8.006 1.00 5.35 O ATOM 260 CB ASP A 19 -48.588 6.761 -7.163 1.00 22.55 C ATOM 261 CG ASP A 19 -48.499 6.627 -8.671 1.00 73.34 C ATOM 262 OD1 ASP A 19 -47.426 6.225 -9.170 1.00 3.01 O ATOM 263 OD2 ASP A 19 -49.502 6.923 -9.353 1.00 24.34 O1- ATOM 0 H ASP A 19 -46.149 6.428 -7.320 1.00 32.20 H new ATOM 0 HA ASP A 19 -48.052 5.721 -5.362 1.00 41.34 H new ATOM 0 HB2 ASP A 19 -49.636 6.777 -6.864 1.00 22.55 H new ATOM 0 HB3 ASP A 19 -48.155 7.714 -6.860 1.00 22.55 H new ATOM 268 N THR A 20 -49.215 3.643 -6.043 1.00 61.12 N ATOM 269 CA THR A 20 -49.801 2.348 -6.365 1.00 12.12 C ATOM 270 C THR A 20 -51.048 2.509 -7.229 1.00 54.32 C ATOM 271 O THR A 20 -51.572 3.612 -7.382 1.00 54.42 O ATOM 272 CB THR A 20 -50.171 1.566 -5.091 1.00 40.23 C ATOM 273 OG1 THR A 20 -50.665 0.267 -5.438 1.00 70.42 O ATOM 274 CG2 THR A 20 -51.221 2.314 -4.283 1.00 72.02 C ATOM 0 H THR A 20 -49.468 4.004 -5.123 1.00 61.12 H new ATOM 0 HA THR A 20 -49.047 1.789 -6.919 1.00 12.12 H new ATOM 0 HB THR A 20 -49.273 1.461 -4.482 1.00 40.23 H new ATOM 0 HG1 THR A 20 -50.896 -0.224 -4.622 1.00 70.42 H new ATOM 0 HG21 THR A 20 -51.467 1.743 -3.388 1.00 72.02 H new ATOM 0 HG22 THR A 20 -50.831 3.290 -3.995 1.00 72.02 H new ATOM 0 HG23 THR A 20 -52.119 2.446 -4.887 1.00 72.02 H new ATOM 282 N LYS A 21 -51.520 1.401 -7.790 1.00 3.44 N ATOM 283 CA LYS A 21 -52.706 1.417 -8.638 1.00 22.44 C ATOM 284 C LYS A 21 -53.970 1.209 -7.808 1.00 14.33 C ATOM 285 O LYS A 21 -55.066 1.074 -8.353 1.00 74.45 O ATOM 286 CB LYS A 21 -52.605 0.334 -9.714 1.00 24.43 C ATOM 287 CG LYS A 21 -52.580 -1.078 -9.155 1.00 51.34 C ATOM 288 CD LYS A 21 -51.158 -1.591 -8.999 1.00 33.02 C ATOM 289 CE LYS A 21 -50.866 -1.996 -7.562 1.00 63.52 C ATOM 290 NZ LYS A 21 -49.465 -1.681 -7.172 1.00 64.01 N1+ ATOM 0 H LYS A 21 -51.099 0.480 -7.672 1.00 3.44 H new ATOM 0 HA LYS A 21 -52.765 2.393 -9.120 1.00 22.44 H new ATOM 0 HB2 LYS A 21 -53.450 0.431 -10.396 1.00 24.43 H new ATOM 0 HB3 LYS A 21 -51.701 0.500 -10.301 1.00 24.43 H new ATOM 0 HG2 LYS A 21 -53.083 -1.096 -8.188 1.00 51.34 H new ATOM 0 HG3 LYS A 21 -53.137 -1.742 -9.816 1.00 51.34 H new ATOM 0 HD2 LYS A 21 -51.004 -2.446 -9.657 1.00 33.02 H new ATOM 0 HD3 LYS A 21 -50.455 -0.818 -9.310 1.00 33.02 H new ATOM 0 HE2 LYS A 21 -51.554 -1.480 -6.892 1.00 63.52 H new ATOM 0 HE3 LYS A 21 -51.045 -3.064 -7.442 1.00 63.52 H new ATOM 0 HZ1 LYS A 21 -49.017 -2.530 -6.773 1.00 64.01 H new ATOM 0 HZ2 LYS A 21 -48.933 -1.370 -8.010 1.00 64.01 H new ATOM 0 HZ3 LYS A 21 -49.465 -0.922 -6.461 1.00 64.01 H new ATOM 304 N LEU A 22 -53.809 1.184 -6.490 1.00 11.11 N ATOM 305 CA LEU A 22 -54.936 0.994 -5.585 1.00 62.04 C ATOM 306 C LEU A 22 -55.369 2.319 -4.966 1.00 2.31 C ATOM 307 O LEU A 22 -56.342 2.378 -4.216 1.00 51.15 O ATOM 308 CB LEU A 22 -54.569 -0.001 -4.483 1.00 32.22 C ATOM 309 CG LEU A 22 -55.597 -1.097 -4.198 1.00 53.13 C ATOM 310 CD1 LEU A 22 -56.941 -0.486 -3.834 1.00 24.41 C ATOM 311 CD2 LEU A 22 -55.736 -2.022 -5.398 1.00 34.53 C ATOM 0 H LEU A 22 -52.908 1.293 -6.024 1.00 11.11 H new ATOM 0 HA LEU A 22 -55.770 0.596 -6.163 1.00 62.04 H new ATOM 0 HB2 LEU A 22 -53.625 -0.477 -4.750 1.00 32.22 H new ATOM 0 HB3 LEU A 22 -54.396 0.555 -3.562 1.00 32.22 H new ATOM 0 HG LEU A 22 -55.248 -1.686 -3.350 1.00 53.13 H new ATOM 0 HD11 LEU A 22 -57.660 -1.281 -3.635 1.00 24.41 H new ATOM 0 HD12 LEU A 22 -56.830 0.134 -2.945 1.00 24.41 H new ATOM 0 HD13 LEU A 22 -57.298 0.127 -4.662 1.00 24.41 H new ATOM 0 HD21 LEU A 22 -56.471 -2.796 -5.178 1.00 34.53 H new ATOM 0 HD22 LEU A 22 -56.063 -1.447 -6.265 1.00 34.53 H new ATOM 0 HD23 LEU A 22 -54.774 -2.487 -5.613 1.00 34.53 H new ATOM 323 N GLY A 23 -54.638 3.383 -5.289 1.00 52.15 N ATOM 324 CA GLY A 23 -54.962 4.694 -4.757 1.00 43.34 C ATOM 325 C GLY A 23 -54.204 5.007 -3.483 1.00 14.33 C ATOM 326 O GLY A 23 -54.738 4.916 -2.378 1.00 42.31 O ATOM 0 H GLY A 23 -53.828 3.360 -5.909 1.00 52.15 H new ATOM 0 HA2 GLY A 23 -54.736 5.453 -5.506 1.00 43.34 H new ATOM 0 HA3 GLY A 23 -56.033 4.749 -4.561 1.00 43.34 H new ATOM 330 N PRO A 24 -52.925 5.386 -3.629 1.00 42.45 N ATOM 331 CA PRO A 24 -52.063 5.720 -2.491 1.00 55.11 C ATOM 332 C PRO A 24 -52.475 7.024 -1.817 1.00 31.25 C ATOM 333 O PRO A 24 -53.309 7.765 -2.335 1.00 23.44 O ATOM 334 CB PRO A 24 -50.677 5.860 -3.125 1.00 4.11 C ATOM 335 CG PRO A 24 -50.945 6.218 -4.546 1.00 61.03 C ATOM 336 CD PRO A 24 -52.222 5.517 -4.917 1.00 45.53 C ATOM 0 HA PRO A 24 -52.113 4.966 -1.706 1.00 55.11 H new ATOM 0 HB2 PRO A 24 -50.090 6.631 -2.626 1.00 4.11 H new ATOM 0 HB3 PRO A 24 -50.112 4.931 -3.051 1.00 4.11 H new ATOM 0 HG2 PRO A 24 -51.044 7.297 -4.664 1.00 61.03 H new ATOM 0 HG3 PRO A 24 -50.125 5.901 -5.190 1.00 61.03 H new ATOM 0 HD2 PRO A 24 -52.804 6.095 -5.635 1.00 45.53 H new ATOM 0 HD3 PRO A 24 -52.030 4.545 -5.371 1.00 45.53 H new ATOM 344 N GLU A 25 -51.882 7.298 -0.658 1.00 30.43 N ATOM 345 CA GLU A 25 -52.189 8.513 0.087 1.00 61.13 C ATOM 346 C GLU A 25 -50.924 9.112 0.696 1.00 2.52 C ATOM 347 O GLU A 25 -50.726 10.326 0.670 1.00 75.32 O ATOM 348 CB GLU A 25 -53.209 8.219 1.189 1.00 32.13 C ATOM 349 CG GLU A 25 -52.891 6.971 1.995 1.00 54.54 C ATOM 350 CD GLU A 25 -53.950 6.663 3.036 1.00 55.02 C ATOM 351 OE1 GLU A 25 -55.124 6.481 2.651 1.00 54.21 O ATOM 352 OE2 GLU A 25 -53.605 6.604 4.234 1.00 12.11 O1- ATOM 0 H GLU A 25 -51.188 6.696 -0.216 1.00 30.43 H new ATOM 0 HA GLU A 25 -52.615 9.237 -0.608 1.00 61.13 H new ATOM 0 HB2 GLU A 25 -53.259 9.074 1.863 1.00 32.13 H new ATOM 0 HB3 GLU A 25 -54.196 8.109 0.739 1.00 32.13 H new ATOM 0 HG2 GLU A 25 -52.794 6.122 1.319 1.00 54.54 H new ATOM 0 HG3 GLU A 25 -51.928 7.098 2.489 1.00 54.54 H new ATOM 359 N GLU A 26 -50.073 8.250 1.243 1.00 43.40 N ATOM 360 CA GLU A 26 -48.828 8.694 1.859 1.00 42.11 C ATOM 361 C GLU A 26 -47.887 7.516 2.094 1.00 25.51 C ATOM 362 O GLU A 26 -48.323 6.368 2.185 1.00 40.12 O ATOM 363 CB GLU A 26 -49.114 9.403 3.185 1.00 74.23 C ATOM 364 CG GLU A 26 -49.586 8.468 4.286 1.00 70.14 C ATOM 365 CD GLU A 26 -50.517 9.150 5.271 1.00 31.34 C ATOM 366 OE1 GLU A 26 -50.106 10.164 5.872 1.00 24.24 O ATOM 367 OE2 GLU A 26 -51.655 8.667 5.440 1.00 61.41 O1- ATOM 0 H GLU A 26 -50.223 7.241 1.272 1.00 43.40 H new ATOM 0 HA GLU A 26 -48.344 9.393 1.177 1.00 42.11 H new ATOM 0 HB2 GLU A 26 -48.210 9.914 3.517 1.00 74.23 H new ATOM 0 HB3 GLU A 26 -49.871 10.170 3.021 1.00 74.23 H new ATOM 0 HG2 GLU A 26 -50.097 7.615 3.839 1.00 70.14 H new ATOM 0 HG3 GLU A 26 -48.721 8.076 4.821 1.00 70.14 H new ATOM 374 N ILE A 27 -46.594 7.808 2.188 1.00 34.23 N ATOM 375 CA ILE A 27 -45.591 6.774 2.411 1.00 51.54 C ATOM 376 C ILE A 27 -45.600 6.304 3.862 1.00 3.43 C ATOM 377 O ILE A 27 -45.850 7.087 4.779 1.00 75.14 O ATOM 378 CB ILE A 27 -44.178 7.274 2.054 1.00 31.11 C ATOM 379 CG1 ILE A 27 -43.219 6.092 1.902 1.00 64.55 C ATOM 380 CG2 ILE A 27 -43.674 8.240 3.116 1.00 22.12 C ATOM 381 CD1 ILE A 27 -41.806 6.502 1.551 1.00 33.44 C ATOM 0 H ILE A 27 -46.216 8.753 2.113 1.00 34.23 H new ATOM 0 HA ILE A 27 -45.848 5.939 1.759 1.00 51.54 H new ATOM 0 HB ILE A 27 -44.225 7.804 1.103 1.00 31.11 H new ATOM 0 HG12 ILE A 27 -43.204 5.525 2.833 1.00 64.55 H new ATOM 0 HG13 ILE A 27 -43.598 5.424 1.128 1.00 64.55 H new ATOM 0 HG21 ILE A 27 -42.675 8.584 2.850 1.00 22.12 H new ATOM 0 HG22 ILE A 27 -44.347 9.095 3.179 1.00 22.12 H new ATOM 0 HG23 ILE A 27 -43.638 7.734 4.081 1.00 22.12 H new ATOM 0 HD11 ILE A 27 -41.182 5.613 1.459 1.00 33.44 H new ATOM 0 HD12 ILE A 27 -41.809 7.043 0.605 1.00 33.44 H new ATOM 0 HD13 ILE A 27 -41.408 7.145 2.336 1.00 33.44 H new ATOM 393 N THR A 28 -45.324 5.019 4.063 1.00 23.51 N ATOM 394 CA THR A 28 -45.299 4.444 5.402 1.00 45.35 C ATOM 395 C THR A 28 -44.364 3.242 5.467 1.00 32.33 C ATOM 396 O THR A 28 -43.770 2.851 4.462 1.00 33.43 O ATOM 397 CB THR A 28 -46.707 4.010 5.853 1.00 53.03 C ATOM 398 OG1 THR A 28 -46.702 3.707 7.252 1.00 4.11 O ATOM 399 CG2 THR A 28 -47.175 2.794 5.067 1.00 21.31 C ATOM 0 H THR A 28 -45.115 4.357 3.316 1.00 23.51 H new ATOM 0 HA THR A 28 -44.934 5.221 6.073 1.00 45.35 H new ATOM 0 HB THR A 28 -47.396 4.833 5.663 1.00 53.03 H new ATOM 0 HG1 THR A 28 -47.601 3.434 7.531 1.00 4.11 H new ATOM 0 HG21 THR A 28 -48.171 2.505 5.402 1.00 21.31 H new ATOM 0 HG22 THR A 28 -47.206 3.037 4.005 1.00 21.31 H new ATOM 0 HG23 THR A 28 -46.484 1.967 5.230 1.00 21.31 H new ATOM 407 N ARG A 29 -44.237 2.660 6.655 1.00 14.42 N ATOM 408 CA ARG A 29 -43.372 1.503 6.850 1.00 74.04 C ATOM 409 C ARG A 29 -44.158 0.328 7.426 1.00 61.04 C ATOM 410 O ARG A 29 -44.761 0.435 8.494 1.00 23.41 O ATOM 411 CB ARG A 29 -42.211 1.857 7.780 1.00 13.44 C ATOM 412 CG ARG A 29 -42.610 2.761 8.936 1.00 21.03 C ATOM 413 CD ARG A 29 -42.484 4.230 8.565 1.00 15.43 C ATOM 414 NE ARG A 29 -43.422 5.065 9.310 1.00 11.32 N ATOM 415 CZ ARG A 29 -43.769 6.293 8.938 1.00 74.13 C ATOM 416 NH1 ARG A 29 -43.258 6.824 7.837 1.00 53.55 N1+ ATOM 417 NH2 ARG A 29 -44.629 6.990 9.669 1.00 74.03 N ATOM 0 H ARG A 29 -44.722 2.971 7.497 1.00 14.42 H new ATOM 0 HA ARG A 29 -42.974 1.211 5.878 1.00 74.04 H new ATOM 0 HB2 ARG A 29 -41.783 0.937 8.180 1.00 13.44 H new ATOM 0 HB3 ARG A 29 -41.429 2.347 7.200 1.00 13.44 H new ATOM 0 HG2 ARG A 29 -43.637 2.546 9.229 1.00 21.03 H new ATOM 0 HG3 ARG A 29 -41.980 2.548 9.800 1.00 21.03 H new ATOM 0 HD2 ARG A 29 -41.466 4.567 8.759 1.00 15.43 H new ATOM 0 HD3 ARG A 29 -42.661 4.350 7.496 1.00 15.43 H new ATOM 0 HE ARG A 29 -43.833 4.685 10.163 1.00 11.32 H new ATOM 0 HH11 ARG A 29 -42.597 6.290 7.273 1.00 53.55 H new ATOM 0 HH12 ARG A 29 -43.526 7.767 7.554 1.00 53.55 H new ATOM 0 HH21 ARG A 29 -45.024 6.584 10.517 1.00 74.03 H new ATOM 0 HH22 ARG A 29 -44.895 7.932 9.383 1.00 74.03 H new ATOM 431 N ASP A 30 -44.148 -0.791 6.710 1.00 64.35 N ATOM 432 CA ASP A 30 -44.860 -1.986 7.149 1.00 0.23 C ATOM 433 C ASP A 30 -44.135 -3.248 6.690 1.00 34.02 C ATOM 434 O ASP A 30 -44.484 -3.837 5.666 1.00 14.01 O ATOM 435 CB ASP A 30 -46.291 -1.980 6.612 1.00 31.35 C ATOM 436 CG ASP A 30 -47.031 -3.267 6.920 1.00 31.41 C ATOM 437 OD1 ASP A 30 -47.612 -3.368 8.021 1.00 64.23 O ATOM 438 OD2 ASP A 30 -47.030 -4.172 6.060 1.00 50.33 O1- ATOM 0 H ASP A 30 -43.655 -0.896 5.823 1.00 64.35 H new ATOM 0 HA ASP A 30 -44.891 -1.982 8.239 1.00 0.23 H new ATOM 0 HB2 ASP A 30 -46.834 -1.140 7.044 1.00 31.35 H new ATOM 0 HB3 ASP A 30 -46.270 -1.826 5.533 1.00 31.35 H new ATOM 443 N ILE A 31 -43.128 -3.657 7.455 1.00 63.23 N ATOM 444 CA ILE A 31 -42.357 -4.850 7.126 1.00 25.31 C ATOM 445 C ILE A 31 -42.520 -5.922 8.197 1.00 64.24 C ATOM 446 O ILE A 31 -41.677 -6.086 9.080 1.00 20.01 O ATOM 447 CB ILE A 31 -40.860 -4.524 6.964 1.00 73.13 C ATOM 448 CG1 ILE A 31 -40.672 -3.353 5.998 1.00 24.14 C ATOM 449 CG2 ILE A 31 -40.102 -5.749 6.475 1.00 43.12 C ATOM 450 CD1 ILE A 31 -40.692 -2.001 6.675 1.00 71.21 C ATOM 0 H ILE A 31 -42.827 -3.181 8.305 1.00 63.23 H new ATOM 0 HA ILE A 31 -42.744 -5.226 6.179 1.00 25.31 H new ATOM 0 HB ILE A 31 -40.458 -4.236 7.936 1.00 73.13 H new ATOM 0 HG12 ILE A 31 -39.724 -3.474 5.474 1.00 24.14 H new ATOM 0 HG13 ILE A 31 -41.459 -3.384 5.244 1.00 24.14 H new ATOM 0 HG21 ILE A 31 -39.046 -5.503 6.365 1.00 43.12 H new ATOM 0 HG22 ILE A 31 -40.213 -6.558 7.197 1.00 43.12 H new ATOM 0 HG23 ILE A 31 -40.503 -6.065 5.512 1.00 43.12 H new ATOM 0 HD11 ILE A 31 -40.553 -1.218 5.929 1.00 71.21 H new ATOM 0 HD12 ILE A 31 -41.650 -1.859 7.176 1.00 71.21 H new ATOM 0 HD13 ILE A 31 -39.888 -1.950 7.409 1.00 71.21 H new ATOM 462 N PRO A 32 -43.627 -6.673 8.119 1.00 34.15 N ATOM 463 CA PRO A 32 -43.926 -7.746 9.073 1.00 63.53 C ATOM 464 C PRO A 32 -42.989 -8.939 8.916 1.00 74.13 C ATOM 465 O PRO A 32 -42.396 -9.139 7.857 1.00 52.54 O ATOM 466 CB PRO A 32 -45.362 -8.145 8.720 1.00 61.33 C ATOM 467 CG PRO A 32 -45.521 -7.761 7.290 1.00 72.25 C ATOM 468 CD PRO A 32 -44.675 -6.534 7.093 1.00 11.40 C ATOM 0 HA PRO A 32 -43.801 -7.420 10.105 1.00 63.53 H new ATOM 0 HB2 PRO A 32 -45.523 -9.214 8.863 1.00 61.33 H new ATOM 0 HB3 PRO A 32 -46.084 -7.627 9.352 1.00 61.33 H new ATOM 0 HG2 PRO A 32 -45.198 -8.567 6.631 1.00 72.25 H new ATOM 0 HG3 PRO A 32 -46.566 -7.556 7.055 1.00 72.25 H new ATOM 0 HD2 PRO A 32 -44.252 -6.495 6.089 1.00 11.40 H new ATOM 0 HD3 PRO A 32 -45.254 -5.621 7.231 1.00 11.40 H new ATOM 476 N ASN A 33 -42.861 -9.728 9.978 1.00 71.22 N ATOM 477 CA ASN A 33 -41.995 -10.901 9.957 1.00 2.45 C ATOM 478 C ASN A 33 -40.537 -10.498 9.757 1.00 2.05 C ATOM 479 O ASN A 33 -39.712 -11.304 9.327 1.00 32.14 O ATOM 480 CB ASN A 33 -42.427 -11.861 8.846 1.00 52.30 C ATOM 481 CG ASN A 33 -43.934 -12.017 8.772 1.00 14.10 C ATOM 482 OD1 ASN A 33 -44.604 -12.172 9.792 1.00 31.13 O ATOM 483 ND2 ASN A 33 -44.473 -11.978 7.558 1.00 31.33 N ATOM 0 H ASN A 33 -43.345 -9.577 10.863 1.00 71.22 H new ATOM 0 HA ASN A 33 -42.086 -11.405 10.919 1.00 2.45 H new ATOM 0 HB2 ASN A 33 -42.055 -11.496 7.889 1.00 52.30 H new ATOM 0 HB3 ASN A 33 -41.971 -12.837 9.015 1.00 52.30 H new ATOM 0 HD21 ASN A 33 -45.482 -12.079 7.444 1.00 31.33 H new ATOM 0 HD22 ASN A 33 -43.878 -11.847 6.740 1.00 31.33 H new ATOM 490 N VAL A 34 -40.226 -9.246 10.074 1.00 34.42 N ATOM 491 CA VAL A 34 -38.868 -8.735 9.932 1.00 3.55 C ATOM 492 C VAL A 34 -38.058 -8.966 11.202 1.00 63.25 C ATOM 493 O VAL A 34 -38.610 -9.042 12.299 1.00 72.34 O ATOM 494 CB VAL A 34 -38.866 -7.231 9.602 1.00 61.54 C ATOM 495 CG1 VAL A 34 -39.361 -6.421 10.790 1.00 74.44 C ATOM 496 CG2 VAL A 34 -37.475 -6.779 9.182 1.00 63.24 C ATOM 0 H VAL A 34 -40.897 -8.566 10.431 1.00 34.42 H new ATOM 0 HA VAL A 34 -38.409 -9.281 9.108 1.00 3.55 H new ATOM 0 HB VAL A 34 -39.547 -7.061 8.768 1.00 61.54 H new ATOM 0 HG11 VAL A 34 -39.352 -5.361 10.537 1.00 74.44 H new ATOM 0 HG12 VAL A 34 -40.377 -6.726 11.040 1.00 74.44 H new ATOM 0 HG13 VAL A 34 -38.709 -6.595 11.646 1.00 74.44 H new ATOM 0 HG21 VAL A 34 -37.492 -5.714 8.953 1.00 63.24 H new ATOM 0 HG22 VAL A 34 -36.772 -6.964 9.994 1.00 63.24 H new ATOM 0 HG23 VAL A 34 -37.163 -7.335 8.298 1.00 63.24 H new ATOM 506 N GLY A 35 -36.742 -9.078 11.047 1.00 71.54 N ATOM 507 CA GLY A 35 -35.876 -9.300 12.190 1.00 61.21 C ATOM 508 C GLY A 35 -35.691 -8.050 13.028 1.00 63.23 C ATOM 509 O GLY A 35 -35.539 -6.953 12.492 1.00 50.52 O ATOM 0 H GLY A 35 -36.260 -9.019 10.150 1.00 71.54 H new ATOM 0 HA2 GLY A 35 -36.295 -10.092 12.811 1.00 61.21 H new ATOM 0 HA3 GLY A 35 -34.903 -9.648 11.843 1.00 61.21 H new ATOM 513 N GLU A 36 -35.705 -8.216 14.347 1.00 25.34 N ATOM 514 CA GLU A 36 -35.541 -7.091 15.260 1.00 23.30 C ATOM 515 C GLU A 36 -34.254 -6.329 14.956 1.00 75.14 C ATOM 516 O GLU A 36 -34.181 -5.114 15.146 1.00 34.31 O ATOM 517 CB GLU A 36 -35.527 -7.580 16.709 1.00 11.14 C ATOM 518 CG GLU A 36 -34.400 -8.554 17.013 1.00 41.24 C ATOM 519 CD GLU A 36 -34.301 -8.891 18.488 1.00 1.32 C ATOM 520 OE1 GLU A 36 -34.275 -7.953 19.312 1.00 11.12 O ATOM 521 OE2 GLU A 36 -34.251 -10.095 18.818 1.00 24.50 O1- ATOM 0 H GLU A 36 -35.828 -9.118 14.807 1.00 25.34 H new ATOM 0 HA GLU A 36 -36.385 -6.416 15.121 1.00 23.30 H new ATOM 0 HB2 GLU A 36 -35.441 -6.720 17.373 1.00 11.14 H new ATOM 0 HB3 GLU A 36 -36.480 -8.060 16.931 1.00 11.14 H new ATOM 0 HG2 GLU A 36 -34.554 -9.471 16.444 1.00 41.24 H new ATOM 0 HG3 GLU A 36 -33.455 -8.126 16.678 1.00 41.24 H new ATOM 528 N ASP A 37 -33.243 -7.050 14.485 1.00 22.02 N ATOM 529 CA ASP A 37 -31.959 -6.442 14.155 1.00 32.15 C ATOM 530 C ASP A 37 -32.085 -5.536 12.933 1.00 14.55 C ATOM 531 O ASP A 37 -31.408 -4.513 12.835 1.00 61.42 O ATOM 532 CB ASP A 37 -30.910 -7.524 13.896 1.00 75.52 C ATOM 533 CG ASP A 37 -30.225 -7.982 15.169 1.00 61.23 C ATOM 534 OD1 ASP A 37 -30.693 -7.603 16.262 1.00 2.44 O ATOM 535 OD2 ASP A 37 -29.221 -8.719 15.071 1.00 44.23 O1- ATOM 0 H ASP A 37 -33.287 -8.056 14.323 1.00 22.02 H new ATOM 0 HA ASP A 37 -31.643 -5.836 15.004 1.00 32.15 H new ATOM 0 HB2 ASP A 37 -31.385 -8.379 13.415 1.00 75.52 H new ATOM 0 HB3 ASP A 37 -30.162 -7.142 13.201 1.00 75.52 H new ATOM 540 N ALA A 38 -32.955 -5.920 12.005 1.00 41.12 N ATOM 541 CA ALA A 38 -33.170 -5.143 10.791 1.00 33.22 C ATOM 542 C ALA A 38 -33.843 -3.811 11.104 1.00 61.11 C ATOM 543 O ALA A 38 -33.762 -2.863 10.320 1.00 73.30 O ATOM 544 CB ALA A 38 -34.006 -5.937 9.797 1.00 54.45 C ATOM 0 H ALA A 38 -33.523 -6.765 12.071 1.00 41.12 H new ATOM 0 HA ALA A 38 -32.197 -4.934 10.346 1.00 33.22 H new ATOM 0 HB1 ALA A 38 -34.159 -5.344 8.895 1.00 54.45 H new ATOM 0 HB2 ALA A 38 -33.487 -6.861 9.541 1.00 54.45 H new ATOM 0 HB3 ALA A 38 -34.972 -6.175 10.242 1.00 54.45 H new ATOM 550 N LEU A 39 -34.505 -3.743 12.253 1.00 44.35 N ATOM 551 CA LEU A 39 -35.192 -2.526 12.671 1.00 51.12 C ATOM 552 C LEU A 39 -34.615 -1.996 13.979 1.00 25.44 C ATOM 553 O LEU A 39 -35.221 -1.152 14.639 1.00 75.32 O ATOM 554 CB LEU A 39 -36.690 -2.792 12.832 1.00 75.42 C ATOM 555 CG LEU A 39 -37.072 -3.922 13.790 1.00 63.45 C ATOM 556 CD1 LEU A 39 -37.121 -3.412 15.222 1.00 3.12 C ATOM 557 CD2 LEU A 39 -38.409 -4.528 13.392 1.00 33.13 C ATOM 0 H LEU A 39 -34.581 -4.517 12.913 1.00 44.35 H new ATOM 0 HA LEU A 39 -35.044 -1.772 11.898 1.00 51.12 H new ATOM 0 HB2 LEU A 39 -37.167 -1.874 13.176 1.00 75.42 H new ATOM 0 HB3 LEU A 39 -37.106 -3.019 11.850 1.00 75.42 H new ATOM 0 HG LEU A 39 -36.311 -4.699 13.728 1.00 63.45 H new ATOM 0 HD11 LEU A 39 -37.394 -4.229 15.890 1.00 3.12 H new ATOM 0 HD12 LEU A 39 -36.142 -3.025 15.504 1.00 3.12 H new ATOM 0 HD13 LEU A 39 -37.862 -2.616 15.300 1.00 3.12 H new ATOM 0 HD21 LEU A 39 -38.665 -5.330 14.084 1.00 33.13 H new ATOM 0 HD22 LEU A 39 -39.181 -3.759 13.425 1.00 33.13 H new ATOM 0 HD23 LEU A 39 -38.340 -4.929 12.381 1.00 33.13 H new ATOM 569 N ARG A 40 -33.440 -2.494 14.347 1.00 20.52 N ATOM 570 CA ARG A 40 -32.779 -2.070 15.575 1.00 43.52 C ATOM 571 C ARG A 40 -32.271 -0.637 15.452 1.00 33.33 C ATOM 572 O ARG A 40 -32.189 0.091 16.441 1.00 61.33 O ATOM 573 CB ARG A 40 -31.616 -3.008 15.905 1.00 31.43 C ATOM 574 CG ARG A 40 -30.390 -2.788 15.034 1.00 41.24 C ATOM 575 CD ARG A 40 -29.430 -3.964 15.118 1.00 43.45 C ATOM 576 NE ARG A 40 -28.046 -3.557 14.883 1.00 63.04 N ATOM 577 CZ ARG A 40 -27.036 -4.414 14.778 1.00 32.22 C ATOM 578 NH1 ARG A 40 -27.255 -5.717 14.888 1.00 22.50 N1+ ATOM 579 NH2 ARG A 40 -25.806 -3.967 14.565 1.00 20.05 N ATOM 0 H ARG A 40 -32.925 -3.193 13.811 1.00 20.52 H new ATOM 0 HA ARG A 40 -33.510 -2.111 16.383 1.00 43.52 H new ATOM 0 HB2 ARG A 40 -31.337 -2.874 16.950 1.00 31.43 H new ATOM 0 HB3 ARG A 40 -31.950 -4.040 15.794 1.00 31.43 H new ATOM 0 HG2 ARG A 40 -30.699 -2.642 13.999 1.00 41.24 H new ATOM 0 HG3 ARG A 40 -29.879 -1.877 15.346 1.00 41.24 H new ATOM 0 HD2 ARG A 40 -29.510 -4.428 16.101 1.00 43.45 H new ATOM 0 HD3 ARG A 40 -29.716 -4.719 14.385 1.00 43.45 H new ATOM 0 HE ARG A 40 -27.845 -2.561 14.795 1.00 63.04 H new ATOM 0 HH11 ARG A 40 -28.200 -6.063 15.053 1.00 22.50 H new ATOM 0 HH12 ARG A 40 -26.478 -6.373 14.807 1.00 22.50 H new ATOM 0 HH21 ARG A 40 -25.635 -2.965 14.482 1.00 20.05 H new ATOM 0 HH22 ARG A 40 -25.031 -4.625 14.484 1.00 20.05 H new ATOM 593 N ASN A 41 -31.931 -0.237 14.230 1.00 55.32 N ATOM 594 CA ASN A 41 -31.431 1.109 13.978 1.00 71.13 C ATOM 595 C ASN A 41 -32.492 1.965 13.294 1.00 35.30 C ATOM 596 O ASN A 41 -32.464 3.194 13.380 1.00 31.23 O ATOM 597 CB ASN A 41 -30.169 1.052 13.114 1.00 34.41 C ATOM 598 CG ASN A 41 -29.102 0.152 13.705 1.00 10.32 C ATOM 599 OD1 ASN A 41 -28.711 0.311 14.862 1.00 32.53 O ATOM 600 ND2 ASN A 41 -28.628 -0.802 12.912 1.00 61.32 N ATOM 0 H ASN A 41 -31.993 -0.826 13.400 1.00 55.32 H new ATOM 0 HA ASN A 41 -31.187 1.565 14.937 1.00 71.13 H new ATOM 0 HB2 ASN A 41 -30.430 0.695 12.118 1.00 34.41 H new ATOM 0 HB3 ASN A 41 -29.767 2.058 12.997 1.00 34.41 H new ATOM 0 HD21 ASN A 41 -27.910 -1.440 13.255 1.00 61.32 H new ATOM 0 HD22 ASN A 41 -28.982 -0.896 11.960 1.00 61.32 H new ATOM 607 N LEU A 42 -33.426 1.308 12.615 1.00 5.31 N ATOM 608 CA LEU A 42 -34.498 2.009 11.916 1.00 1.45 C ATOM 609 C LEU A 42 -35.204 2.990 12.846 1.00 41.30 C ATOM 610 O LEU A 42 -35.440 2.693 14.017 1.00 64.12 O ATOM 611 CB LEU A 42 -35.507 1.005 11.354 1.00 35.41 C ATOM 612 CG LEU A 42 -36.201 1.410 10.052 1.00 32.44 C ATOM 613 CD1 LEU A 42 -35.436 0.877 8.852 1.00 21.05 C ATOM 614 CD2 LEU A 42 -37.638 0.910 10.037 1.00 43.22 C ATOM 0 H LEU A 42 -33.463 0.292 12.534 1.00 5.31 H new ATOM 0 HA LEU A 42 -34.056 2.571 11.093 1.00 1.45 H new ATOM 0 HB2 LEU A 42 -34.994 0.057 11.190 1.00 35.41 H new ATOM 0 HB3 LEU A 42 -36.272 0.826 12.110 1.00 35.41 H new ATOM 0 HG LEU A 42 -36.216 2.498 9.993 1.00 32.44 H new ATOM 0 HD11 LEU A 42 -35.944 1.175 7.935 1.00 21.05 H new ATOM 0 HD12 LEU A 42 -34.425 1.284 8.855 1.00 21.05 H new ATOM 0 HD13 LEU A 42 -35.389 -0.211 8.904 1.00 21.05 H new ATOM 0 HD21 LEU A 42 -38.117 1.207 9.104 1.00 43.22 H new ATOM 0 HD22 LEU A 42 -37.646 -0.177 10.119 1.00 43.22 H new ATOM 0 HD23 LEU A 42 -38.182 1.341 10.877 1.00 43.22 H new ATOM 626 N ASP A 43 -35.540 4.161 12.316 1.00 10.14 N ATOM 627 CA ASP A 43 -36.222 5.187 13.097 1.00 31.33 C ATOM 628 C ASP A 43 -37.708 5.233 12.753 1.00 31.33 C ATOM 629 O ASP A 43 -38.207 4.399 11.998 1.00 2.34 O ATOM 630 CB ASP A 43 -35.585 6.555 12.849 1.00 44.20 C ATOM 631 CG ASP A 43 -35.617 6.952 11.386 1.00 54.04 C ATOM 632 OD1 ASP A 43 -36.229 6.215 10.586 1.00 1.31 O ATOM 633 OD2 ASP A 43 -35.029 7.999 11.043 1.00 30.34 O1- ATOM 0 H ASP A 43 -35.351 4.424 11.349 1.00 10.14 H new ATOM 0 HA ASP A 43 -36.119 4.934 14.152 1.00 31.33 H new ATOM 0 HB2 ASP A 43 -36.108 7.308 13.438 1.00 44.20 H new ATOM 0 HB3 ASP A 43 -34.552 6.540 13.196 1.00 44.20 H new ATOM 638 N ASP A 44 -38.410 6.213 13.312 1.00 73.33 N ATOM 639 CA ASP A 44 -39.837 6.368 13.065 1.00 11.43 C ATOM 640 C ASP A 44 -40.104 6.679 11.595 1.00 44.41 C ATOM 641 O ASP A 44 -41.218 6.495 11.103 1.00 0.12 O ATOM 642 CB ASP A 44 -40.412 7.480 13.945 1.00 63.23 C ATOM 643 CG ASP A 44 -40.328 7.149 15.422 1.00 31.34 C ATOM 644 OD1 ASP A 44 -40.188 5.954 15.756 1.00 40.13 O ATOM 645 OD2 ASP A 44 -40.401 8.086 16.245 1.00 13.32 O1- ATOM 0 H ASP A 44 -38.013 6.912 13.940 1.00 73.33 H new ATOM 0 HA ASP A 44 -40.327 5.427 13.315 1.00 11.43 H new ATOM 0 HB2 ASP A 44 -39.873 8.408 13.752 1.00 63.23 H new ATOM 0 HB3 ASP A 44 -41.453 7.653 13.673 1.00 63.23 H new ATOM 650 N ARG A 45 -39.075 7.151 10.899 1.00 71.11 N ATOM 651 CA ARG A 45 -39.199 7.489 9.486 1.00 52.13 C ATOM 652 C ARG A 45 -39.194 6.230 8.624 1.00 35.45 C ATOM 653 O ARG A 45 -39.676 6.239 7.492 1.00 3.22 O ATOM 654 CB ARG A 45 -38.058 8.416 9.061 1.00 65.04 C ATOM 655 CG ARG A 45 -37.826 9.574 10.015 1.00 43.34 C ATOM 656 CD ARG A 45 -36.811 10.561 9.459 1.00 43.42 C ATOM 657 NE ARG A 45 -36.903 11.865 10.110 1.00 64.23 N ATOM 658 CZ ARG A 45 -35.973 12.808 9.999 1.00 23.12 C ATOM 659 NH1 ARG A 45 -34.890 12.593 9.266 1.00 63.01 N1+ ATOM 660 NH2 ARG A 45 -36.128 13.970 10.622 1.00 3.01 N ATOM 0 H ARG A 45 -38.146 7.308 11.290 1.00 71.11 H new ATOM 0 HA ARG A 45 -40.149 8.003 9.342 1.00 52.13 H new ATOM 0 HB2 ARG A 45 -37.140 7.834 8.980 1.00 65.04 H new ATOM 0 HB3 ARG A 45 -38.274 8.812 8.069 1.00 65.04 H new ATOM 0 HG2 ARG A 45 -38.769 10.087 10.202 1.00 43.34 H new ATOM 0 HG3 ARG A 45 -37.476 9.192 10.974 1.00 43.34 H new ATOM 0 HD2 ARG A 45 -35.806 10.160 9.590 1.00 43.42 H new ATOM 0 HD3 ARG A 45 -36.969 10.679 8.387 1.00 43.42 H new ATOM 0 HE ARG A 45 -37.725 12.063 10.680 1.00 64.23 H new ATOM 0 HH11 ARG A 45 -34.768 11.702 8.785 1.00 63.01 H new ATOM 0 HH12 ARG A 45 -34.178 13.319 9.183 1.00 63.01 H new ATOM 0 HH21 ARG A 45 -36.961 14.139 11.186 1.00 3.01 H new ATOM 0 HH22 ARG A 45 -35.414 14.694 10.537 1.00 3.01 H new ATOM 674 N GLY A 46 -38.644 5.148 9.167 1.00 63.25 N ATOM 675 CA GLY A 46 -38.587 3.897 8.434 1.00 13.20 C ATOM 676 C GLY A 46 -37.262 3.702 7.724 1.00 41.41 C ATOM 677 O GLY A 46 -37.105 2.774 6.931 1.00 11.40 O ATOM 0 H GLY A 46 -38.237 5.116 10.102 1.00 63.25 H new ATOM 0 HA2 GLY A 46 -38.753 3.068 9.122 1.00 13.20 H new ATOM 0 HA3 GLY A 46 -39.395 3.870 7.703 1.00 13.20 H new ATOM 681 N VAL A 47 -36.305 4.580 8.007 1.00 30.53 N ATOM 682 CA VAL A 47 -34.987 4.501 7.388 1.00 42.32 C ATOM 683 C VAL A 47 -33.902 4.279 8.436 1.00 35.22 C ATOM 684 O VAL A 47 -33.944 4.861 9.520 1.00 74.45 O ATOM 685 CB VAL A 47 -34.663 5.778 6.592 1.00 33.24 C ATOM 686 CG1 VAL A 47 -34.501 6.966 7.529 1.00 62.32 C ATOM 687 CG2 VAL A 47 -33.411 5.578 5.751 1.00 11.24 C ATOM 0 H VAL A 47 -36.418 5.354 8.661 1.00 30.53 H new ATOM 0 HA VAL A 47 -35.008 3.652 6.704 1.00 42.32 H new ATOM 0 HB VAL A 47 -35.496 5.987 5.920 1.00 33.24 H new ATOM 0 HG11 VAL A 47 -34.272 7.859 6.948 1.00 62.32 H new ATOM 0 HG12 VAL A 47 -35.427 7.121 8.083 1.00 62.32 H new ATOM 0 HG13 VAL A 47 -33.688 6.770 8.228 1.00 62.32 H new ATOM 0 HG21 VAL A 47 -33.197 6.491 5.195 1.00 11.24 H new ATOM 0 HG22 VAL A 47 -32.569 5.344 6.402 1.00 11.24 H new ATOM 0 HG23 VAL A 47 -33.569 4.756 5.053 1.00 11.24 H new ATOM 697 N ILE A 48 -32.932 3.433 8.104 1.00 4.11 N ATOM 698 CA ILE A 48 -31.834 3.136 9.016 1.00 23.31 C ATOM 699 C ILE A 48 -30.936 4.353 9.211 1.00 42.35 C ATOM 700 O ILE A 48 -30.621 5.064 8.256 1.00 21.41 O ATOM 701 CB ILE A 48 -30.981 1.960 8.505 1.00 74.51 C ATOM 702 CG1 ILE A 48 -31.845 0.707 8.347 1.00 2.21 C ATOM 703 CG2 ILE A 48 -29.822 1.695 9.454 1.00 61.43 C ATOM 704 CD1 ILE A 48 -32.371 0.165 9.659 1.00 11.41 C ATOM 0 H ILE A 48 -32.884 2.942 7.211 1.00 4.11 H new ATOM 0 HA ILE A 48 -32.283 2.862 9.971 1.00 23.31 H new ATOM 0 HB ILE A 48 -30.573 2.223 7.529 1.00 74.51 H new ATOM 0 HG12 ILE A 48 -32.687 0.936 7.694 1.00 2.21 H new ATOM 0 HG13 ILE A 48 -31.260 -0.068 7.852 1.00 2.21 H new ATOM 0 HG21 ILE A 48 -29.228 0.861 9.079 1.00 61.43 H new ATOM 0 HG22 ILE A 48 -29.196 2.585 9.521 1.00 61.43 H new ATOM 0 HG23 ILE A 48 -30.210 1.449 10.442 1.00 61.43 H new ATOM 0 HD11 ILE A 48 -32.975 -0.723 9.470 1.00 11.41 H new ATOM 0 HD12 ILE A 48 -31.534 -0.096 10.306 1.00 11.41 H new ATOM 0 HD13 ILE A 48 -32.984 0.923 10.146 1.00 11.41 H new ATOM 716 N ARG A 49 -30.527 4.586 10.453 1.00 61.21 N ATOM 717 CA ARG A 49 -29.665 5.717 10.774 1.00 55.21 C ATOM 718 C ARG A 49 -28.250 5.490 10.247 1.00 4.43 C ATOM 719 O ARG A 49 -27.874 4.364 9.918 1.00 74.42 O ATOM 720 CB ARG A 49 -29.625 5.944 12.287 1.00 75.12 C ATOM 721 CG ARG A 49 -29.032 7.285 12.686 1.00 63.14 C ATOM 722 CD ARG A 49 -29.322 7.610 14.143 1.00 21.00 C ATOM 723 NE ARG A 49 -28.397 8.606 14.677 1.00 40.53 N ATOM 724 CZ ARG A 49 -28.391 8.999 15.945 1.00 35.01 C ATOM 725 NH1 ARG A 49 -29.255 8.482 16.807 1.00 2.42 N1+ ATOM 726 NH2 ARG A 49 -27.517 9.910 16.355 1.00 44.41 N ATOM 0 H ARG A 49 -30.779 4.007 11.254 1.00 61.21 H new ATOM 0 HA ARG A 49 -30.078 6.603 10.291 1.00 55.21 H new ATOM 0 HB2 ARG A 49 -30.638 5.872 12.684 1.00 75.12 H new ATOM 0 HB3 ARG A 49 -29.044 5.147 12.750 1.00 75.12 H new ATOM 0 HG2 ARG A 49 -27.954 7.271 12.523 1.00 63.14 H new ATOM 0 HG3 ARG A 49 -29.441 8.069 12.049 1.00 63.14 H new ATOM 0 HD2 ARG A 49 -30.344 7.978 14.236 1.00 21.00 H new ATOM 0 HD3 ARG A 49 -29.256 6.699 14.738 1.00 21.00 H new ATOM 0 HE ARG A 49 -27.718 9.023 14.040 1.00 40.53 H new ATOM 0 HH11 ARG A 49 -29.927 7.780 16.497 1.00 2.42 H new ATOM 0 HH12 ARG A 49 -29.248 8.786 17.781 1.00 2.42 H new ATOM 0 HH21 ARG A 49 -26.849 10.309 15.696 1.00 44.41 H new ATOM 0 HH22 ARG A 49 -27.513 10.211 17.330 1.00 44.41 H new ATOM 740 N ILE A 50 -27.473 6.564 10.170 1.00 42.34 N ATOM 741 CA ILE A 50 -26.102 6.481 9.683 1.00 64.41 C ATOM 742 C ILE A 50 -25.206 5.759 10.684 1.00 25.51 C ATOM 743 O ILE A 50 -25.470 5.764 11.885 1.00 50.31 O ATOM 744 CB ILE A 50 -25.517 7.878 9.403 1.00 4.21 C ATOM 745 CG1 ILE A 50 -26.519 8.726 8.618 1.00 31.11 C ATOM 746 CG2 ILE A 50 -24.205 7.761 8.645 1.00 54.25 C ATOM 747 CD1 ILE A 50 -26.950 8.096 7.311 1.00 54.33 C ATOM 0 H ILE A 50 -27.769 7.502 10.439 1.00 42.34 H new ATOM 0 HA ILE A 50 -26.133 5.916 8.751 1.00 64.41 H new ATOM 0 HB ILE A 50 -25.320 8.371 10.355 1.00 4.21 H new ATOM 0 HG12 ILE A 50 -27.400 8.899 9.237 1.00 31.11 H new ATOM 0 HG13 ILE A 50 -26.076 9.701 8.414 1.00 31.11 H new ATOM 0 HG21 ILE A 50 -23.805 8.757 8.455 1.00 54.25 H new ATOM 0 HG22 ILE A 50 -23.491 7.190 9.239 1.00 54.25 H new ATOM 0 HG23 ILE A 50 -24.377 7.252 7.697 1.00 54.25 H new ATOM 0 HD11 ILE A 50 -27.660 8.752 6.808 1.00 54.33 H new ATOM 0 HD12 ILE A 50 -26.078 7.948 6.674 1.00 54.33 H new ATOM 0 HD13 ILE A 50 -27.422 7.134 7.509 1.00 54.33 H new ATOM 759 N GLY A 51 -24.144 5.138 10.179 1.00 2.14 N ATOM 760 CA GLY A 51 -23.225 4.421 11.043 1.00 43.44 C ATOM 761 C GLY A 51 -23.685 3.006 11.334 1.00 53.24 C ATOM 762 O GLY A 51 -23.143 2.339 12.215 1.00 63.33 O ATOM 0 H GLY A 51 -23.904 5.119 9.188 1.00 2.14 H new ATOM 0 HA2 GLY A 51 -22.241 4.391 10.575 1.00 43.44 H new ATOM 0 HA3 GLY A 51 -23.115 4.964 11.982 1.00 43.44 H new ATOM 766 N ALA A 52 -24.688 2.549 10.593 1.00 53.13 N ATOM 767 CA ALA A 52 -25.222 1.205 10.776 1.00 25.41 C ATOM 768 C ALA A 52 -24.746 0.270 9.670 1.00 3.24 C ATOM 769 O ALA A 52 -24.813 0.608 8.488 1.00 33.21 O ATOM 770 CB ALA A 52 -26.742 1.242 10.821 1.00 4.44 C ATOM 0 H ALA A 52 -25.148 3.089 9.860 1.00 53.13 H new ATOM 0 HA ALA A 52 -24.851 0.820 11.726 1.00 25.41 H new ATOM 0 HB1 ALA A 52 -27.127 0.231 10.958 1.00 4.44 H new ATOM 0 HB2 ALA A 52 -27.066 1.869 11.651 1.00 4.44 H new ATOM 0 HB3 ALA A 52 -27.124 1.652 9.886 1.00 4.44 H new ATOM 776 N GLU A 53 -24.265 -0.906 10.061 1.00 24.44 N ATOM 777 CA GLU A 53 -23.776 -1.888 9.100 1.00 12.23 C ATOM 778 C GLU A 53 -24.930 -2.493 8.305 1.00 61.23 C ATOM 779 O GLU A 53 -25.989 -2.791 8.857 1.00 62.55 O ATOM 780 CB GLU A 53 -23.001 -2.995 9.818 1.00 5.05 C ATOM 781 CG GLU A 53 -22.569 -4.127 8.903 1.00 63.31 C ATOM 782 CD GLU A 53 -23.596 -5.240 8.825 1.00 65.35 C ATOM 783 OE1 GLU A 53 -24.691 -5.078 9.401 1.00 22.21 O ATOM 784 OE2 GLU A 53 -23.304 -6.273 8.186 1.00 42.20 O1- ATOM 0 H GLU A 53 -24.204 -1.202 11.035 1.00 24.44 H new ATOM 0 HA GLU A 53 -23.108 -1.378 8.406 1.00 12.23 H new ATOM 0 HB2 GLU A 53 -22.118 -2.562 10.288 1.00 5.05 H new ATOM 0 HB3 GLU A 53 -23.621 -3.401 10.617 1.00 5.05 H new ATOM 0 HG2 GLU A 53 -22.390 -3.732 7.903 1.00 63.31 H new ATOM 0 HG3 GLU A 53 -21.623 -4.535 9.258 1.00 63.31 H new ATOM 791 N VAL A 54 -24.716 -2.670 7.006 1.00 22.21 N ATOM 792 CA VAL A 54 -25.738 -3.240 6.134 1.00 62.55 C ATOM 793 C VAL A 54 -25.593 -4.754 6.035 1.00 25.30 C ATOM 794 O VAL A 54 -24.482 -5.286 6.051 1.00 72.42 O ATOM 795 CB VAL A 54 -25.668 -2.635 4.720 1.00 34.21 C ATOM 796 CG1 VAL A 54 -24.272 -2.793 4.138 1.00 11.11 C ATOM 797 CG2 VAL A 54 -26.709 -3.278 3.814 1.00 22.21 C ATOM 0 H VAL A 54 -23.845 -2.428 6.533 1.00 22.21 H new ATOM 0 HA VAL A 54 -26.704 -2.999 6.577 1.00 62.55 H new ATOM 0 HB VAL A 54 -25.887 -1.569 4.789 1.00 34.21 H new ATOM 0 HG11 VAL A 54 -24.243 -2.359 3.138 1.00 11.11 H new ATOM 0 HG12 VAL A 54 -23.552 -2.282 4.776 1.00 11.11 H new ATOM 0 HG13 VAL A 54 -24.019 -3.852 4.081 1.00 11.11 H new ATOM 0 HG21 VAL A 54 -26.646 -2.839 2.818 1.00 22.21 H new ATOM 0 HG22 VAL A 54 -26.523 -4.350 3.750 1.00 22.21 H new ATOM 0 HG23 VAL A 54 -27.704 -3.106 4.224 1.00 22.21 H new ATOM 807 N LYS A 55 -26.723 -5.446 5.932 1.00 32.13 N ATOM 808 CA LYS A 55 -26.724 -6.900 5.827 1.00 11.44 C ATOM 809 C LYS A 55 -28.009 -7.398 5.173 1.00 24.20 C ATOM 810 O LYS A 55 -28.931 -6.621 4.924 1.00 53.12 O ATOM 811 CB LYS A 55 -26.566 -7.531 7.213 1.00 13.34 C ATOM 812 CG LYS A 55 -27.712 -7.215 8.158 1.00 34.42 C ATOM 813 CD LYS A 55 -27.789 -8.219 9.297 1.00 72.33 C ATOM 814 CE LYS A 55 -26.736 -7.940 10.358 1.00 54.12 C ATOM 815 NZ LYS A 55 -27.249 -7.038 11.426 1.00 75.44 N1+ ATOM 0 H LYS A 55 -27.651 -5.022 5.919 1.00 32.13 H new ATOM 0 HA LYS A 55 -25.882 -7.195 5.201 1.00 11.44 H new ATOM 0 HB2 LYS A 55 -26.484 -8.612 7.104 1.00 13.34 H new ATOM 0 HB3 LYS A 55 -25.633 -7.184 7.657 1.00 13.34 H new ATOM 0 HG2 LYS A 55 -27.584 -6.212 8.564 1.00 34.42 H new ATOM 0 HG3 LYS A 55 -28.652 -7.217 7.606 1.00 34.42 H new ATOM 0 HD2 LYS A 55 -28.780 -8.183 9.749 1.00 72.33 H new ATOM 0 HD3 LYS A 55 -27.654 -9.227 8.905 1.00 72.33 H new ATOM 0 HE2 LYS A 55 -26.411 -8.881 10.803 1.00 54.12 H new ATOM 0 HE3 LYS A 55 -25.861 -7.488 9.891 1.00 54.12 H new ATOM 0 HZ1 LYS A 55 -26.501 -6.873 12.130 1.00 75.44 H new ATOM 0 HZ2 LYS A 55 -27.536 -6.131 11.006 1.00 75.44 H new ATOM 0 HZ3 LYS A 55 -28.069 -7.480 11.889 1.00 75.44 H new ATOM 829 N ASP A 56 -28.062 -8.696 4.898 1.00 1.11 N ATOM 830 CA ASP A 56 -29.236 -9.297 4.274 1.00 50.12 C ATOM 831 C ASP A 56 -30.489 -9.025 5.100 1.00 51.21 C ATOM 832 O ASP A 56 -30.446 -9.019 6.329 1.00 22.43 O ATOM 833 CB ASP A 56 -29.036 -10.805 4.111 1.00 24.03 C ATOM 834 CG ASP A 56 -29.666 -11.337 2.839 1.00 74.11 C ATOM 835 OD1 ASP A 56 -30.415 -10.582 2.185 1.00 70.55 O ATOM 836 OD2 ASP A 56 -29.409 -12.511 2.496 1.00 42.54 O1- ATOM 0 H ASP A 56 -27.307 -9.352 5.097 1.00 1.11 H new ATOM 0 HA ASP A 56 -29.366 -8.846 3.290 1.00 50.12 H new ATOM 0 HB2 ASP A 56 -27.969 -11.029 4.106 1.00 24.03 H new ATOM 0 HB3 ASP A 56 -29.466 -11.321 4.970 1.00 24.03 H new ATOM 841 N GLY A 57 -31.606 -8.798 4.414 1.00 23.23 N ATOM 842 CA GLY A 57 -32.855 -8.526 5.100 1.00 2.42 C ATOM 843 C GLY A 57 -32.966 -7.083 5.552 1.00 30.44 C ATOM 844 O GLY A 57 -33.939 -6.704 6.204 1.00 50.43 O ATOM 0 H GLY A 57 -31.667 -8.798 3.396 1.00 23.23 H new ATOM 0 HA2 GLY A 57 -33.688 -8.761 4.438 1.00 2.42 H new ATOM 0 HA3 GLY A 57 -32.941 -9.182 5.966 1.00 2.42 H new ATOM 848 N ASP A 58 -31.967 -6.278 5.208 1.00 1.23 N ATOM 849 CA ASP A 58 -31.957 -4.870 5.584 1.00 24.33 C ATOM 850 C ASP A 58 -32.228 -3.982 4.373 1.00 44.22 C ATOM 851 O ASP A 58 -31.315 -3.641 3.621 1.00 4.32 O ATOM 852 CB ASP A 58 -30.612 -4.497 6.212 1.00 74.23 C ATOM 853 CG ASP A 58 -30.770 -3.613 7.434 1.00 42.34 C ATOM 854 OD1 ASP A 58 -31.794 -2.904 7.525 1.00 52.45 O ATOM 855 OD2 ASP A 58 -29.868 -3.626 8.297 1.00 60.24 O1- ATOM 0 H ASP A 58 -31.154 -6.577 4.669 1.00 1.23 H new ATOM 0 HA ASP A 58 -32.749 -4.710 6.316 1.00 24.33 H new ATOM 0 HB2 ASP A 58 -30.080 -5.406 6.491 1.00 74.23 H new ATOM 0 HB3 ASP A 58 -29.999 -3.983 5.472 1.00 74.23 H new ATOM 860 N LEU A 59 -33.491 -3.612 4.189 1.00 1.10 N ATOM 861 CA LEU A 59 -33.885 -2.765 3.069 1.00 32.31 C ATOM 862 C LEU A 59 -33.308 -1.360 3.220 1.00 22.24 C ATOM 863 O LEU A 59 -33.086 -0.660 2.231 1.00 63.34 O ATOM 864 CB LEU A 59 -35.410 -2.695 2.968 1.00 63.13 C ATOM 865 CG LEU A 59 -36.162 -3.996 3.252 1.00 21.11 C ATOM 866 CD1 LEU A 59 -36.817 -3.944 4.624 1.00 3.32 C ATOM 867 CD2 LEU A 59 -37.201 -4.259 2.172 1.00 13.30 C ATOM 0 H LEU A 59 -34.260 -3.885 4.801 1.00 1.10 H new ATOM 0 HA LEU A 59 -33.487 -3.205 2.155 1.00 32.31 H new ATOM 0 HB2 LEU A 59 -35.766 -1.934 3.663 1.00 63.13 H new ATOM 0 HB3 LEU A 59 -35.673 -2.358 1.965 1.00 63.13 H new ATOM 0 HG LEU A 59 -35.445 -4.817 3.245 1.00 21.11 H new ATOM 0 HD11 LEU A 59 -37.348 -4.878 4.809 1.00 3.32 H new ATOM 0 HD12 LEU A 59 -36.052 -3.804 5.387 1.00 3.32 H new ATOM 0 HD13 LEU A 59 -37.522 -3.113 4.660 1.00 3.32 H new ATOM 0 HD21 LEU A 59 -37.726 -5.189 2.391 1.00 13.30 H new ATOM 0 HD22 LEU A 59 -37.915 -3.436 2.146 1.00 13.30 H new ATOM 0 HD23 LEU A 59 -36.707 -4.341 1.204 1.00 13.30 H new ATOM 879 N LEU A 60 -33.068 -0.955 4.462 1.00 4.23 N ATOM 880 CA LEU A 60 -32.516 0.364 4.743 1.00 33.23 C ATOM 881 C LEU A 60 -33.467 1.463 4.280 1.00 4.21 C ATOM 882 O LEU A 60 -33.076 2.623 4.146 1.00 64.02 O ATOM 883 CB LEU A 60 -31.158 0.528 4.056 1.00 0.12 C ATOM 884 CG LEU A 60 -30.137 -0.580 4.317 1.00 74.51 C ATOM 885 CD1 LEU A 60 -29.011 -0.519 3.296 1.00 63.21 C ATOM 886 CD2 LEU A 60 -29.583 -0.472 5.731 1.00 1.41 C ATOM 0 H LEU A 60 -33.247 -1.522 5.291 1.00 4.23 H new ATOM 0 HA LEU A 60 -32.385 0.452 5.821 1.00 33.23 H new ATOM 0 HB2 LEU A 60 -31.323 0.597 2.981 1.00 0.12 H new ATOM 0 HB3 LEU A 60 -30.725 1.476 4.373 1.00 0.12 H new ATOM 0 HG LEU A 60 -30.639 -1.542 4.217 1.00 74.51 H new ATOM 0 HD11 LEU A 60 -28.294 -1.315 3.497 1.00 63.21 H new ATOM 0 HD12 LEU A 60 -29.421 -0.645 2.294 1.00 63.21 H new ATOM 0 HD13 LEU A 60 -28.510 0.447 3.364 1.00 63.21 H new ATOM 0 HD21 LEU A 60 -28.858 -1.268 5.900 1.00 1.41 H new ATOM 0 HD22 LEU A 60 -29.096 0.495 5.858 1.00 1.41 H new ATOM 0 HD23 LEU A 60 -30.398 -0.565 6.449 1.00 1.41 H new ATOM 898 N VAL A 61 -34.721 1.090 4.038 1.00 0.20 N ATOM 899 CA VAL A 61 -35.730 2.044 3.594 1.00 71.21 C ATOM 900 C VAL A 61 -37.136 1.521 3.862 1.00 70.32 C ATOM 901 O VAL A 61 -37.425 0.345 3.643 1.00 31.11 O ATOM 902 CB VAL A 61 -35.586 2.354 2.093 1.00 31.34 C ATOM 903 CG1 VAL A 61 -36.007 1.154 1.257 1.00 4.22 C ATOM 904 CG2 VAL A 61 -36.403 3.583 1.722 1.00 2.31 C ATOM 0 H VAL A 61 -35.061 0.134 4.142 1.00 0.20 H new ATOM 0 HA VAL A 61 -35.572 2.960 4.163 1.00 71.21 H new ATOM 0 HB VAL A 61 -34.537 2.565 1.883 1.00 31.34 H new ATOM 0 HG11 VAL A 61 -35.899 1.392 0.199 1.00 4.22 H new ATOM 0 HG12 VAL A 61 -35.377 0.300 1.503 1.00 4.22 H new ATOM 0 HG13 VAL A 61 -37.048 0.910 1.469 1.00 4.22 H new ATOM 0 HG21 VAL A 61 -36.290 3.788 0.657 1.00 2.31 H new ATOM 0 HG22 VAL A 61 -37.454 3.403 1.947 1.00 2.31 H new ATOM 0 HG23 VAL A 61 -36.051 4.440 2.296 1.00 2.31 H new ATOM 914 N GLY A 62 -38.009 2.403 4.339 1.00 71.04 N ATOM 915 CA GLY A 62 -39.376 2.012 4.630 1.00 31.12 C ATOM 916 C GLY A 62 -40.359 2.528 3.597 1.00 34.53 C ATOM 917 O GLY A 62 -40.748 3.696 3.627 1.00 41.31 O ATOM 0 H GLY A 62 -37.794 3.382 4.529 1.00 71.04 H new ATOM 0 HA2 GLY A 62 -39.438 0.925 4.675 1.00 31.12 H new ATOM 0 HA3 GLY A 62 -39.657 2.388 5.614 1.00 31.12 H new ATOM 921 N LYS A 63 -40.761 1.655 2.678 1.00 64.14 N ATOM 922 CA LYS A 63 -41.704 2.027 1.630 1.00 33.22 C ATOM 923 C LYS A 63 -42.730 0.922 1.404 1.00 20.52 C ATOM 924 O LYS A 63 -42.388 -0.175 0.964 1.00 13.53 O ATOM 925 CB LYS A 63 -40.959 2.321 0.326 1.00 74.02 C ATOM 926 CG LYS A 63 -41.874 2.471 -0.877 1.00 20.40 C ATOM 927 CD LYS A 63 -42.815 3.653 -0.718 1.00 71.32 C ATOM 928 CE LYS A 63 -43.996 3.559 -1.673 1.00 42.40 C ATOM 929 NZ LYS A 63 -44.899 2.426 -1.327 1.00 61.51 N1+ ATOM 0 H LYS A 63 -40.448 0.685 2.638 1.00 64.14 H new ATOM 0 HA LYS A 63 -42.230 2.926 1.951 1.00 33.22 H new ATOM 0 HB2 LYS A 63 -40.379 3.236 0.447 1.00 74.02 H new ATOM 0 HB3 LYS A 63 -40.249 1.517 0.134 1.00 74.02 H new ATOM 0 HG2 LYS A 63 -41.274 2.601 -1.778 1.00 20.40 H new ATOM 0 HG3 LYS A 63 -42.454 1.558 -1.010 1.00 20.40 H new ATOM 0 HD2 LYS A 63 -43.179 3.694 0.309 1.00 71.32 H new ATOM 0 HD3 LYS A 63 -42.271 4.580 -0.901 1.00 71.32 H new ATOM 0 HE2 LYS A 63 -44.558 4.492 -1.648 1.00 42.40 H new ATOM 0 HE3 LYS A 63 -43.630 3.434 -2.692 1.00 42.40 H new ATOM 0 HZ1 LYS A 63 -45.126 1.888 -2.187 1.00 61.51 H new ATOM 0 HZ2 LYS A 63 -44.426 1.801 -0.643 1.00 61.51 H new ATOM 0 HZ3 LYS A 63 -45.776 2.796 -0.909 1.00 61.51 H new ATOM 943 N VAL A 64 -43.991 1.220 1.706 1.00 71.05 N ATOM 944 CA VAL A 64 -45.067 0.252 1.534 1.00 72.21 C ATOM 945 C VAL A 64 -46.366 0.941 1.129 1.00 72.14 C ATOM 946 O VAL A 64 -46.809 1.886 1.781 1.00 61.31 O ATOM 947 CB VAL A 64 -45.307 -0.556 2.822 1.00 41.14 C ATOM 948 CG1 VAL A 64 -44.363 -1.748 2.889 1.00 41.34 C ATOM 949 CG2 VAL A 64 -45.145 0.333 4.046 1.00 71.41 C ATOM 0 H VAL A 64 -44.291 2.124 2.071 1.00 71.05 H new ATOM 0 HA VAL A 64 -44.757 -0.428 0.741 1.00 72.21 H new ATOM 0 HB VAL A 64 -46.329 -0.934 2.808 1.00 41.14 H new ATOM 0 HG11 VAL A 64 -44.547 -2.307 3.806 1.00 41.34 H new ATOM 0 HG12 VAL A 64 -44.533 -2.396 2.029 1.00 41.34 H new ATOM 0 HG13 VAL A 64 -43.331 -1.396 2.880 1.00 41.34 H new ATOM 0 HG21 VAL A 64 -45.318 -0.254 4.948 1.00 71.41 H new ATOM 0 HG22 VAL A 64 -44.135 0.742 4.068 1.00 71.41 H new ATOM 0 HG23 VAL A 64 -45.866 1.149 4.001 1.00 71.41 H new ATOM 959 N THR A 65 -46.972 0.460 0.048 1.00 75.31 N ATOM 960 CA THR A 65 -48.221 1.029 -0.444 1.00 21.11 C ATOM 961 C THR A 65 -49.415 0.181 -0.025 1.00 50.33 C ATOM 962 O THR A 65 -49.287 -1.003 0.288 1.00 22.30 O ATOM 963 CB THR A 65 -48.211 1.161 -1.979 1.00 51.22 C ATOM 964 OG1 THR A 65 -47.296 0.214 -2.546 1.00 52.43 O ATOM 965 CG2 THR A 65 -47.818 2.568 -2.401 1.00 65.41 C ATOM 0 H THR A 65 -46.618 -0.322 -0.503 1.00 75.31 H new ATOM 0 HA THR A 65 -48.312 2.021 -0.002 1.00 21.11 H new ATOM 0 HB THR A 65 -49.218 0.958 -2.345 1.00 51.22 H new ATOM 0 HG1 THR A 65 -47.296 0.303 -3.522 1.00 52.43 H new ATOM 0 HG21 THR A 65 -47.818 2.635 -3.489 1.00 65.41 H new ATOM 0 HG22 THR A 65 -48.532 3.283 -1.993 1.00 65.41 H new ATOM 0 HG23 THR A 65 -46.821 2.796 -2.024 1.00 65.41 H new ATOM 973 N PRO A 66 -50.606 0.797 -0.018 1.00 71.34 N ATOM 974 CA PRO A 66 -51.848 0.116 0.360 1.00 72.00 C ATOM 975 C PRO A 66 -52.279 -0.919 -0.675 1.00 31.14 C ATOM 976 O PRO A 66 -51.899 -0.841 -1.843 1.00 4.01 O ATOM 977 CB PRO A 66 -52.868 1.255 0.435 1.00 54.11 C ATOM 978 CG PRO A 66 -52.331 2.306 -0.473 1.00 72.32 C ATOM 979 CD PRO A 66 -50.833 2.207 -0.380 1.00 51.54 C ATOM 0 HA PRO A 66 -51.741 -0.441 1.291 1.00 72.00 H new ATOM 0 HB2 PRO A 66 -53.856 0.923 0.116 1.00 54.11 H new ATOM 0 HB3 PRO A 66 -52.971 1.627 1.454 1.00 54.11 H new ATOM 0 HG2 PRO A 66 -52.670 2.148 -1.497 1.00 72.32 H new ATOM 0 HG3 PRO A 66 -52.676 3.295 -0.172 1.00 72.32 H new ATOM 0 HD2 PRO A 66 -50.354 2.461 -1.326 1.00 51.54 H new ATOM 0 HD3 PRO A 66 -50.431 2.885 0.373 1.00 51.54 H new ATOM 987 N LYS A 67 -53.076 -1.888 -0.238 1.00 13.34 N ATOM 988 CA LYS A 67 -53.561 -2.938 -1.124 1.00 22.03 C ATOM 989 C LYS A 67 -55.085 -2.930 -1.196 1.00 61.40 C ATOM 990 O LYS A 67 -55.745 -2.174 -0.484 1.00 45.12 O ATOM 991 CB LYS A 67 -53.071 -4.306 -0.645 1.00 13.12 C ATOM 992 CG LYS A 67 -51.744 -4.725 -1.255 1.00 24.12 C ATOM 993 CD LYS A 67 -51.341 -6.120 -0.809 1.00 43.33 C ATOM 994 CE LYS A 67 -52.233 -7.184 -1.432 1.00 51.24 C ATOM 995 NZ LYS A 67 -52.117 -7.204 -2.916 1.00 22.33 N1+ ATOM 0 H LYS A 67 -53.400 -1.967 0.726 1.00 13.34 H new ATOM 0 HA LYS A 67 -53.166 -2.746 -2.122 1.00 22.03 H new ATOM 0 HB2 LYS A 67 -52.973 -4.288 0.440 1.00 13.12 H new ATOM 0 HB3 LYS A 67 -53.824 -5.057 -0.884 1.00 13.12 H new ATOM 0 HG2 LYS A 67 -51.817 -4.697 -2.342 1.00 24.12 H new ATOM 0 HG3 LYS A 67 -50.970 -4.013 -0.969 1.00 24.12 H new ATOM 0 HD2 LYS A 67 -50.303 -6.306 -1.086 1.00 43.33 H new ATOM 0 HD3 LYS A 67 -51.398 -6.186 0.277 1.00 43.33 H new ATOM 0 HE2 LYS A 67 -51.964 -8.162 -1.033 1.00 51.24 H new ATOM 0 HE3 LYS A 67 -53.270 -6.999 -1.151 1.00 51.24 H new ATOM 0 HZ1 LYS A 67 -52.482 -8.107 -3.281 1.00 22.33 H new ATOM 0 HZ2 LYS A 67 -52.669 -6.420 -3.318 1.00 22.33 H new ATOM 0 HZ3 LYS A 67 -51.119 -7.099 -3.188 1.00 22.33 H new ATOM 1009 N GLY A 68 -55.638 -3.775 -2.061 1.00 41.33 N ATOM 1010 CA GLY A 68 -57.079 -3.850 -2.208 1.00 62.55 C ATOM 1011 C GLY A 68 -57.684 -4.996 -1.423 1.00 22.32 C ATOM 1012 O GLY A 68 -57.026 -6.008 -1.182 1.00 24.52 O ATOM 0 H GLY A 68 -55.113 -4.409 -2.663 1.00 41.33 H new ATOM 0 HA2 GLY A 68 -57.524 -2.912 -1.876 1.00 62.55 H new ATOM 0 HA3 GLY A 68 -57.328 -3.965 -3.263 1.00 62.55 H new ATOM 1016 N VAL A 69 -58.942 -4.839 -1.023 1.00 13.52 N ATOM 1017 CA VAL A 69 -59.636 -5.870 -0.261 1.00 23.11 C ATOM 1018 C VAL A 69 -59.957 -7.078 -1.134 1.00 22.23 C ATOM 1019 O VAL A 69 -60.047 -8.204 -0.647 1.00 32.21 O ATOM 1020 CB VAL A 69 -60.942 -5.331 0.353 1.00 70.31 C ATOM 1021 CG1 VAL A 69 -60.651 -4.186 1.310 1.00 51.03 C ATOM 1022 CG2 VAL A 69 -61.902 -4.891 -0.743 1.00 34.25 C ATOM 0 H VAL A 69 -59.501 -4.008 -1.214 1.00 13.52 H new ATOM 0 HA VAL A 69 -58.965 -6.175 0.542 1.00 23.11 H new ATOM 0 HB VAL A 69 -61.415 -6.133 0.920 1.00 70.31 H new ATOM 0 HG11 VAL A 69 -61.586 -3.819 1.733 1.00 51.03 H new ATOM 0 HG12 VAL A 69 -60.003 -4.538 2.113 1.00 51.03 H new ATOM 0 HG13 VAL A 69 -60.155 -3.379 0.771 1.00 51.03 H new ATOM 0 HG21 VAL A 69 -62.820 -4.513 -0.293 1.00 34.25 H new ATOM 0 HG22 VAL A 69 -61.439 -4.104 -1.338 1.00 34.25 H new ATOM 0 HG23 VAL A 69 -62.136 -5.741 -1.384 1.00 34.25 H new ATOM 1032 N THR A 70 -60.130 -6.834 -2.430 1.00 55.35 N ATOM 1033 CA THR A 70 -60.444 -7.900 -3.373 1.00 0.23 C ATOM 1034 C THR A 70 -59.238 -8.807 -3.596 1.00 24.22 C ATOM 1035 O THR A 70 -59.388 -9.983 -3.924 1.00 33.12 O ATOM 1036 CB THR A 70 -60.904 -7.333 -4.729 1.00 23.51 C ATOM 1037 OG1 THR A 70 -61.623 -6.112 -4.531 1.00 74.35 O ATOM 1038 CG2 THR A 70 -61.785 -8.334 -5.462 1.00 3.05 C ATOM 0 H THR A 70 -60.058 -5.907 -2.850 1.00 55.35 H new ATOM 0 HA THR A 70 -61.257 -8.480 -2.937 1.00 0.23 H new ATOM 0 HB THR A 70 -60.020 -7.138 -5.336 1.00 23.51 H new ATOM 0 HG1 THR A 70 -61.910 -5.757 -5.398 1.00 74.35 H new ATOM 0 HG21 THR A 70 -62.098 -7.912 -6.417 1.00 3.05 H new ATOM 0 HG22 THR A 70 -61.224 -9.252 -5.637 1.00 3.05 H new ATOM 0 HG23 THR A 70 -62.665 -8.556 -4.857 1.00 3.05 H new ATOM 1046 N GLU A 71 -58.044 -8.251 -3.415 1.00 11.11 N ATOM 1047 CA GLU A 71 -56.813 -9.012 -3.598 1.00 34.23 C ATOM 1048 C GLU A 71 -56.687 -10.105 -2.541 1.00 23.33 C ATOM 1049 O GLU A 71 -56.108 -11.163 -2.791 1.00 53.31 O ATOM 1050 CB GLU A 71 -55.599 -8.083 -3.535 1.00 54.35 C ATOM 1051 CG GLU A 71 -55.133 -7.595 -4.897 1.00 72.01 C ATOM 1052 CD GLU A 71 -55.797 -6.296 -5.309 1.00 25.40 C ATOM 1053 OE1 GLU A 71 -57.009 -6.142 -5.054 1.00 5.12 O ATOM 1054 OE2 GLU A 71 -55.103 -5.433 -5.887 1.00 23.50 O1- ATOM 0 H GLU A 71 -57.903 -7.278 -3.142 1.00 11.11 H new ATOM 0 HA GLU A 71 -56.850 -9.483 -4.580 1.00 34.23 H new ATOM 0 HB2 GLU A 71 -55.844 -7.221 -2.914 1.00 54.35 H new ATOM 0 HB3 GLU A 71 -54.777 -8.606 -3.045 1.00 54.35 H new ATOM 0 HG2 GLU A 71 -54.052 -7.456 -4.879 1.00 72.01 H new ATOM 0 HG3 GLU A 71 -55.344 -8.360 -5.645 1.00 72.01 H new ATOM 1061 N LEU A 72 -57.233 -9.842 -1.359 1.00 12.50 N ATOM 1062 CA LEU A 72 -57.182 -10.802 -0.262 1.00 60.42 C ATOM 1063 C LEU A 72 -57.720 -12.160 -0.700 1.00 51.14 C ATOM 1064 O LEU A 72 -58.574 -12.246 -1.584 1.00 34.14 O ATOM 1065 CB LEU A 72 -57.983 -10.284 0.934 1.00 44.10 C ATOM 1066 CG LEU A 72 -57.241 -9.345 1.884 1.00 41.21 C ATOM 1067 CD1 LEU A 72 -56.717 -8.130 1.134 1.00 14.22 C ATOM 1068 CD2 LEU A 72 -58.147 -8.918 3.028 1.00 4.04 C ATOM 0 H LEU A 72 -57.716 -8.972 -1.136 1.00 12.50 H new ATOM 0 HA LEU A 72 -56.140 -10.924 0.033 1.00 60.42 H new ATOM 0 HB2 LEU A 72 -58.865 -9.765 0.558 1.00 44.10 H new ATOM 0 HB3 LEU A 72 -58.338 -11.141 1.506 1.00 44.10 H new ATOM 0 HG LEU A 72 -56.390 -9.882 2.303 1.00 41.21 H new ATOM 0 HD11 LEU A 72 -56.192 -7.473 1.827 1.00 14.22 H new ATOM 0 HD12 LEU A 72 -56.032 -8.454 0.351 1.00 14.22 H new ATOM 0 HD13 LEU A 72 -57.552 -7.591 0.686 1.00 14.22 H new ATOM 0 HD21 LEU A 72 -57.601 -8.250 3.694 1.00 4.04 H new ATOM 0 HD22 LEU A 72 -59.018 -8.400 2.628 1.00 4.04 H new ATOM 0 HD23 LEU A 72 -58.472 -9.798 3.583 1.00 4.04 H new ATOM 1080 N THR A 73 -57.218 -13.221 -0.077 1.00 73.31 N ATOM 1081 CA THR A 73 -57.648 -14.574 -0.402 1.00 33.52 C ATOM 1082 C THR A 73 -58.459 -15.181 0.737 1.00 24.20 C ATOM 1083 O THR A 73 -58.447 -14.675 1.859 1.00 22.42 O ATOM 1084 CB THR A 73 -56.447 -15.489 -0.706 1.00 30.40 C ATOM 1085 OG1 THR A 73 -55.753 -15.806 0.506 1.00 65.52 O ATOM 1086 CG2 THR A 73 -55.492 -14.820 -1.683 1.00 71.53 C ATOM 0 H THR A 73 -56.512 -13.169 0.657 1.00 73.31 H new ATOM 0 HA THR A 73 -58.273 -14.501 -1.292 1.00 33.52 H new ATOM 0 HB THR A 73 -56.823 -16.406 -1.159 1.00 30.40 H new ATOM 0 HG1 THR A 73 -54.992 -16.389 0.304 1.00 65.52 H new ATOM 0 HG21 THR A 73 -54.651 -15.485 -1.883 1.00 71.53 H new ATOM 0 HG22 THR A 73 -56.015 -14.606 -2.615 1.00 71.53 H new ATOM 0 HG23 THR A 73 -55.124 -13.889 -1.252 1.00 71.53 H new ATOM 1094 N ALA A 74 -59.163 -16.269 0.443 1.00 25.51 N ATOM 1095 CA ALA A 74 -59.977 -16.947 1.443 1.00 22.05 C ATOM 1096 C ALA A 74 -59.145 -17.324 2.665 1.00 64.11 C ATOM 1097 O ALA A 74 -59.649 -17.341 3.788 1.00 22.20 O ATOM 1098 CB ALA A 74 -60.628 -18.185 0.845 1.00 52.43 C ATOM 0 H ALA A 74 -59.186 -16.700 -0.481 1.00 25.51 H new ATOM 0 HA ALA A 74 -60.758 -16.259 1.765 1.00 22.05 H new ATOM 0 HB1 ALA A 74 -61.233 -18.681 1.604 1.00 52.43 H new ATOM 0 HB2 ALA A 74 -61.263 -17.894 0.008 1.00 52.43 H new ATOM 0 HB3 ALA A 74 -59.855 -18.869 0.493 1.00 52.43 H new ATOM 1104 N GLU A 75 -57.871 -17.625 2.437 1.00 71.15 N ATOM 1105 CA GLU A 75 -56.971 -18.003 3.521 1.00 23.11 C ATOM 1106 C GLU A 75 -56.837 -16.871 4.535 1.00 12.34 C ATOM 1107 O GLU A 75 -56.712 -17.113 5.736 1.00 50.21 O ATOM 1108 CB GLU A 75 -55.594 -18.370 2.965 1.00 42.41 C ATOM 1109 CG GLU A 75 -55.647 -19.359 1.812 1.00 25.54 C ATOM 1110 CD GLU A 75 -54.276 -19.883 1.429 1.00 73.13 C ATOM 1111 OE1 GLU A 75 -53.540 -19.163 0.724 1.00 41.51 O ATOM 1112 OE2 GLU A 75 -53.940 -21.015 1.837 1.00 65.41 O1- ATOM 0 H GLU A 75 -57.439 -17.615 1.513 1.00 71.15 H new ATOM 0 HA GLU A 75 -57.394 -18.872 4.025 1.00 23.11 H new ATOM 0 HB2 GLU A 75 -55.093 -17.462 2.631 1.00 42.41 H new ATOM 0 HB3 GLU A 75 -54.988 -18.792 3.767 1.00 42.41 H new ATOM 0 HG2 GLU A 75 -56.288 -20.197 2.086 1.00 25.54 H new ATOM 0 HG3 GLU A 75 -56.103 -18.878 0.946 1.00 25.54 H new ATOM 1119 N GLU A 76 -56.862 -15.636 4.043 1.00 50.31 N ATOM 1120 CA GLU A 76 -56.741 -14.468 4.907 1.00 72.21 C ATOM 1121 C GLU A 76 -58.070 -14.157 5.590 1.00 22.24 C ATOM 1122 O GLU A 76 -58.110 -13.850 6.782 1.00 10.21 O ATOM 1123 CB GLU A 76 -56.274 -13.255 4.099 1.00 62.24 C ATOM 1124 CG GLU A 76 -56.899 -11.945 4.552 1.00 64.30 C ATOM 1125 CD GLU A 76 -56.590 -11.622 6.001 1.00 33.44 C ATOM 1126 OE1 GLU A 76 -55.425 -11.797 6.413 1.00 31.41 O ATOM 1127 OE2 GLU A 76 -57.516 -11.193 6.722 1.00 3.21 O1- ATOM 0 H GLU A 76 -56.965 -15.419 3.052 1.00 50.31 H new ATOM 0 HA GLU A 76 -56.001 -14.691 5.675 1.00 72.21 H new ATOM 0 HB2 GLU A 76 -55.189 -13.175 4.173 1.00 62.24 H new ATOM 0 HB3 GLU A 76 -56.511 -13.416 3.047 1.00 62.24 H new ATOM 0 HG2 GLU A 76 -56.537 -11.136 3.918 1.00 64.30 H new ATOM 0 HG3 GLU A 76 -57.979 -11.996 4.417 1.00 64.30 H new ATOM 1134 N ARG A 77 -59.154 -14.239 4.827 1.00 60.41 N ATOM 1135 CA ARG A 77 -60.484 -13.964 5.358 1.00 75.45 C ATOM 1136 C ARG A 77 -60.748 -14.788 6.615 1.00 5.25 C ATOM 1137 O ARG A 77 -61.205 -14.262 7.631 1.00 54.11 O ATOM 1138 CB ARG A 77 -61.550 -14.268 4.303 1.00 61.41 C ATOM 1139 CG ARG A 77 -61.530 -13.309 3.124 1.00 55.33 C ATOM 1140 CD ARG A 77 -62.748 -13.497 2.233 1.00 52.34 C ATOM 1141 NE ARG A 77 -62.981 -12.338 1.373 1.00 62.33 N ATOM 1142 CZ ARG A 77 -64.075 -12.178 0.638 1.00 34.33 C ATOM 1143 NH1 ARG A 77 -65.032 -13.095 0.657 1.00 23.02 N1+ ATOM 1144 NH2 ARG A 77 -64.214 -11.097 -0.119 1.00 22.33 N ATOM 0 H ARG A 77 -59.138 -14.493 3.839 1.00 60.41 H new ATOM 0 HA ARG A 77 -60.532 -12.907 5.620 1.00 75.45 H new ATOM 0 HB2 ARG A 77 -61.407 -15.284 3.936 1.00 61.41 H new ATOM 0 HB3 ARG A 77 -62.533 -14.234 4.772 1.00 61.41 H new ATOM 0 HG2 ARG A 77 -61.500 -12.282 3.489 1.00 55.33 H new ATOM 0 HG3 ARG A 77 -60.623 -13.467 2.540 1.00 55.33 H new ATOM 0 HD2 ARG A 77 -62.612 -14.385 1.616 1.00 52.34 H new ATOM 0 HD3 ARG A 77 -63.627 -13.671 2.853 1.00 52.34 H new ATOM 0 HE ARG A 77 -62.264 -11.613 1.336 1.00 62.33 H new ATOM 0 HH11 ARG A 77 -64.929 -13.927 1.238 1.00 23.02 H new ATOM 0 HH12 ARG A 77 -65.871 -12.968 0.091 1.00 23.02 H new ATOM 0 HH21 ARG A 77 -63.480 -10.389 -0.136 1.00 22.33 H new ATOM 0 HH22 ARG A 77 -65.055 -10.974 -0.684 1.00 22.33 H new ATOM 1158 N LEU A 78 -60.459 -16.083 6.539 1.00 4.11 N ATOM 1159 CA LEU A 78 -60.665 -16.981 7.670 1.00 63.30 C ATOM 1160 C LEU A 78 -59.628 -16.730 8.761 1.00 1.51 C ATOM 1161 O LEU A 78 -59.885 -16.964 9.942 1.00 72.43 O ATOM 1162 CB LEU A 78 -60.597 -18.437 7.210 1.00 62.25 C ATOM 1163 CG LEU A 78 -59.292 -18.869 6.540 1.00 4.10 C ATOM 1164 CD1 LEU A 78 -58.285 -19.331 7.581 1.00 71.01 C ATOM 1165 CD2 LEU A 78 -59.554 -19.970 5.523 1.00 24.05 C ATOM 0 H LEU A 78 -60.081 -16.534 5.706 1.00 4.11 H new ATOM 0 HA LEU A 78 -61.654 -16.784 8.083 1.00 63.30 H new ATOM 0 HB2 LEU A 78 -60.768 -19.079 8.074 1.00 62.25 H new ATOM 0 HB3 LEU A 78 -61.416 -18.616 6.513 1.00 62.25 H new ATOM 0 HG LEU A 78 -58.873 -18.010 6.016 1.00 4.10 H new ATOM 0 HD11 LEU A 78 -57.363 -19.635 7.086 1.00 71.01 H new ATOM 0 HD12 LEU A 78 -58.074 -18.514 8.271 1.00 71.01 H new ATOM 0 HD13 LEU A 78 -58.695 -20.176 8.134 1.00 71.01 H new ATOM 0 HD21 LEU A 78 -58.614 -20.265 5.056 1.00 24.05 H new ATOM 0 HD22 LEU A 78 -59.996 -20.831 6.025 1.00 24.05 H new ATOM 0 HD23 LEU A 78 -60.240 -19.604 4.759 1.00 24.05 H new ATOM 1177 N LEU A 79 -58.457 -16.253 8.356 1.00 73.12 N ATOM 1178 CA LEU A 79 -57.381 -15.968 9.298 1.00 25.52 C ATOM 1179 C LEU A 79 -57.824 -14.947 10.341 1.00 13.43 C ATOM 1180 O LEU A 79 -57.294 -14.907 11.451 1.00 45.51 O ATOM 1181 CB LEU A 79 -56.147 -15.451 8.554 1.00 42.42 C ATOM 1182 CG LEU A 79 -54.833 -15.475 9.335 1.00 44.11 C ATOM 1183 CD1 LEU A 79 -54.258 -16.883 9.373 1.00 40.45 C ATOM 1184 CD2 LEU A 79 -53.832 -14.504 8.725 1.00 24.32 C ATOM 0 H LEU A 79 -58.228 -16.055 7.382 1.00 73.12 H new ATOM 0 HA LEU A 79 -57.127 -16.896 9.810 1.00 25.52 H new ATOM 0 HB2 LEU A 79 -56.019 -16.044 7.648 1.00 42.42 H new ATOM 0 HB3 LEU A 79 -56.341 -14.426 8.239 1.00 42.42 H new ATOM 0 HG LEU A 79 -55.036 -15.161 10.359 1.00 44.11 H new ATOM 0 HD11 LEU A 79 -53.323 -16.879 9.933 1.00 40.45 H new ATOM 0 HD12 LEU A 79 -54.968 -17.553 9.857 1.00 40.45 H new ATOM 0 HD13 LEU A 79 -54.070 -17.227 8.356 1.00 40.45 H new ATOM 0 HD21 LEU A 79 -52.903 -14.534 9.294 1.00 24.32 H new ATOM 0 HD22 LEU A 79 -53.634 -14.787 7.691 1.00 24.32 H new ATOM 0 HD23 LEU A 79 -54.241 -13.494 8.753 1.00 24.32 H new ATOM 1196 N HIS A 80 -58.803 -14.124 9.975 1.00 75.01 N ATOM 1197 CA HIS A 80 -59.320 -13.103 10.880 1.00 1.10 C ATOM 1198 C HIS A 80 -59.850 -13.733 12.164 1.00 41.42 C ATOM 1199 O HIS A 80 -59.590 -13.240 13.261 1.00 43.25 O ATOM 1200 CB HIS A 80 -60.429 -12.302 10.197 1.00 42.21 C ATOM 1201 CG HIS A 80 -61.078 -11.293 11.093 1.00 54.33 C ATOM 1202 ND1 HIS A 80 -62.406 -11.354 11.458 1.00 50.24 N ATOM 1203 CD2 HIS A 80 -60.574 -10.194 11.702 1.00 45.33 C ATOM 1204 CE1 HIS A 80 -62.691 -10.336 12.249 1.00 33.42 C ATOM 1205 NE2 HIS A 80 -61.595 -9.616 12.413 1.00 55.02 N ATOM 0 H HIS A 80 -59.253 -14.144 9.060 1.00 75.01 H new ATOM 0 HA HIS A 80 -58.501 -12.431 11.137 1.00 1.10 H new ATOM 0 HB2 HIS A 80 -60.014 -11.791 9.328 1.00 42.21 H new ATOM 0 HB3 HIS A 80 -61.189 -12.991 9.829 1.00 42.21 H new ATOM 0 HD2 HIS A 80 -59.556 -9.838 11.640 1.00 45.33 H new ATOM 0 HE1 HIS A 80 -63.656 -10.127 12.687 1.00 33.42 H new ATOM 0 HE2 HIS A 80 -61.520 -8.769 12.976 1.00 55.02 H new ATOM 1213 N ALA A 81 -60.592 -14.826 12.020 1.00 63.15 N ATOM 1214 CA ALA A 81 -61.156 -15.524 13.167 1.00 52.51 C ATOM 1215 C ALA A 81 -60.064 -16.195 13.993 1.00 71.02 C ATOM 1216 O ALA A 81 -60.235 -16.434 15.189 1.00 50.32 O ATOM 1217 CB ALA A 81 -62.180 -16.552 12.709 1.00 34.12 C ATOM 0 H ALA A 81 -60.816 -15.247 11.119 1.00 63.15 H new ATOM 0 HA ALA A 81 -61.654 -14.788 13.799 1.00 52.51 H new ATOM 0 HB1 ALA A 81 -62.593 -17.066 13.577 1.00 34.12 H new ATOM 0 HB2 ALA A 81 -62.983 -16.050 12.168 1.00 34.12 H new ATOM 0 HB3 ALA A 81 -61.699 -17.277 12.053 1.00 34.12 H new ATOM 1223 N ILE A 82 -58.943 -16.498 13.348 1.00 14.21 N ATOM 1224 CA ILE A 82 -57.822 -17.140 14.024 1.00 11.44 C ATOM 1225 C ILE A 82 -57.163 -16.192 15.019 1.00 25.11 C ATOM 1226 O ILE A 82 -57.099 -16.477 16.215 1.00 24.25 O ATOM 1227 CB ILE A 82 -56.763 -17.629 13.018 1.00 54.10 C ATOM 1228 CG1 ILE A 82 -57.427 -18.414 11.886 1.00 55.43 C ATOM 1229 CG2 ILE A 82 -55.718 -18.482 13.721 1.00 73.32 C ATOM 1230 CD1 ILE A 82 -58.226 -19.605 12.365 1.00 45.00 C ATOM 0 H ILE A 82 -58.786 -16.309 12.358 1.00 14.21 H new ATOM 0 HA ILE A 82 -58.227 -17.999 14.559 1.00 11.44 H new ATOM 0 HB ILE A 82 -56.264 -16.761 12.588 1.00 54.10 H new ATOM 0 HG12 ILE A 82 -58.084 -17.746 11.328 1.00 55.43 H new ATOM 0 HG13 ILE A 82 -56.659 -18.757 11.193 1.00 55.43 H new ATOM 0 HG21 ILE A 82 -54.977 -18.820 12.997 1.00 73.32 H new ATOM 0 HG22 ILE A 82 -55.227 -17.892 14.494 1.00 73.32 H new ATOM 0 HG23 ILE A 82 -56.201 -19.347 14.176 1.00 73.32 H new ATOM 0 HD11 ILE A 82 -58.668 -20.114 11.509 1.00 45.00 H new ATOM 0 HD12 ILE A 82 -57.569 -20.293 12.897 1.00 45.00 H new ATOM 0 HD13 ILE A 82 -59.017 -19.267 13.035 1.00 45.00 H new ATOM 1242 N PHE A 83 -56.676 -15.062 14.518 1.00 72.31 N ATOM 1243 CA PHE A 83 -56.021 -14.070 15.364 1.00 63.53 C ATOM 1244 C PHE A 83 -57.047 -13.297 16.187 1.00 3.44 C ATOM 1245 O PHE A 83 -56.738 -12.782 17.261 1.00 52.42 O ATOM 1246 CB PHE A 83 -55.201 -13.102 14.510 1.00 53.14 C ATOM 1247 CG PHE A 83 -53.774 -13.530 14.322 1.00 4.12 C ATOM 1248 CD1 PHE A 83 -52.802 -13.171 15.243 1.00 53.02 C ATOM 1249 CD2 PHE A 83 -53.403 -14.291 13.225 1.00 44.11 C ATOM 1250 CE1 PHE A 83 -51.488 -13.563 15.072 1.00 32.53 C ATOM 1251 CE2 PHE A 83 -52.090 -14.686 13.049 1.00 2.50 C ATOM 1252 CZ PHE A 83 -51.132 -14.323 13.975 1.00 24.31 C ATOM 0 H PHE A 83 -56.722 -14.810 13.531 1.00 72.31 H new ATOM 0 HA PHE A 83 -55.353 -14.595 16.047 1.00 63.53 H new ATOM 0 HB2 PHE A 83 -55.674 -13.002 13.533 1.00 53.14 H new ATOM 0 HB3 PHE A 83 -55.218 -12.116 14.975 1.00 53.14 H new ATOM 0 HD1 PHE A 83 -53.075 -12.578 16.104 1.00 53.02 H new ATOM 0 HD2 PHE A 83 -54.149 -14.579 12.499 1.00 44.11 H new ATOM 0 HE1 PHE A 83 -50.740 -13.275 15.796 1.00 32.53 H new ATOM 0 HE2 PHE A 83 -51.814 -15.278 12.189 1.00 2.50 H new ATOM 0 HZ PHE A 83 -50.106 -14.633 13.842 1.00 24.31 H new ATOM 1262 N GLY A 84 -58.272 -13.219 15.674 1.00 11.45 N ATOM 1263 CA GLY A 84 -59.325 -12.505 16.373 1.00 21.23 C ATOM 1264 C GLY A 84 -59.041 -11.021 16.490 1.00 34.15 C ATOM 1265 O GLY A 84 -59.440 -10.381 17.463 1.00 1.13 O ATOM 0 H GLY A 84 -58.553 -13.637 14.787 1.00 11.45 H new ATOM 0 HA2 GLY A 84 -60.269 -12.651 15.848 1.00 21.23 H new ATOM 0 HA3 GLY A 84 -59.446 -12.928 17.370 1.00 21.23 H new ATOM 1269 N GLU A 85 -58.348 -10.473 15.498 1.00 71.23 N ATOM 1270 CA GLU A 85 -58.009 -9.054 15.496 1.00 3.24 C ATOM 1271 C GLU A 85 -57.903 -8.522 14.069 1.00 45.31 C ATOM 1272 O GLU A 85 -57.283 -9.144 13.207 1.00 43.43 O ATOM 1273 CB GLU A 85 -56.692 -8.820 16.238 1.00 62.14 C ATOM 1274 CG GLU A 85 -56.684 -9.375 17.653 1.00 3.03 C ATOM 1275 CD GLU A 85 -55.559 -8.808 18.495 1.00 22.13 C ATOM 1276 OE1 GLU A 85 -54.855 -7.896 18.009 1.00 62.10 O ATOM 1277 OE2 GLU A 85 -55.380 -9.274 19.640 1.00 0.10 O1- ATOM 0 H GLU A 85 -58.010 -10.989 14.686 1.00 71.23 H new ATOM 0 HA GLU A 85 -58.807 -8.516 16.008 1.00 3.24 H new ATOM 0 HB2 GLU A 85 -55.880 -9.277 15.673 1.00 62.14 H new ATOM 0 HB3 GLU A 85 -56.491 -7.749 16.275 1.00 62.14 H new ATOM 0 HG2 GLU A 85 -57.638 -9.154 18.131 1.00 3.03 H new ATOM 0 HG3 GLU A 85 -56.592 -10.460 17.613 1.00 3.03 H new ATOM 1284 N LYS A 86 -58.514 -7.366 13.828 1.00 0.31 N ATOM 1285 CA LYS A 86 -58.488 -6.749 12.508 1.00 50.23 C ATOM 1286 C LYS A 86 -57.055 -6.548 12.028 1.00 62.42 C ATOM 1287 O LYS A 86 -56.241 -5.932 12.715 1.00 1.22 O ATOM 1288 CB LYS A 86 -59.219 -5.404 12.538 1.00 52.31 C ATOM 1289 CG LYS A 86 -60.680 -5.514 12.940 1.00 22.44 C ATOM 1290 CD LYS A 86 -61.552 -5.930 11.767 1.00 14.40 C ATOM 1291 CE LYS A 86 -62.938 -6.355 12.225 1.00 71.34 C ATOM 1292 NZ LYS A 86 -63.828 -5.184 12.458 1.00 0.31 N1+ ATOM 0 H LYS A 86 -59.033 -6.838 14.530 1.00 0.31 H new ATOM 0 HA LYS A 86 -58.995 -7.418 11.812 1.00 50.23 H new ATOM 0 HB2 LYS A 86 -58.709 -4.738 13.234 1.00 52.31 H new ATOM 0 HB3 LYS A 86 -59.156 -4.944 11.552 1.00 52.31 H new ATOM 0 HG2 LYS A 86 -60.783 -6.240 13.746 1.00 22.44 H new ATOM 0 HG3 LYS A 86 -61.024 -4.556 13.329 1.00 22.44 H new ATOM 0 HD2 LYS A 86 -61.638 -5.101 11.065 1.00 14.40 H new ATOM 0 HD3 LYS A 86 -61.076 -6.752 11.233 1.00 14.40 H new ATOM 0 HE2 LYS A 86 -63.385 -7.007 11.474 1.00 71.34 H new ATOM 0 HE3 LYS A 86 -62.855 -6.936 13.143 1.00 71.34 H new ATOM 0 HZ1 LYS A 86 -64.763 -5.515 12.769 1.00 0.31 H new ATOM 0 HZ2 LYS A 86 -63.415 -4.575 13.192 1.00 0.31 H new ATOM 0 HZ3 LYS A 86 -63.928 -4.643 11.575 1.00 0.31 H new ATOM 1306 N ALA A 87 -56.754 -7.073 10.844 1.00 21.22 N ATOM 1307 CA ALA A 87 -55.419 -6.948 10.271 1.00 63.11 C ATOM 1308 C ALA A 87 -55.488 -6.548 8.801 1.00 4.23 C ATOM 1309 O ALA A 87 -56.018 -7.288 7.971 1.00 21.02 O ATOM 1310 CB ALA A 87 -54.653 -8.254 10.430 1.00 2.10 C ATOM 0 H ALA A 87 -57.416 -7.588 10.264 1.00 21.22 H new ATOM 0 HA ALA A 87 -54.891 -6.161 10.810 1.00 63.11 H new ATOM 0 HB1 ALA A 87 -53.658 -8.147 9.998 1.00 2.10 H new ATOM 0 HB2 ALA A 87 -54.565 -8.497 11.489 1.00 2.10 H new ATOM 0 HB3 ALA A 87 -55.187 -9.054 9.917 1.00 2.10 H new ATOM 1316 N ARG A 88 -54.949 -5.375 8.486 1.00 51.52 N ATOM 1317 CA ARG A 88 -54.952 -4.876 7.116 1.00 72.01 C ATOM 1318 C ARG A 88 -53.759 -5.423 6.337 1.00 43.43 C ATOM 1319 O ARG A 88 -52.736 -5.780 6.919 1.00 52.35 O ATOM 1320 CB ARG A 88 -54.923 -3.347 7.107 1.00 64.15 C ATOM 1321 CG ARG A 88 -56.297 -2.711 7.237 1.00 10.34 C ATOM 1322 CD ARG A 88 -56.875 -2.914 8.629 1.00 52.23 C ATOM 1323 NE ARG A 88 -58.068 -2.101 8.850 1.00 54.25 N ATOM 1324 CZ ARG A 88 -58.041 -0.784 9.015 1.00 53.44 C ATOM 1325 NH1 ARG A 88 -56.886 -0.133 8.983 1.00 14.44 N1+ ATOM 1326 NH2 ARG A 88 -59.169 -0.114 9.211 1.00 23.21 N ATOM 0 H ARG A 88 -54.505 -4.752 9.161 1.00 51.52 H new ATOM 0 HA ARG A 88 -55.868 -5.217 6.633 1.00 72.01 H new ATOM 0 HB2 ARG A 88 -54.292 -2.999 7.925 1.00 64.15 H new ATOM 0 HB3 ARG A 88 -54.460 -3.006 6.181 1.00 64.15 H new ATOM 0 HG2 ARG A 88 -56.227 -1.645 7.023 1.00 10.34 H new ATOM 0 HG3 ARG A 88 -56.970 -3.142 6.496 1.00 10.34 H new ATOM 0 HD2 ARG A 88 -57.122 -3.966 8.769 1.00 52.23 H new ATOM 0 HD3 ARG A 88 -56.121 -2.662 9.375 1.00 52.23 H new ATOM 0 HE ARG A 88 -58.973 -2.571 8.879 1.00 54.25 H new ATOM 0 HH11 ARG A 88 -56.016 -0.644 8.831 1.00 14.44 H new ATOM 0 HH12 ARG A 88 -56.867 0.879 9.110 1.00 14.44 H new ATOM 0 HH21 ARG A 88 -60.060 -0.611 9.235 1.00 23.21 H new ATOM 0 HH22 ARG A 88 -59.146 0.898 9.338 1.00 23.21 H new ATOM 1340 N GLU A 89 -53.900 -5.485 5.016 1.00 51.11 N ATOM 1341 CA GLU A 89 -52.835 -5.989 4.158 1.00 3.21 C ATOM 1342 C GLU A 89 -52.336 -4.900 3.211 1.00 11.30 C ATOM 1343 O GLU A 89 -53.118 -4.093 2.711 1.00 53.52 O ATOM 1344 CB GLU A 89 -53.325 -7.195 3.352 1.00 74.52 C ATOM 1345 CG GLU A 89 -53.289 -8.501 4.129 1.00 45.43 C ATOM 1346 CD GLU A 89 -53.492 -9.713 3.240 1.00 12.21 C ATOM 1347 OE1 GLU A 89 -53.672 -9.528 2.018 1.00 23.33 O ATOM 1348 OE2 GLU A 89 -53.471 -10.845 3.766 1.00 4.44 O1- ATOM 0 H GLU A 89 -54.741 -5.193 4.518 1.00 51.11 H new ATOM 0 HA GLU A 89 -52.007 -6.299 4.796 1.00 3.21 H new ATOM 0 HB2 GLU A 89 -54.346 -7.008 3.019 1.00 74.52 H new ATOM 0 HB3 GLU A 89 -52.711 -7.297 2.457 1.00 74.52 H new ATOM 0 HG2 GLU A 89 -52.332 -8.588 4.643 1.00 45.43 H new ATOM 0 HG3 GLU A 89 -54.062 -8.484 4.897 1.00 45.43 H new ATOM 1355 N VAL A 90 -51.029 -4.886 2.972 1.00 14.00 N ATOM 1356 CA VAL A 90 -50.425 -3.897 2.086 1.00 43.15 C ATOM 1357 C VAL A 90 -49.397 -4.541 1.164 1.00 34.22 C ATOM 1358 O VAL A 90 -49.163 -5.749 1.225 1.00 14.45 O ATOM 1359 CB VAL A 90 -49.746 -2.769 2.885 1.00 61.31 C ATOM 1360 CG1 VAL A 90 -50.784 -1.794 3.421 1.00 61.42 C ATOM 1361 CG2 VAL A 90 -48.910 -3.346 4.017 1.00 63.51 C ATOM 0 H VAL A 90 -50.368 -5.548 3.379 1.00 14.00 H new ATOM 0 HA VAL A 90 -51.231 -3.474 1.487 1.00 43.15 H new ATOM 0 HB VAL A 90 -49.081 -2.223 2.215 1.00 61.31 H new ATOM 0 HG11 VAL A 90 -50.285 -1.004 3.983 1.00 61.42 H new ATOM 0 HG12 VAL A 90 -51.335 -1.355 2.589 1.00 61.42 H new ATOM 0 HG13 VAL A 90 -51.476 -2.323 4.076 1.00 61.42 H new ATOM 0 HG21 VAL A 90 -48.438 -2.535 4.571 1.00 63.51 H new ATOM 0 HG22 VAL A 90 -49.551 -3.918 4.688 1.00 63.51 H new ATOM 0 HG23 VAL A 90 -48.141 -4.000 3.605 1.00 63.51 H new ATOM 1371 N ARG A 91 -48.786 -3.729 0.308 1.00 25.45 N ATOM 1372 CA ARG A 91 -47.783 -4.219 -0.629 1.00 3.45 C ATOM 1373 C ARG A 91 -46.416 -3.615 -0.328 1.00 15.52 C ATOM 1374 O ARG A 91 -46.270 -2.394 -0.243 1.00 10.53 O ATOM 1375 CB ARG A 91 -48.193 -3.891 -2.067 1.00 35.24 C ATOM 1376 CG ARG A 91 -47.545 -4.792 -3.105 1.00 1.41 C ATOM 1377 CD ARG A 91 -48.261 -6.129 -3.206 1.00 62.05 C ATOM 1378 NE ARG A 91 -48.047 -6.769 -4.502 1.00 32.31 N ATOM 1379 CZ ARG A 91 -48.541 -7.958 -4.825 1.00 62.40 C ATOM 1380 NH1 ARG A 91 -49.274 -8.636 -3.951 1.00 60.23 N1+ ATOM 1381 NH2 ARG A 91 -48.303 -8.473 -6.025 1.00 63.42 N ATOM 0 H ARG A 91 -48.968 -2.727 0.244 1.00 25.45 H new ATOM 0 HA ARG A 91 -47.715 -5.301 -0.516 1.00 3.45 H new ATOM 0 HB2 ARG A 91 -49.277 -3.971 -2.154 1.00 35.24 H new ATOM 0 HB3 ARG A 91 -47.932 -2.855 -2.283 1.00 35.24 H new ATOM 0 HG2 ARG A 91 -47.557 -4.297 -4.076 1.00 1.41 H new ATOM 0 HG3 ARG A 91 -46.500 -4.957 -2.844 1.00 1.41 H new ATOM 0 HD2 ARG A 91 -47.909 -6.789 -2.413 1.00 62.05 H new ATOM 0 HD3 ARG A 91 -49.329 -5.981 -3.047 1.00 62.05 H new ATOM 0 HE ARG A 91 -47.487 -6.275 -5.197 1.00 32.31 H new ATOM 0 HH11 ARG A 91 -49.459 -8.244 -3.028 1.00 60.23 H new ATOM 0 HH12 ARG A 91 -49.652 -9.549 -4.202 1.00 60.23 H new ATOM 0 HH21 ARG A 91 -47.740 -7.955 -6.700 1.00 63.42 H new ATOM 0 HH22 ARG A 91 -48.683 -9.387 -6.272 1.00 63.42 H new ATOM 1395 N ASP A 92 -45.416 -4.475 -0.166 1.00 43.34 N ATOM 1396 CA ASP A 92 -44.060 -4.026 0.126 1.00 22.20 C ATOM 1397 C ASP A 92 -43.287 -3.761 -1.162 1.00 4.24 C ATOM 1398 O ASP A 92 -43.014 -4.679 -1.936 1.00 43.15 O ATOM 1399 CB ASP A 92 -43.326 -5.068 0.972 1.00 42.30 C ATOM 1400 CG ASP A 92 -43.469 -6.470 0.414 1.00 10.14 C ATOM 1401 OD1 ASP A 92 -42.676 -6.839 -0.478 1.00 24.00 O ATOM 1402 OD2 ASP A 92 -44.374 -7.200 0.872 1.00 53.42 O1- ATOM 0 H ASP A 92 -45.519 -5.488 -0.232 1.00 43.34 H new ATOM 0 HA ASP A 92 -44.125 -3.094 0.688 1.00 22.20 H new ATOM 0 HB2 ASP A 92 -42.269 -4.808 1.027 1.00 42.30 H new ATOM 0 HB3 ASP A 92 -43.714 -5.044 1.990 1.00 42.30 H new ATOM 1407 N THR A 93 -42.936 -2.498 -1.386 1.00 3.24 N ATOM 1408 CA THR A 93 -42.196 -2.111 -2.582 1.00 15.11 C ATOM 1409 C THR A 93 -40.820 -1.562 -2.222 1.00 15.23 C ATOM 1410 O THR A 93 -40.171 -0.905 -3.037 1.00 31.43 O ATOM 1411 CB THR A 93 -42.961 -1.053 -3.398 1.00 51.14 C ATOM 1412 OG1 THR A 93 -42.782 0.241 -2.813 1.00 20.55 O ATOM 1413 CG2 THR A 93 -44.445 -1.385 -3.459 1.00 32.22 C ATOM 0 H THR A 93 -43.152 -1.726 -0.755 1.00 3.24 H new ATOM 0 HA THR A 93 -42.079 -3.010 -3.187 1.00 15.11 H new ATOM 0 HB THR A 93 -42.562 -1.052 -4.412 1.00 51.14 H new ATOM 0 HG1 THR A 93 -43.270 0.908 -3.339 1.00 20.55 H new ATOM 0 HG21 THR A 93 -44.965 -0.623 -4.041 1.00 32.22 H new ATOM 0 HG22 THR A 93 -44.581 -2.358 -3.931 1.00 32.22 H new ATOM 0 HG23 THR A 93 -44.854 -1.412 -2.449 1.00 32.22 H new ATOM 1421 N SER A 94 -40.379 -1.837 -0.999 1.00 41.23 N ATOM 1422 CA SER A 94 -39.080 -1.367 -0.531 1.00 71.52 C ATOM 1423 C SER A 94 -37.959 -1.898 -1.418 1.00 43.33 C ATOM 1424 O SER A 94 -38.179 -2.768 -2.263 1.00 3.02 O ATOM 1425 CB SER A 94 -38.849 -1.802 0.917 1.00 20.52 C ATOM 1426 OG SER A 94 -39.698 -1.094 1.804 1.00 2.23 O ATOM 0 H SER A 94 -40.902 -2.383 -0.314 1.00 41.23 H new ATOM 0 HA SER A 94 -39.075 -0.278 -0.581 1.00 71.52 H new ATOM 0 HB2 SER A 94 -39.031 -2.873 1.012 1.00 20.52 H new ATOM 0 HB3 SER A 94 -37.808 -1.630 1.190 1.00 20.52 H new ATOM 0 HG SER A 94 -40.538 -0.875 1.349 1.00 2.23 H new ATOM 1432 N LEU A 95 -36.756 -1.370 -1.221 1.00 11.13 N ATOM 1433 CA LEU A 95 -35.599 -1.789 -2.003 1.00 34.44 C ATOM 1434 C LEU A 95 -35.024 -3.096 -1.466 1.00 62.22 C ATOM 1435 O LEU A 95 -35.115 -3.382 -0.273 1.00 61.44 O ATOM 1436 CB LEU A 95 -34.524 -0.700 -1.985 1.00 53.31 C ATOM 1437 CG LEU A 95 -33.790 -0.504 -0.657 1.00 14.14 C ATOM 1438 CD1 LEU A 95 -32.590 -1.435 -0.569 1.00 71.33 C ATOM 1439 CD2 LEU A 95 -33.357 0.945 -0.496 1.00 61.44 C ATOM 0 H LEU A 95 -36.557 -0.651 -0.526 1.00 11.13 H new ATOM 0 HA LEU A 95 -35.925 -1.951 -3.030 1.00 34.44 H new ATOM 0 HB2 LEU A 95 -33.787 -0.932 -2.754 1.00 53.31 H new ATOM 0 HB3 LEU A 95 -34.988 0.246 -2.264 1.00 53.31 H new ATOM 0 HG LEU A 95 -34.475 -0.749 0.155 1.00 14.14 H new ATOM 0 HD11 LEU A 95 -32.080 -1.282 0.382 1.00 71.33 H new ATOM 0 HD12 LEU A 95 -32.926 -2.470 -0.638 1.00 71.33 H new ATOM 0 HD13 LEU A 95 -31.903 -1.221 -1.388 1.00 71.33 H new ATOM 0 HD21 LEU A 95 -32.837 1.066 0.454 1.00 61.44 H new ATOM 0 HD22 LEU A 95 -32.689 1.218 -1.313 1.00 61.44 H new ATOM 0 HD23 LEU A 95 -34.235 1.591 -0.514 1.00 61.44 H new ATOM 1451 N ARG A 96 -34.430 -3.886 -2.356 1.00 22.20 N ATOM 1452 CA ARG A 96 -33.840 -5.161 -1.972 1.00 2.41 C ATOM 1453 C ARG A 96 -32.336 -5.023 -1.762 1.00 14.45 C ATOM 1454 O ARG A 96 -31.613 -4.568 -2.649 1.00 63.30 O ATOM 1455 CB ARG A 96 -34.122 -6.220 -3.041 1.00 44.25 C ATOM 1456 CG ARG A 96 -35.551 -6.737 -3.024 1.00 63.41 C ATOM 1457 CD ARG A 96 -35.881 -7.422 -1.708 1.00 52.41 C ATOM 1458 NE ARG A 96 -36.969 -8.385 -1.850 1.00 50.34 N ATOM 1459 CZ ARG A 96 -37.267 -9.299 -0.933 1.00 2.41 C ATOM 1460 NH1 ARG A 96 -36.562 -9.372 0.187 1.00 13.23 N1+ ATOM 1461 NH2 ARG A 96 -38.273 -10.140 -1.135 1.00 2.33 N ATOM 0 H ARG A 96 -34.345 -3.664 -3.348 1.00 22.20 H new ATOM 0 HA ARG A 96 -34.293 -5.474 -1.031 1.00 2.41 H new ATOM 0 HB2 ARG A 96 -33.909 -5.798 -4.023 1.00 44.25 H new ATOM 0 HB3 ARG A 96 -33.440 -7.058 -2.899 1.00 44.25 H new ATOM 0 HG2 ARG A 96 -36.240 -5.909 -3.187 1.00 63.41 H new ATOM 0 HG3 ARG A 96 -35.695 -7.438 -3.846 1.00 63.41 H new ATOM 0 HD2 ARG A 96 -34.993 -7.931 -1.332 1.00 52.41 H new ATOM 0 HD3 ARG A 96 -36.156 -6.671 -0.967 1.00 52.41 H new ATOM 0 HE ARG A 96 -37.532 -8.354 -2.700 1.00 50.34 H new ATOM 0 HH11 ARG A 96 -35.789 -8.726 0.346 1.00 13.23 H new ATOM 0 HH12 ARG A 96 -36.792 -10.074 0.890 1.00 13.23 H new ATOM 0 HH21 ARG A 96 -38.819 -10.085 -1.995 1.00 2.33 H new ATOM 0 HH22 ARG A 96 -38.501 -10.841 -0.430 1.00 2.33 H new ATOM 1475 N VAL A 97 -31.870 -5.418 -0.581 1.00 32.32 N ATOM 1476 CA VAL A 97 -30.451 -5.338 -0.254 1.00 32.11 C ATOM 1477 C VAL A 97 -29.817 -6.724 -0.215 1.00 2.42 C ATOM 1478 O VAL A 97 -30.348 -7.660 0.384 1.00 4.01 O ATOM 1479 CB VAL A 97 -30.225 -4.645 1.103 1.00 24.41 C ATOM 1480 CG1 VAL A 97 -28.876 -5.037 1.686 1.00 40.42 C ATOM 1481 CG2 VAL A 97 -30.334 -3.135 0.953 1.00 52.15 C ATOM 0 H VAL A 97 -32.454 -5.796 0.165 1.00 32.32 H new ATOM 0 HA VAL A 97 -29.979 -4.747 -1.039 1.00 32.11 H new ATOM 0 HB VAL A 97 -31.000 -4.975 1.794 1.00 24.41 H new ATOM 0 HG11 VAL A 97 -28.735 -4.537 2.644 1.00 40.42 H new ATOM 0 HG12 VAL A 97 -28.842 -6.117 1.831 1.00 40.42 H new ATOM 0 HG13 VAL A 97 -28.083 -4.738 1.001 1.00 40.42 H new ATOM 0 HG21 VAL A 97 -30.172 -2.661 1.921 1.00 52.15 H new ATOM 0 HG22 VAL A 97 -29.582 -2.784 0.246 1.00 52.15 H new ATOM 0 HG23 VAL A 97 -31.327 -2.877 0.584 1.00 52.15 H new ATOM 1491 N PRO A 98 -28.654 -6.862 -0.869 1.00 12.13 N ATOM 1492 CA PRO A 98 -27.922 -8.130 -0.923 1.00 3.14 C ATOM 1493 C PRO A 98 -27.321 -8.511 0.426 1.00 31.21 C ATOM 1494 O PRO A 98 -27.161 -7.665 1.306 1.00 54.31 O ATOM 1495 CB PRO A 98 -26.814 -7.856 -1.944 1.00 5.32 C ATOM 1496 CG PRO A 98 -26.614 -6.381 -1.900 1.00 31.15 C ATOM 1497 CD PRO A 98 -27.964 -5.789 -1.605 1.00 23.22 C ATOM 0 HA PRO A 98 -28.571 -8.964 -1.190 1.00 3.14 H new ATOM 0 HB2 PRO A 98 -25.898 -8.387 -1.686 1.00 5.32 H new ATOM 0 HB3 PRO A 98 -27.104 -8.186 -2.941 1.00 5.32 H new ATOM 0 HG2 PRO A 98 -25.892 -6.108 -1.131 1.00 31.15 H new ATOM 0 HG3 PRO A 98 -26.225 -6.011 -2.849 1.00 31.15 H new ATOM 0 HD2 PRO A 98 -27.883 -4.881 -1.008 1.00 23.22 H new ATOM 0 HD3 PRO A 98 -28.495 -5.523 -2.519 1.00 23.22 H new ATOM 1505 N HIS A 99 -26.989 -9.789 0.581 1.00 2.03 N ATOM 1506 CA HIS A 99 -26.405 -10.282 1.823 1.00 40.20 C ATOM 1507 C HIS A 99 -25.030 -9.663 2.059 1.00 23.32 C ATOM 1508 O HIS A 99 -24.204 -9.597 1.150 1.00 3.54 O ATOM 1509 CB HIS A 99 -26.292 -11.806 1.789 1.00 10.22 C ATOM 1510 CG HIS A 99 -25.429 -12.319 0.679 1.00 63.35 C ATOM 1511 ND1 HIS A 99 -25.920 -12.645 -0.568 1.00 22.30 N ATOM 1512 CD2 HIS A 99 -24.098 -12.559 0.631 1.00 12.11 C ATOM 1513 CE1 HIS A 99 -24.929 -13.066 -1.333 1.00 51.45 C ATOM 1514 NE2 HIS A 99 -23.812 -13.022 -0.629 1.00 54.33 N ATOM 0 H HIS A 99 -27.115 -10.502 -0.138 1.00 2.03 H new ATOM 0 HA HIS A 99 -27.061 -9.993 2.644 1.00 40.20 H new ATOM 0 HB2 HIS A 99 -25.890 -12.153 2.741 1.00 10.22 H new ATOM 0 HB3 HIS A 99 -27.290 -12.234 1.689 1.00 10.22 H new ATOM 0 HD2 HIS A 99 -23.392 -12.413 1.435 1.00 12.11 H new ATOM 0 HE1 HIS A 99 -25.017 -13.391 -2.359 1.00 51.45 H new ATOM 0 HE2 HIS A 99 -22.887 -13.289 -0.967 1.00 54.33 H new ATOM 1522 N GLY A 100 -24.792 -9.211 3.287 1.00 52.11 N ATOM 1523 CA GLY A 100 -23.518 -8.604 3.620 1.00 34.40 C ATOM 1524 C GLY A 100 -23.476 -7.125 3.289 1.00 32.53 C ATOM 1525 O GLY A 100 -23.103 -6.304 4.126 1.00 13.43 O ATOM 0 H GLY A 100 -25.460 -9.255 4.057 1.00 52.11 H new ATOM 0 HA2 GLY A 100 -23.321 -8.741 4.683 1.00 34.40 H new ATOM 0 HA3 GLY A 100 -22.722 -9.117 3.080 1.00 34.40 H new ATOM 1529 N GLY A 101 -23.857 -6.783 2.061 1.00 3.44 N ATOM 1530 CA GLY A 101 -23.852 -5.394 1.643 1.00 63.32 C ATOM 1531 C GLY A 101 -22.516 -4.966 1.070 1.00 13.11 C ATOM 1532 O GLY A 101 -22.459 -4.161 0.141 1.00 41.12 O ATOM 0 H GLY A 101 -24.169 -7.444 1.349 1.00 3.44 H new ATOM 0 HA2 GLY A 101 -24.630 -5.240 0.896 1.00 63.32 H new ATOM 0 HA3 GLY A 101 -24.098 -4.760 2.495 1.00 63.32 H new ATOM 1536 N GLY A 102 -21.435 -5.505 1.627 1.00 35.30 N ATOM 1537 CA GLY A 102 -20.107 -5.160 1.154 1.00 42.33 C ATOM 1538 C GLY A 102 -19.499 -4.004 1.925 1.00 11.11 C ATOM 1539 O GLY A 102 -18.301 -3.997 2.203 1.00 65.03 O ATOM 0 H GLY A 102 -21.456 -6.174 2.397 1.00 35.30 H new ATOM 0 HA2 GLY A 102 -19.457 -6.031 1.238 1.00 42.33 H new ATOM 0 HA3 GLY A 102 -20.157 -4.901 0.096 1.00 42.33 H new ATOM 1543 N GLY A 103 -20.328 -3.023 2.269 1.00 42.51 N ATOM 1544 CA GLY A 103 -19.847 -1.870 3.006 1.00 70.24 C ATOM 1545 C GLY A 103 -20.735 -1.523 4.185 1.00 14.31 C ATOM 1546 O GLY A 103 -21.476 -2.371 4.683 1.00 75.45 O ATOM 0 H GLY A 103 -21.324 -3.007 2.050 1.00 42.51 H new ATOM 0 HA2 GLY A 103 -18.836 -2.067 3.362 1.00 70.24 H new ATOM 0 HA3 GLY A 103 -19.788 -1.013 2.335 1.00 70.24 H new ATOM 1550 N ILE A 104 -20.661 -0.274 4.632 1.00 10.42 N ATOM 1551 CA ILE A 104 -21.466 0.182 5.758 1.00 73.30 C ATOM 1552 C ILE A 104 -22.089 1.545 5.473 1.00 61.32 C ATOM 1553 O ILE A 104 -21.499 2.376 4.783 1.00 74.25 O ATOM 1554 CB ILE A 104 -20.628 0.273 7.047 1.00 31.42 C ATOM 1555 CG1 ILE A 104 -19.942 -1.064 7.331 1.00 73.31 C ATOM 1556 CG2 ILE A 104 -21.506 0.685 8.221 1.00 75.13 C ATOM 1557 CD1 ILE A 104 -18.926 -0.997 8.450 1.00 42.35 C ATOM 0 H ILE A 104 -20.052 0.440 4.232 1.00 10.42 H new ATOM 0 HA ILE A 104 -22.258 -0.554 5.899 1.00 73.30 H new ATOM 0 HB ILE A 104 -19.858 1.032 6.910 1.00 31.42 H new ATOM 0 HG12 ILE A 104 -20.700 -1.805 7.583 1.00 73.31 H new ATOM 0 HG13 ILE A 104 -19.448 -1.410 6.423 1.00 73.31 H new ATOM 0 HG21 ILE A 104 -20.900 0.745 9.125 1.00 75.13 H new ATOM 0 HG22 ILE A 104 -21.952 1.659 8.018 1.00 75.13 H new ATOM 0 HG23 ILE A 104 -22.295 -0.053 8.362 1.00 75.13 H new ATOM 0 HD11 ILE A 104 -18.480 -1.981 8.596 1.00 42.35 H new ATOM 0 HD12 ILE A 104 -18.147 -0.280 8.192 1.00 42.35 H new ATOM 0 HD13 ILE A 104 -19.418 -0.682 9.370 1.00 42.35 H new ATOM 1569 N ILE A 105 -23.284 1.767 6.010 1.00 72.41 N ATOM 1570 CA ILE A 105 -23.986 3.029 5.815 1.00 11.13 C ATOM 1571 C ILE A 105 -23.236 4.182 6.475 1.00 43.31 C ATOM 1572 O ILE A 105 -23.274 4.345 7.695 1.00 71.54 O ATOM 1573 CB ILE A 105 -25.416 2.971 6.382 1.00 21.24 C ATOM 1574 CG1 ILE A 105 -26.151 1.740 5.847 1.00 33.43 C ATOM 1575 CG2 ILE A 105 -26.177 4.242 6.033 1.00 13.51 C ATOM 1576 CD1 ILE A 105 -26.380 1.776 4.353 1.00 11.11 C ATOM 0 H ILE A 105 -23.786 1.089 6.583 1.00 72.41 H new ATOM 0 HA ILE A 105 -24.037 3.199 4.740 1.00 11.13 H new ATOM 0 HB ILE A 105 -25.357 2.893 7.468 1.00 21.24 H new ATOM 0 HG12 ILE A 105 -25.578 0.847 6.097 1.00 33.43 H new ATOM 0 HG13 ILE A 105 -27.113 1.653 6.352 1.00 33.43 H new ATOM 0 HG21 ILE A 105 -27.186 4.185 6.441 1.00 13.51 H new ATOM 0 HG22 ILE A 105 -25.661 5.103 6.458 1.00 13.51 H new ATOM 0 HG23 ILE A 105 -26.229 4.349 4.950 1.00 13.51 H new ATOM 0 HD11 ILE A 105 -26.906 0.873 4.044 1.00 11.11 H new ATOM 0 HD12 ILE A 105 -26.979 2.650 4.098 1.00 11.11 H new ATOM 0 HD13 ILE A 105 -25.420 1.831 3.839 1.00 11.11 H new ATOM 1588 N HIS A 106 -22.556 4.982 5.659 1.00 44.11 N ATOM 1589 CA HIS A 106 -21.798 6.122 6.162 1.00 34.34 C ATOM 1590 C HIS A 106 -22.520 7.431 5.854 1.00 52.02 C ATOM 1591 O HIS A 106 -22.325 8.434 6.542 1.00 2.51 O ATOM 1592 CB HIS A 106 -20.398 6.142 5.550 1.00 22.33 C ATOM 1593 CG HIS A 106 -19.507 7.198 6.127 1.00 1.11 C ATOM 1594 ND1 HIS A 106 -19.135 8.330 5.434 1.00 2.12 N ATOM 1595 CD2 HIS A 106 -18.913 7.288 7.340 1.00 44.21 C ATOM 1596 CE1 HIS A 106 -18.350 9.072 6.195 1.00 70.15 C ATOM 1597 NE2 HIS A 106 -18.200 8.462 7.358 1.00 4.01 N ATOM 0 H HIS A 106 -22.515 4.862 4.647 1.00 44.11 H new ATOM 0 HA HIS A 106 -21.711 6.020 7.244 1.00 34.34 H new ATOM 0 HB2 HIS A 106 -19.933 5.167 5.695 1.00 22.33 H new ATOM 0 HB3 HIS A 106 -20.483 6.298 4.475 1.00 22.33 H new ATOM 0 HD1 HIS A 106 -19.421 8.559 4.482 1.00 2.12 H new ATOM 0 HD2 HIS A 106 -18.986 6.570 8.144 1.00 44.21 H new ATOM 0 HE1 HIS A 106 -17.907 10.016 5.915 1.00 70.15 H new ATOM 1605 N ASP A 107 -23.351 7.414 4.819 1.00 2.53 N ATOM 1606 CA ASP A 107 -24.100 8.600 4.420 1.00 2.33 C ATOM 1607 C ASP A 107 -25.411 8.211 3.742 1.00 53.53 C ATOM 1608 O ASP A 107 -25.517 7.143 3.139 1.00 42.21 O ATOM 1609 CB ASP A 107 -23.263 9.467 3.481 1.00 13.01 C ATOM 1610 CG ASP A 107 -21.850 9.674 3.988 1.00 51.05 C ATOM 1611 OD1 ASP A 107 -21.676 10.424 4.972 1.00 40.31 O ATOM 1612 OD2 ASP A 107 -20.917 9.084 3.403 1.00 71.12 O1- ATOM 0 H ASP A 107 -23.524 6.592 4.240 1.00 2.53 H new ATOM 0 HA ASP A 107 -24.332 9.173 5.318 1.00 2.33 H new ATOM 0 HB2 ASP A 107 -23.228 9.001 2.496 1.00 13.01 H new ATOM 0 HB3 ASP A 107 -23.747 10.436 3.358 1.00 13.01 H new ATOM 1617 N VAL A 108 -26.407 9.085 3.846 1.00 40.23 N ATOM 1618 CA VAL A 108 -27.710 8.834 3.242 1.00 11.03 C ATOM 1619 C VAL A 108 -28.398 10.138 2.857 1.00 62.13 C ATOM 1620 O VAL A 108 -28.564 11.034 3.684 1.00 23.34 O ATOM 1621 CB VAL A 108 -28.627 8.045 4.195 1.00 20.20 C ATOM 1622 CG1 VAL A 108 -30.008 7.865 3.581 1.00 12.41 C ATOM 1623 CG2 VAL A 108 -28.008 6.700 4.539 1.00 33.40 C ATOM 0 H VAL A 108 -26.336 9.973 4.343 1.00 40.23 H new ATOM 0 HA VAL A 108 -27.534 8.241 2.344 1.00 11.03 H new ATOM 0 HB VAL A 108 -28.738 8.614 5.118 1.00 20.20 H new ATOM 0 HG11 VAL A 108 -30.642 7.305 4.269 1.00 12.41 H new ATOM 0 HG12 VAL A 108 -30.452 8.842 3.392 1.00 12.41 H new ATOM 0 HG13 VAL A 108 -29.920 7.318 2.642 1.00 12.41 H new ATOM 0 HG21 VAL A 108 -28.670 6.157 5.213 1.00 33.40 H new ATOM 0 HG22 VAL A 108 -27.865 6.121 3.626 1.00 33.40 H new ATOM 0 HG23 VAL A 108 -27.045 6.856 5.024 1.00 33.40 H new ATOM 1633 N LYS A 109 -28.796 10.240 1.593 1.00 73.05 N ATOM 1634 CA LYS A 109 -29.468 11.435 1.095 1.00 64.22 C ATOM 1635 C LYS A 109 -30.971 11.202 0.973 1.00 55.52 C ATOM 1636 O LYS A 109 -31.410 10.181 0.446 1.00 53.24 O ATOM 1637 CB LYS A 109 -28.892 11.841 -0.263 1.00 5.12 C ATOM 1638 CG LYS A 109 -27.720 12.804 -0.163 1.00 4.01 C ATOM 1639 CD LYS A 109 -28.177 14.249 -0.271 1.00 43.23 C ATOM 1640 CE LYS A 109 -27.071 15.214 0.131 1.00 25.43 C ATOM 1641 NZ LYS A 109 -27.616 16.468 0.718 1.00 11.23 N1+ ATOM 0 H LYS A 109 -28.665 9.509 0.894 1.00 73.05 H new ATOM 0 HA LYS A 109 -29.299 12.241 1.809 1.00 64.22 H new ATOM 0 HB2 LYS A 109 -28.571 10.945 -0.795 1.00 5.12 H new ATOM 0 HB3 LYS A 109 -29.680 12.301 -0.860 1.00 5.12 H new ATOM 0 HG2 LYS A 109 -27.204 12.654 0.786 1.00 4.01 H new ATOM 0 HG3 LYS A 109 -27.002 12.588 -0.954 1.00 4.01 H new ATOM 0 HD2 LYS A 109 -28.489 14.458 -1.294 1.00 43.23 H new ATOM 0 HD3 LYS A 109 -29.047 14.405 0.366 1.00 43.23 H new ATOM 0 HE2 LYS A 109 -26.413 14.731 0.853 1.00 25.43 H new ATOM 0 HE3 LYS A 109 -26.464 15.455 -0.742 1.00 25.43 H new ATOM 0 HZ1 LYS A 109 -26.831 17.099 0.979 1.00 11.23 H new ATOM 0 HZ2 LYS A 109 -28.224 16.942 0.020 1.00 11.23 H new ATOM 0 HZ3 LYS A 109 -28.174 16.241 1.566 1.00 11.23 H new ATOM 1655 N VAL A 110 -31.754 12.159 1.461 1.00 33.40 N ATOM 1656 CA VAL A 110 -33.207 12.060 1.403 1.00 62.24 C ATOM 1657 C VAL A 110 -33.837 13.401 1.044 1.00 62.33 C ATOM 1658 O VAL A 110 -33.654 14.394 1.750 1.00 72.31 O ATOM 1659 CB VAL A 110 -33.791 11.575 2.744 1.00 4.52 C ATOM 1660 CG1 VAL A 110 -33.326 12.470 3.883 1.00 44.34 C ATOM 1661 CG2 VAL A 110 -35.310 11.527 2.678 1.00 54.34 C ATOM 0 H VAL A 110 -31.406 13.011 1.901 1.00 33.40 H new ATOM 0 HA VAL A 110 -33.442 11.332 0.627 1.00 62.24 H new ATOM 0 HB VAL A 110 -33.427 10.565 2.935 1.00 4.52 H new ATOM 0 HG11 VAL A 110 -33.748 12.113 4.822 1.00 44.34 H new ATOM 0 HG12 VAL A 110 -32.238 12.448 3.942 1.00 44.34 H new ATOM 0 HG13 VAL A 110 -33.658 13.492 3.702 1.00 44.34 H new ATOM 0 HG21 VAL A 110 -35.705 11.182 3.634 1.00 54.34 H new ATOM 0 HG22 VAL A 110 -35.697 12.523 2.464 1.00 54.34 H new ATOM 0 HG23 VAL A 110 -35.618 10.841 1.889 1.00 54.34 H new ATOM 1671 N PHE A 111 -34.579 13.424 -0.058 1.00 31.14 N ATOM 1672 CA PHE A 111 -35.235 14.645 -0.513 1.00 61.30 C ATOM 1673 C PHE A 111 -36.731 14.599 -0.217 1.00 14.04 C ATOM 1674 O PHE A 111 -37.354 13.541 -0.274 1.00 54.20 O ATOM 1675 CB PHE A 111 -35.004 14.845 -2.012 1.00 25.34 C ATOM 1676 CG PHE A 111 -33.588 14.590 -2.440 1.00 21.54 C ATOM 1677 CD1 PHE A 111 -32.537 15.269 -1.846 1.00 61.01 C ATOM 1678 CD2 PHE A 111 -33.307 13.671 -3.438 1.00 34.24 C ATOM 1679 CE1 PHE A 111 -31.232 15.037 -2.237 1.00 62.23 C ATOM 1680 CE2 PHE A 111 -32.004 13.433 -3.834 1.00 44.30 C ATOM 1681 CZ PHE A 111 -30.966 14.119 -3.233 1.00 45.00 C ATOM 0 H PHE A 111 -34.741 12.611 -0.653 1.00 31.14 H new ATOM 0 HA PHE A 111 -34.801 15.486 0.028 1.00 61.30 H new ATOM 0 HB2 PHE A 111 -35.667 14.180 -2.565 1.00 25.34 H new ATOM 0 HB3 PHE A 111 -35.278 15.865 -2.281 1.00 25.34 H new ATOM 0 HD1 PHE A 111 -32.740 15.989 -1.067 1.00 61.01 H new ATOM 0 HD2 PHE A 111 -34.115 13.134 -3.912 1.00 34.24 H new ATOM 0 HE1 PHE A 111 -30.422 15.573 -1.764 1.00 62.23 H new ATOM 0 HE2 PHE A 111 -31.798 12.712 -4.612 1.00 44.30 H new ATOM 0 HZ PHE A 111 -29.947 13.937 -3.542 1.00 45.00 H new ATOM 1691 N ASN A 112 -37.301 15.758 0.098 1.00 50.25 N ATOM 1692 CA ASN A 112 -38.725 15.851 0.402 1.00 72.43 C ATOM 1693 C ASN A 112 -39.371 17.002 -0.364 1.00 13.34 C ATOM 1694 O ASN A 112 -38.820 18.100 -0.436 1.00 60.11 O ATOM 1695 CB ASN A 112 -38.934 16.045 1.906 1.00 64.11 C ATOM 1696 CG ASN A 112 -39.059 14.728 2.646 1.00 42.02 C ATOM 1697 OD1 ASN A 112 -38.145 13.904 2.629 1.00 74.51 O ATOM 1698 ND2 ASN A 112 -40.195 14.524 3.302 1.00 45.40 N ATOM 0 H ASN A 112 -36.800 16.645 0.149 1.00 50.25 H new ATOM 0 HA ASN A 112 -39.199 14.920 0.092 1.00 72.43 H new ATOM 0 HB2 ASN A 112 -38.098 16.611 2.316 1.00 64.11 H new ATOM 0 HB3 ASN A 112 -39.833 16.639 2.072 1.00 64.11 H new ATOM 0 HD21 ASN A 112 -40.337 13.656 3.819 1.00 45.40 H new ATOM 0 HD22 ASN A 112 -40.926 15.235 3.289 1.00 45.40 H new ATOM 1705 N ARG A 113 -40.542 16.740 -0.935 1.00 20.34 N ATOM 1706 CA ARG A 113 -41.264 17.753 -1.697 1.00 53.42 C ATOM 1707 C ARG A 113 -41.509 18.998 -0.850 1.00 54.43 C ATOM 1708 O ARG A 113 -41.633 20.103 -1.377 1.00 33.44 O ATOM 1709 CB ARG A 113 -42.596 17.192 -2.197 1.00 52.52 C ATOM 1710 CG ARG A 113 -43.497 18.238 -2.831 1.00 1.01 C ATOM 1711 CD ARG A 113 -44.679 17.598 -3.544 1.00 10.22 C ATOM 1712 NE ARG A 113 -45.572 18.595 -4.129 1.00 43.12 N ATOM 1713 CZ ARG A 113 -46.707 18.292 -4.746 1.00 21.52 C ATOM 1714 NH1 ARG A 113 -47.088 17.026 -4.859 1.00 31.21 N1+ ATOM 1715 NH2 ARG A 113 -47.466 19.255 -5.251 1.00 54.41 N ATOM 0 H ARG A 113 -41.011 15.836 -0.885 1.00 20.34 H new ATOM 0 HA ARG A 113 -40.651 18.033 -2.554 1.00 53.42 H new ATOM 0 HB2 ARG A 113 -42.399 16.405 -2.925 1.00 52.52 H new ATOM 0 HB3 ARG A 113 -43.122 16.729 -1.362 1.00 52.52 H new ATOM 0 HG2 ARG A 113 -43.860 18.921 -2.063 1.00 1.01 H new ATOM 0 HG3 ARG A 113 -42.922 18.833 -3.540 1.00 1.01 H new ATOM 0 HD2 ARG A 113 -44.313 16.935 -4.328 1.00 10.22 H new ATOM 0 HD3 ARG A 113 -45.237 16.981 -2.839 1.00 10.22 H new ATOM 0 HE ARG A 113 -45.309 19.578 -4.059 1.00 43.12 H new ATOM 0 HH11 ARG A 113 -46.508 16.282 -4.471 1.00 31.21 H new ATOM 0 HH12 ARG A 113 -47.961 16.797 -5.334 1.00 31.21 H new ATOM 0 HH21 ARG A 113 -47.177 20.230 -5.165 1.00 54.41 H new ATOM 0 HH22 ARG A 113 -48.338 19.021 -5.725 1.00 54.41 H new ATOM 1729 N GLU A 114 -41.579 18.809 0.464 1.00 1.14 N ATOM 1730 CA GLU A 114 -41.811 19.918 1.382 1.00 4.11 C ATOM 1731 C GLU A 114 -40.605 20.851 1.425 1.00 41.23 C ATOM 1732 O GLU A 114 -40.732 22.032 1.751 1.00 33.03 O ATOM 1733 CB GLU A 114 -42.112 19.390 2.787 1.00 54.33 C ATOM 1734 CG GLU A 114 -43.579 19.066 3.016 1.00 44.41 C ATOM 1735 CD GLU A 114 -44.389 20.283 3.416 1.00 52.21 C ATOM 1736 OE1 GLU A 114 -44.289 21.318 2.725 1.00 71.42 O ATOM 1737 OE2 GLU A 114 -45.125 20.200 4.421 1.00 73.01 O1- ATOM 0 H GLU A 114 -41.479 17.900 0.916 1.00 1.14 H new ATOM 0 HA GLU A 114 -42.671 20.482 1.021 1.00 4.11 H new ATOM 0 HB2 GLU A 114 -41.519 18.493 2.963 1.00 54.33 H new ATOM 0 HB3 GLU A 114 -41.794 20.131 3.520 1.00 54.33 H new ATOM 0 HG2 GLU A 114 -43.999 18.638 2.106 1.00 44.41 H new ATOM 0 HG3 GLU A 114 -43.663 18.307 3.794 1.00 44.41 H new ATOM 1744 N ASP A 115 -39.437 20.313 1.093 1.00 61.31 N ATOM 1745 CA ASP A 115 -38.207 21.098 1.092 1.00 32.24 C ATOM 1746 C ASP A 115 -38.168 22.046 -0.102 1.00 43.43 C ATOM 1747 O ASP A 115 -37.454 23.048 -0.088 1.00 43.12 O ATOM 1748 CB ASP A 115 -36.988 20.174 1.066 1.00 53.53 C ATOM 1749 CG ASP A 115 -35.742 20.845 1.608 1.00 13.43 C ATOM 1750 OD1 ASP A 115 -35.811 21.421 2.714 1.00 74.43 O ATOM 1751 OD2 ASP A 115 -34.695 20.794 0.927 1.00 32.32 O1- ATOM 0 H ASP A 115 -39.315 19.337 0.821 1.00 61.31 H new ATOM 0 HA ASP A 115 -38.183 21.693 2.005 1.00 32.24 H new ATOM 0 HB2 ASP A 115 -37.200 19.280 1.653 1.00 53.53 H new ATOM 0 HB3 ASP A 115 -36.805 19.847 0.042 1.00 53.53 H new ATOM 1756 N GLY A 116 -38.942 21.723 -1.133 1.00 54.51 N ATOM 1757 CA GLY A 116 -38.980 22.556 -2.321 1.00 23.20 C ATOM 1758 C GLY A 116 -38.287 21.910 -3.504 1.00 2.22 C ATOM 1759 O GLY A 116 -37.871 22.597 -4.439 1.00 55.14 O ATOM 0 H GLY A 116 -39.543 20.900 -1.167 1.00 54.51 H new ATOM 0 HA2 GLY A 116 -40.018 22.765 -2.581 1.00 23.20 H new ATOM 0 HA3 GLY A 116 -38.506 23.514 -2.105 1.00 23.20 H new ATOM 1763 N ASP A 117 -38.160 20.589 -3.465 1.00 71.14 N ATOM 1764 CA ASP A 117 -37.510 19.851 -4.541 1.00 22.33 C ATOM 1765 C ASP A 117 -38.543 19.269 -5.500 1.00 23.13 C ATOM 1766 O ASP A 117 -39.535 18.679 -5.075 1.00 55.15 O ATOM 1767 CB ASP A 117 -36.639 18.731 -3.968 1.00 15.40 C ATOM 1768 CG ASP A 117 -37.433 17.471 -3.682 1.00 11.35 C ATOM 1769 OD1 ASP A 117 -38.441 17.558 -2.948 1.00 73.13 O ATOM 1770 OD2 ASP A 117 -37.046 16.398 -4.190 1.00 42.23 O1- ATOM 0 H ASP A 117 -38.499 20.007 -2.699 1.00 71.14 H new ATOM 0 HA ASP A 117 -36.877 20.545 -5.094 1.00 22.33 H new ATOM 0 HB2 ASP A 117 -35.838 18.501 -4.671 1.00 15.40 H new ATOM 0 HB3 ASP A 117 -36.166 19.076 -3.048 1.00 15.40 H new ATOM 1775 N GLU A 118 -38.302 19.441 -6.797 1.00 12.24 N ATOM 1776 CA GLU A 118 -39.213 18.934 -7.816 1.00 23.12 C ATOM 1777 C GLU A 118 -38.944 17.458 -8.103 1.00 62.43 C ATOM 1778 O GLU A 118 -37.791 17.033 -8.195 1.00 43.24 O ATOM 1779 CB GLU A 118 -39.077 19.747 -9.104 1.00 34.24 C ATOM 1780 CG GLU A 118 -40.290 19.655 -10.014 1.00 62.21 C ATOM 1781 CD GLU A 118 -40.272 18.415 -10.887 1.00 42.54 C ATOM 1782 OE1 GLU A 118 -39.173 17.873 -11.126 1.00 52.30 O ATOM 1783 OE2 GLU A 118 -41.359 17.986 -11.329 1.00 0.43 O1- ATOM 0 H GLU A 118 -37.484 19.927 -7.166 1.00 12.24 H new ATOM 0 HA GLU A 118 -40.230 19.033 -7.437 1.00 23.12 H new ATOM 0 HB2 GLU A 118 -38.905 20.792 -8.847 1.00 34.24 H new ATOM 0 HB3 GLU A 118 -38.198 19.404 -9.649 1.00 34.24 H new ATOM 0 HG2 GLU A 118 -41.195 19.654 -9.407 1.00 62.21 H new ATOM 0 HG3 GLU A 118 -40.332 20.541 -10.648 1.00 62.21 H new ATOM 1790 N LEU A 119 -40.013 16.684 -8.242 1.00 53.45 N ATOM 1791 CA LEU A 119 -39.894 15.256 -8.516 1.00 44.14 C ATOM 1792 C LEU A 119 -40.699 14.871 -9.752 1.00 13.41 C ATOM 1793 O LEU A 119 -41.638 15.560 -10.152 1.00 3.34 O ATOM 1794 CB LEU A 119 -40.367 14.443 -7.311 1.00 54.15 C ATOM 1795 CG LEU A 119 -39.374 14.316 -6.155 1.00 4.14 C ATOM 1796 CD1 LEU A 119 -40.110 14.163 -4.833 1.00 75.22 C ATOM 1797 CD2 LEU A 119 -38.435 13.140 -6.385 1.00 64.10 C ATOM 0 H LEU A 119 -40.973 17.021 -8.170 1.00 53.45 H new ATOM 0 HA LEU A 119 -38.844 15.034 -8.705 1.00 44.14 H new ATOM 0 HB2 LEU A 119 -41.282 14.896 -6.929 1.00 54.15 H new ATOM 0 HB3 LEU A 119 -40.626 13.441 -7.653 1.00 54.15 H new ATOM 0 HG LEU A 119 -38.778 15.228 -6.111 1.00 4.14 H new ATOM 0 HD11 LEU A 119 -39.387 14.074 -4.022 1.00 75.22 H new ATOM 0 HD12 LEU A 119 -40.739 15.037 -4.664 1.00 75.22 H new ATOM 0 HD13 LEU A 119 -40.732 13.268 -4.864 1.00 75.22 H new ATOM 0 HD21 LEU A 119 -37.735 13.065 -5.553 1.00 64.10 H new ATOM 0 HD22 LEU A 119 -39.015 12.220 -6.456 1.00 64.10 H new ATOM 0 HD23 LEU A 119 -37.881 13.292 -7.312 1.00 64.10 H new ATOM 1809 N PRO A 120 -40.328 13.740 -10.372 1.00 20.10 N ATOM 1810 CA PRO A 120 -41.006 13.236 -11.571 1.00 0.40 C ATOM 1811 C PRO A 120 -42.411 12.725 -11.270 1.00 11.03 C ATOM 1812 O PRO A 120 -42.797 12.540 -10.116 1.00 42.43 O ATOM 1813 CB PRO A 120 -40.106 12.086 -12.029 1.00 45.01 C ATOM 1814 CG PRO A 120 -39.406 11.636 -10.793 1.00 75.10 C ATOM 1815 CD PRO A 120 -39.219 12.868 -9.951 1.00 64.30 C ATOM 0 HA PRO A 120 -41.141 14.015 -12.321 1.00 0.40 H new ATOM 0 HB2 PRO A 120 -40.690 11.278 -12.470 1.00 45.01 H new ATOM 0 HB3 PRO A 120 -39.396 12.417 -12.787 1.00 45.01 H new ATOM 0 HG2 PRO A 120 -39.993 10.886 -10.263 1.00 75.10 H new ATOM 0 HG3 PRO A 120 -38.446 11.178 -11.033 1.00 75.10 H new ATOM 0 HD2 PRO A 120 -39.270 12.639 -8.887 1.00 64.30 H new ATOM 0 HD3 PRO A 120 -38.250 13.334 -10.131 1.00 64.30 H new ATOM 1823 N PRO A 121 -43.196 12.491 -12.332 1.00 13.45 N ATOM 1824 CA PRO A 121 -44.571 11.997 -12.207 1.00 63.41 C ATOM 1825 C PRO A 121 -44.626 10.552 -11.724 1.00 74.12 C ATOM 1826 O PRO A 121 -43.996 9.669 -12.303 1.00 70.11 O ATOM 1827 CB PRO A 121 -45.117 12.106 -13.633 1.00 51.31 C ATOM 1828 CG PRO A 121 -43.914 12.031 -14.507 1.00 10.41 C ATOM 1829 CD PRO A 121 -42.801 12.689 -13.737 1.00 53.13 C ATOM 0 HA PRO A 121 -45.143 12.564 -11.472 1.00 63.41 H new ATOM 0 HB2 PRO A 121 -45.816 11.299 -13.852 1.00 51.31 H new ATOM 0 HB3 PRO A 121 -45.655 13.042 -13.780 1.00 51.31 H new ATOM 0 HG2 PRO A 121 -43.667 10.996 -14.743 1.00 10.41 H new ATOM 0 HG3 PRO A 121 -44.088 12.541 -15.455 1.00 10.41 H new ATOM 0 HD2 PRO A 121 -41.837 12.229 -13.952 1.00 53.13 H new ATOM 0 HD3 PRO A 121 -42.712 13.747 -13.984 1.00 53.13 H new ATOM 1837 N GLY A 122 -45.385 10.317 -10.658 1.00 43.21 N ATOM 1838 CA GLY A 122 -45.509 8.978 -10.115 1.00 45.50 C ATOM 1839 C GLY A 122 -44.678 8.780 -8.862 1.00 61.31 C ATOM 1840 O GLY A 122 -44.807 7.766 -8.176 1.00 64.21 O ATOM 0 H GLY A 122 -45.917 11.031 -10.161 1.00 43.21 H new ATOM 0 HA2 GLY A 122 -46.556 8.777 -9.888 1.00 45.50 H new ATOM 0 HA3 GLY A 122 -45.201 8.254 -10.869 1.00 45.50 H new ATOM 1844 N VAL A 123 -43.822 9.752 -8.563 1.00 20.12 N ATOM 1845 CA VAL A 123 -42.965 9.680 -7.386 1.00 30.11 C ATOM 1846 C VAL A 123 -43.426 10.658 -6.311 1.00 42.43 C ATOM 1847 O VAL A 123 -43.774 11.801 -6.606 1.00 35.02 O ATOM 1848 CB VAL A 123 -41.496 9.978 -7.740 1.00 72.33 C ATOM 1849 CG1 VAL A 123 -40.624 9.918 -6.495 1.00 14.23 C ATOM 1850 CG2 VAL A 123 -40.997 9.008 -8.799 1.00 34.10 C ATOM 0 H VAL A 123 -43.704 10.598 -9.120 1.00 20.12 H new ATOM 0 HA VAL A 123 -43.038 8.662 -7.004 1.00 30.11 H new ATOM 0 HB VAL A 123 -41.435 10.987 -8.148 1.00 72.33 H new ATOM 0 HG11 VAL A 123 -39.590 10.131 -6.765 1.00 14.23 H new ATOM 0 HG12 VAL A 123 -40.970 10.657 -5.772 1.00 14.23 H new ATOM 0 HG13 VAL A 123 -40.686 8.923 -6.055 1.00 14.23 H new ATOM 0 HG21 VAL A 123 -39.957 9.233 -9.037 1.00 34.10 H new ATOM 0 HG22 VAL A 123 -41.070 7.988 -8.422 1.00 34.10 H new ATOM 0 HG23 VAL A 123 -41.605 9.107 -9.698 1.00 34.10 H new ATOM 1860 N ASN A 124 -43.425 10.201 -5.063 1.00 33.12 N ATOM 1861 CA ASN A 124 -43.843 11.037 -3.943 1.00 53.53 C ATOM 1862 C ASN A 124 -42.642 11.466 -3.106 1.00 53.12 C ATOM 1863 O ASN A 124 -42.640 12.546 -2.516 1.00 73.13 O ATOM 1864 CB ASN A 124 -44.847 10.286 -3.066 1.00 43.21 C ATOM 1865 CG ASN A 124 -46.163 10.038 -3.777 1.00 42.43 C ATOM 1866 OD1 ASN A 124 -46.508 10.737 -4.730 1.00 73.31 O ATOM 1867 ND2 ASN A 124 -46.907 9.040 -3.315 1.00 3.04 N ATOM 0 H ASN A 124 -43.140 9.257 -4.802 1.00 33.12 H new ATOM 0 HA ASN A 124 -44.320 11.930 -4.347 1.00 53.53 H new ATOM 0 HB2 ASN A 124 -44.417 9.332 -2.761 1.00 43.21 H new ATOM 0 HB3 ASN A 124 -45.031 10.858 -2.157 1.00 43.21 H new ATOM 0 HD21 ASN A 124 -47.803 8.827 -3.753 1.00 3.04 H new ATOM 0 HD22 ASN A 124 -46.582 8.486 -2.522 1.00 3.04 H new ATOM 1874 N GLN A 125 -41.623 10.614 -3.062 1.00 42.31 N ATOM 1875 CA GLN A 125 -40.416 10.906 -2.298 1.00 61.22 C ATOM 1876 C GLN A 125 -39.184 10.319 -2.980 1.00 32.52 C ATOM 1877 O GLN A 125 -39.298 9.502 -3.894 1.00 3.53 O ATOM 1878 CB GLN A 125 -40.540 10.351 -0.878 1.00 74.32 C ATOM 1879 CG GLN A 125 -41.304 11.263 0.068 1.00 12.52 C ATOM 1880 CD GLN A 125 -42.565 10.619 0.609 1.00 12.21 C ATOM 1881 OE1 GLN A 125 -42.850 10.693 1.804 1.00 35.21 O ATOM 1882 NE2 GLN A 125 -43.329 9.981 -0.271 1.00 13.11 N ATOM 0 H GLN A 125 -41.609 9.716 -3.546 1.00 42.31 H new ATOM 0 HA GLN A 125 -40.300 11.989 -2.249 1.00 61.22 H new ATOM 0 HB2 GLN A 125 -41.039 9.383 -0.918 1.00 74.32 H new ATOM 0 HB3 GLN A 125 -39.542 10.179 -0.476 1.00 74.32 H new ATOM 0 HG2 GLN A 125 -40.657 11.541 0.900 1.00 12.52 H new ATOM 0 HG3 GLN A 125 -41.566 12.184 -0.454 1.00 12.52 H new ATOM 0 HE21 GLN A 125 -43.055 9.944 -1.253 1.00 13.11 H new ATOM 0 HE22 GLN A 125 -44.190 9.528 0.035 1.00 13.11 H new ATOM 1891 N LEU A 126 -38.008 10.742 -2.531 1.00 13.13 N ATOM 1892 CA LEU A 126 -36.754 10.259 -3.099 1.00 42.24 C ATOM 1893 C LEU A 126 -35.674 10.158 -2.027 1.00 22.01 C ATOM 1894 O LEU A 126 -35.390 11.129 -1.324 1.00 4.43 O ATOM 1895 CB LEU A 126 -36.289 11.187 -4.222 1.00 14.10 C ATOM 1896 CG LEU A 126 -35.311 10.582 -5.231 1.00 62.41 C ATOM 1897 CD1 LEU A 126 -33.972 10.295 -4.570 1.00 34.22 C ATOM 1898 CD2 LEU A 126 -35.891 9.313 -5.840 1.00 54.24 C ATOM 0 H LEU A 126 -37.896 11.418 -1.776 1.00 13.13 H new ATOM 0 HA LEU A 126 -36.928 9.264 -3.508 1.00 42.24 H new ATOM 0 HB2 LEU A 126 -37.168 11.538 -4.763 1.00 14.10 H new ATOM 0 HB3 LEU A 126 -35.821 12.063 -3.772 1.00 14.10 H new ATOM 0 HG LEU A 126 -35.150 11.305 -6.031 1.00 62.41 H new ATOM 0 HD11 LEU A 126 -33.289 9.865 -5.303 1.00 34.22 H new ATOM 0 HD12 LEU A 126 -33.551 11.223 -4.183 1.00 34.22 H new ATOM 0 HD13 LEU A 126 -34.114 9.591 -3.750 1.00 34.22 H new ATOM 0 HD21 LEU A 126 -35.182 8.896 -6.555 1.00 54.24 H new ATOM 0 HD22 LEU A 126 -36.081 8.585 -5.051 1.00 54.24 H new ATOM 0 HD23 LEU A 126 -36.825 9.548 -6.350 1.00 54.24 H new ATOM 1910 N VAL A 127 -35.073 8.979 -1.907 1.00 20.53 N ATOM 1911 CA VAL A 127 -34.022 8.753 -0.923 1.00 45.13 C ATOM 1912 C VAL A 127 -32.993 7.751 -1.438 1.00 1.10 C ATOM 1913 O VAL A 127 -33.347 6.676 -1.921 1.00 14.25 O ATOM 1914 CB VAL A 127 -34.600 8.239 0.409 1.00 20.41 C ATOM 1915 CG1 VAL A 127 -35.456 7.004 0.178 1.00 10.03 C ATOM 1916 CG2 VAL A 127 -33.481 7.946 1.397 1.00 54.52 C ATOM 0 H VAL A 127 -35.296 8.165 -2.480 1.00 20.53 H new ATOM 0 HA VAL A 127 -33.537 9.714 -0.753 1.00 45.13 H new ATOM 0 HB VAL A 127 -35.235 9.017 0.834 1.00 20.41 H new ATOM 0 HG11 VAL A 127 -35.856 6.655 1.130 1.00 10.03 H new ATOM 0 HG12 VAL A 127 -36.279 7.252 -0.492 1.00 10.03 H new ATOM 0 HG13 VAL A 127 -34.848 6.218 -0.270 1.00 10.03 H new ATOM 0 HG21 VAL A 127 -33.907 7.584 2.333 1.00 54.52 H new ATOM 0 HG22 VAL A 127 -32.819 7.186 0.982 1.00 54.52 H new ATOM 0 HG23 VAL A 127 -32.914 8.858 1.586 1.00 54.52 H new ATOM 1926 N ARG A 128 -31.718 8.113 -1.331 1.00 4.20 N ATOM 1927 CA ARG A 128 -30.638 7.246 -1.786 1.00 61.44 C ATOM 1928 C ARG A 128 -29.695 6.902 -0.636 1.00 20.05 C ATOM 1929 O ARG A 128 -29.590 7.649 0.337 1.00 44.24 O ATOM 1930 CB ARG A 128 -29.858 7.919 -2.917 1.00 53.24 C ATOM 1931 CG ARG A 128 -30.727 8.335 -4.092 1.00 2.30 C ATOM 1932 CD ARG A 128 -30.081 9.455 -4.893 1.00 44.25 C ATOM 1933 NE ARG A 128 -30.655 9.573 -6.231 1.00 42.20 N ATOM 1934 CZ ARG A 128 -30.271 10.485 -7.117 1.00 12.20 C ATOM 1935 NH1 ARG A 128 -29.316 11.352 -6.810 1.00 23.30 N1+ ATOM 1936 NH2 ARG A 128 -30.842 10.530 -8.314 1.00 64.11 N ATOM 0 H ARG A 128 -31.408 9.000 -0.934 1.00 4.20 H new ATOM 0 HA ARG A 128 -31.080 6.322 -2.159 1.00 61.44 H new ATOM 0 HB2 ARG A 128 -29.349 8.799 -2.523 1.00 53.24 H new ATOM 0 HB3 ARG A 128 -29.086 7.236 -3.271 1.00 53.24 H new ATOM 0 HG2 ARG A 128 -30.900 7.476 -4.740 1.00 2.30 H new ATOM 0 HG3 ARG A 128 -31.701 8.661 -3.728 1.00 2.30 H new ATOM 0 HD2 ARG A 128 -30.204 10.399 -4.361 1.00 44.25 H new ATOM 0 HD3 ARG A 128 -29.009 9.272 -4.973 1.00 44.25 H new ATOM 0 HE ARG A 128 -31.391 8.920 -6.500 1.00 42.20 H new ATOM 0 HH11 ARG A 128 -28.874 11.320 -5.891 1.00 23.30 H new ATOM 0 HH12 ARG A 128 -29.023 12.051 -7.493 1.00 23.30 H new ATOM 0 HH21 ARG A 128 -31.576 9.864 -8.554 1.00 64.11 H new ATOM 0 HH22 ARG A 128 -30.547 11.231 -8.994 1.00 64.11 H new ATOM 1950 N VAL A 129 -29.012 5.768 -0.756 1.00 61.44 N ATOM 1951 CA VAL A 129 -28.077 5.327 0.272 1.00 71.52 C ATOM 1952 C VAL A 129 -26.646 5.322 -0.252 1.00 13.23 C ATOM 1953 O VAL A 129 -26.412 5.148 -1.449 1.00 34.03 O ATOM 1954 CB VAL A 129 -28.431 3.917 0.783 1.00 44.32 C ATOM 1955 CG1 VAL A 129 -27.591 3.566 2.002 1.00 3.32 C ATOM 1956 CG2 VAL A 129 -29.915 3.823 1.103 1.00 62.34 C ATOM 0 H VAL A 129 -29.089 5.138 -1.555 1.00 61.44 H new ATOM 0 HA VAL A 129 -28.155 6.035 1.097 1.00 71.52 H new ATOM 0 HB VAL A 129 -28.207 3.197 -0.004 1.00 44.32 H new ATOM 0 HG11 VAL A 129 -27.854 2.567 2.350 1.00 3.32 H new ATOM 0 HG12 VAL A 129 -26.534 3.591 1.735 1.00 3.32 H new ATOM 0 HG13 VAL A 129 -27.782 4.288 2.796 1.00 3.32 H new ATOM 0 HG21 VAL A 129 -30.147 2.820 1.462 1.00 62.34 H new ATOM 0 HG22 VAL A 129 -30.168 4.552 1.873 1.00 62.34 H new ATOM 0 HG23 VAL A 129 -30.495 4.029 0.203 1.00 62.34 H new ATOM 1966 N TYR A 130 -25.690 5.512 0.651 1.00 2.33 N ATOM 1967 CA TYR A 130 -24.281 5.531 0.278 1.00 2.11 C ATOM 1968 C TYR A 130 -23.489 4.509 1.090 1.00 50.21 C ATOM 1969 O TYR A 130 -23.333 4.651 2.303 1.00 35.14 O ATOM 1970 CB TYR A 130 -23.695 6.929 0.489 1.00 54.22 C ATOM 1971 CG TYR A 130 -24.217 7.957 -0.490 1.00 50.10 C ATOM 1972 CD1 TYR A 130 -25.559 8.318 -0.499 1.00 41.25 C ATOM 1973 CD2 TYR A 130 -23.368 8.568 -1.404 1.00 64.34 C ATOM 1974 CE1 TYR A 130 -26.040 9.257 -1.391 1.00 42.45 C ATOM 1975 CE2 TYR A 130 -23.840 9.508 -2.300 1.00 13.34 C ATOM 1976 CZ TYR A 130 -25.176 9.849 -2.290 1.00 23.14 C ATOM 1977 OH TYR A 130 -25.651 10.784 -3.179 1.00 43.15 O ATOM 0 H TYR A 130 -25.865 5.655 1.646 1.00 2.33 H new ATOM 0 HA TYR A 130 -24.207 5.268 -0.777 1.00 2.11 H new ATOM 0 HB2 TYR A 130 -23.919 7.259 1.503 1.00 54.22 H new ATOM 0 HB3 TYR A 130 -22.610 6.876 0.403 1.00 54.22 H new ATOM 0 HD1 TYR A 130 -26.237 7.857 0.203 1.00 41.25 H new ATOM 0 HD2 TYR A 130 -22.321 8.304 -1.414 1.00 64.34 H new ATOM 0 HE1 TYR A 130 -27.086 9.526 -1.385 1.00 42.45 H new ATOM 0 HE2 TYR A 130 -23.166 9.973 -3.004 1.00 13.34 H new ATOM 0 HH TYR A 130 -24.915 11.104 -3.741 1.00 43.15 H new ATOM 1987 N ILE A 131 -22.993 3.482 0.410 1.00 62.14 N ATOM 1988 CA ILE A 131 -22.217 2.437 1.067 1.00 14.52 C ATOM 1989 C ILE A 131 -20.787 2.401 0.538 1.00 32.22 C ATOM 1990 O ILE A 131 -20.560 2.321 -0.669 1.00 50.11 O ATOM 1991 CB ILE A 131 -22.859 1.050 0.870 1.00 53.44 C ATOM 1992 CG1 ILE A 131 -24.106 0.913 1.745 1.00 75.34 C ATOM 1993 CG2 ILE A 131 -21.857 -0.048 1.190 1.00 74.22 C ATOM 1994 CD1 ILE A 131 -25.400 1.107 0.988 1.00 41.20 C ATOM 0 H ILE A 131 -23.114 3.351 -0.594 1.00 62.14 H new ATOM 0 HA ILE A 131 -22.204 2.675 2.131 1.00 14.52 H new ATOM 0 HB ILE A 131 -23.157 0.949 -0.173 1.00 53.44 H new ATOM 0 HG12 ILE A 131 -24.109 -0.074 2.207 1.00 75.34 H new ATOM 0 HG13 ILE A 131 -24.055 1.643 2.553 1.00 75.34 H new ATOM 0 HG21 ILE A 131 -22.326 -1.022 1.046 1.00 74.22 H new ATOM 0 HG22 ILE A 131 -20.996 0.041 0.528 1.00 74.22 H new ATOM 0 HG23 ILE A 131 -21.530 0.048 2.226 1.00 74.22 H new ATOM 0 HD11 ILE A 131 -26.242 0.996 1.672 1.00 41.20 H new ATOM 0 HD12 ILE A 131 -25.419 2.104 0.549 1.00 41.20 H new ATOM 0 HD13 ILE A 131 -25.474 0.361 0.197 1.00 41.20 H new ATOM 2006 N VAL A 132 -19.822 2.460 1.452 1.00 41.23 N ATOM 2007 CA VAL A 132 -18.414 2.432 1.080 1.00 34.34 C ATOM 2008 C VAL A 132 -17.794 1.070 1.375 1.00 0.01 C ATOM 2009 O VAL A 132 -18.061 0.470 2.416 1.00 51.31 O ATOM 2010 CB VAL A 132 -17.615 3.519 1.823 1.00 61.21 C ATOM 2011 CG1 VAL A 132 -18.176 4.899 1.517 1.00 1.22 C ATOM 2012 CG2 VAL A 132 -17.620 3.253 3.321 1.00 73.24 C ATOM 0 H VAL A 132 -19.991 2.528 2.456 1.00 41.23 H new ATOM 0 HA VAL A 132 -18.366 2.625 0.008 1.00 34.34 H new ATOM 0 HB VAL A 132 -16.583 3.488 1.474 1.00 61.21 H new ATOM 0 HG11 VAL A 132 -17.598 5.653 2.051 1.00 1.22 H new ATOM 0 HG12 VAL A 132 -18.115 5.087 0.445 1.00 1.22 H new ATOM 0 HG13 VAL A 132 -19.217 4.947 1.835 1.00 1.22 H new ATOM 0 HG21 VAL A 132 -17.051 4.031 3.831 1.00 73.24 H new ATOM 0 HG22 VAL A 132 -18.647 3.255 3.688 1.00 73.24 H new ATOM 0 HG23 VAL A 132 -17.166 2.282 3.520 1.00 73.24 H new ATOM 2022 N GLN A 133 -16.966 0.591 0.452 1.00 42.41 N ATOM 2023 CA GLN A 133 -16.309 -0.701 0.614 1.00 12.41 C ATOM 2024 C GLN A 133 -14.925 -0.534 1.232 1.00 54.20 C ATOM 2025 O GLN A 133 -14.038 0.079 0.638 1.00 2.20 O ATOM 2026 CB GLN A 133 -16.196 -1.411 -0.736 1.00 71.20 C ATOM 2027 CG GLN A 133 -17.431 -2.216 -1.106 1.00 14.21 C ATOM 2028 CD GLN A 133 -18.716 -1.434 -0.915 1.00 65.31 C ATOM 2029 OE1 GLN A 133 -19.603 -1.847 -0.167 1.00 73.53 O ATOM 2030 NE2 GLN A 133 -18.822 -0.297 -1.592 1.00 12.32 N ATOM 0 H GLN A 133 -16.734 1.077 -0.414 1.00 42.41 H new ATOM 0 HA GLN A 133 -16.916 -1.308 1.286 1.00 12.41 H new ATOM 0 HB2 GLN A 133 -16.010 -0.669 -1.513 1.00 71.20 H new ATOM 0 HB3 GLN A 133 -15.332 -2.075 -0.716 1.00 71.20 H new ATOM 0 HG2 GLN A 133 -17.355 -2.534 -2.146 1.00 14.21 H new ATOM 0 HG3 GLN A 133 -17.466 -3.120 -0.498 1.00 14.21 H new ATOM 0 HE21 GLN A 133 -18.062 0.007 -2.201 1.00 12.32 H new ATOM 0 HE22 GLN A 133 -19.663 0.273 -1.504 1.00 12.32 H new ATOM 2039 N LYS A 134 -14.747 -1.082 2.429 1.00 12.52 N ATOM 2040 CA LYS A 134 -13.471 -0.996 3.129 1.00 43.01 C ATOM 2041 C LYS A 134 -12.885 -2.384 3.365 1.00 3.21 C ATOM 2042 O LYS A 134 -13.609 -3.379 3.381 1.00 43.24 O ATOM 2043 CB LYS A 134 -13.647 -0.269 4.465 1.00 4.32 C ATOM 2044 CG LYS A 134 -14.430 1.027 4.354 1.00 31.52 C ATOM 2045 CD LYS A 134 -14.484 1.761 5.684 1.00 15.52 C ATOM 2046 CE LYS A 134 -15.172 0.928 6.753 1.00 55.02 C ATOM 2047 NZ LYS A 134 -15.750 1.778 7.831 1.00 1.44 N1+ ATOM 0 H LYS A 134 -15.471 -1.591 2.935 1.00 12.52 H new ATOM 0 HA LYS A 134 -12.779 -0.431 2.504 1.00 43.01 H new ATOM 0 HB2 LYS A 134 -14.155 -0.932 5.165 1.00 4.32 H new ATOM 0 HB3 LYS A 134 -12.664 -0.055 4.885 1.00 4.32 H new ATOM 0 HG2 LYS A 134 -13.970 1.668 3.602 1.00 31.52 H new ATOM 0 HG3 LYS A 134 -15.443 0.813 4.014 1.00 31.52 H new ATOM 0 HD2 LYS A 134 -13.472 2.005 6.007 1.00 15.52 H new ATOM 0 HD3 LYS A 134 -15.015 2.704 5.559 1.00 15.52 H new ATOM 0 HE2 LYS A 134 -15.963 0.332 6.297 1.00 55.02 H new ATOM 0 HE3 LYS A 134 -14.456 0.229 7.186 1.00 55.02 H new ATOM 0 HZ1 LYS A 134 -16.210 1.173 8.541 1.00 1.44 H new ATOM 0 HZ2 LYS A 134 -14.992 2.328 8.284 1.00 1.44 H new ATOM 0 HZ3 LYS A 134 -16.452 2.428 7.422 1.00 1.44 H new ATOM 2061 N ARG A 135 -11.570 -2.442 3.551 1.00 73.21 N ATOM 2062 CA ARG A 135 -10.888 -3.709 3.788 1.00 2.23 C ATOM 2063 C ARG A 135 -9.854 -3.569 4.901 1.00 4.34 C ATOM 2064 O ARG A 135 -9.165 -2.553 5.001 1.00 70.31 O ATOM 2065 CB ARG A 135 -10.209 -4.194 2.505 1.00 24.23 C ATOM 2066 CG ARG A 135 -11.177 -4.442 1.360 1.00 61.24 C ATOM 2067 CD ARG A 135 -11.917 -5.759 1.533 1.00 61.52 C ATOM 2068 NE ARG A 135 -12.707 -6.103 0.353 1.00 65.45 N ATOM 2069 CZ ARG A 135 -13.402 -7.228 0.236 1.00 44.11 C ATOM 2070 NH1 ARG A 135 -13.405 -8.115 1.222 1.00 2.13 N1+ ATOM 2071 NH2 ARG A 135 -14.096 -7.469 -0.869 1.00 1.42 N ATOM 0 H ARG A 135 -10.956 -1.627 3.542 1.00 73.21 H new ATOM 0 HA ARG A 135 -11.633 -4.442 4.097 1.00 2.23 H new ATOM 0 HB2 ARG A 135 -9.472 -3.455 2.192 1.00 24.23 H new ATOM 0 HB3 ARG A 135 -9.667 -5.115 2.717 1.00 24.23 H new ATOM 0 HG2 ARG A 135 -11.895 -3.624 1.305 1.00 61.24 H new ATOM 0 HG3 ARG A 135 -10.632 -4.451 0.416 1.00 61.24 H new ATOM 0 HD2 ARG A 135 -11.199 -6.554 1.733 1.00 61.52 H new ATOM 0 HD3 ARG A 135 -12.572 -5.695 2.402 1.00 61.52 H new ATOM 0 HE ARG A 135 -12.726 -5.442 -0.424 1.00 65.45 H new ATOM 0 HH11 ARG A 135 -12.872 -7.934 2.073 1.00 2.13 H new ATOM 0 HH12 ARG A 135 -13.940 -8.979 1.130 1.00 2.13 H new ATOM 0 HH21 ARG A 135 -14.096 -6.790 -1.630 1.00 1.42 H new ATOM 0 HH22 ARG A 135 -14.630 -8.334 -0.958 1.00 1.42 H new ATOM 2085 N LYS A 136 -9.750 -4.597 5.737 1.00 75.34 N ATOM 2086 CA LYS A 136 -8.801 -4.591 6.843 1.00 14.01 C ATOM 2087 C LYS A 136 -7.500 -5.281 6.448 1.00 71.32 C ATOM 2088 O LYS A 136 -7.507 -6.252 5.691 1.00 71.05 O ATOM 2089 CB LYS A 136 -9.407 -5.284 8.067 1.00 52.34 C ATOM 2090 CG LYS A 136 -10.315 -4.385 8.887 1.00 44.13 C ATOM 2091 CD LYS A 136 -9.531 -3.603 9.928 1.00 43.40 C ATOM 2092 CE LYS A 136 -9.185 -4.468 11.131 1.00 63.11 C ATOM 2093 NZ LYS A 136 -10.403 -4.931 11.851 1.00 55.42 N1+ ATOM 0 H LYS A 136 -10.312 -5.445 5.669 1.00 75.34 H new ATOM 0 HA LYS A 136 -8.580 -3.553 7.093 1.00 14.01 H new ATOM 0 HB2 LYS A 136 -9.973 -6.155 7.738 1.00 52.34 H new ATOM 0 HB3 LYS A 136 -8.601 -5.650 8.703 1.00 52.34 H new ATOM 0 HG2 LYS A 136 -10.836 -3.692 8.226 1.00 44.13 H new ATOM 0 HG3 LYS A 136 -11.077 -4.988 9.381 1.00 44.13 H new ATOM 0 HD2 LYS A 136 -8.615 -3.217 9.481 1.00 43.40 H new ATOM 0 HD3 LYS A 136 -10.115 -2.742 10.253 1.00 43.40 H new ATOM 0 HE2 LYS A 136 -8.607 -5.332 10.803 1.00 63.11 H new ATOM 0 HE3 LYS A 136 -8.552 -3.902 11.815 1.00 63.11 H new ATOM 0 HZ1 LYS A 136 -10.157 -5.166 12.834 1.00 55.42 H new ATOM 0 HZ2 LYS A 136 -11.118 -4.176 11.845 1.00 55.42 H new ATOM 0 HZ3 LYS A 136 -10.786 -5.775 11.378 1.00 55.42 H new ATOM 2107 N ILE A 137 -6.386 -4.775 6.966 1.00 30.52 N ATOM 2108 CA ILE A 137 -5.077 -5.345 6.668 1.00 4.50 C ATOM 2109 C ILE A 137 -5.065 -6.850 6.912 1.00 42.20 C ATOM 2110 O ILE A 137 -5.851 -7.367 7.707 1.00 34.34 O ATOM 2111 CB ILE A 137 -3.971 -4.690 7.515 1.00 24.31 C ATOM 2112 CG1 ILE A 137 -4.291 -4.829 9.005 1.00 34.43 C ATOM 2113 CG2 ILE A 137 -3.811 -3.225 7.136 1.00 52.43 C ATOM 2114 CD1 ILE A 137 -3.788 -6.118 9.614 1.00 4.14 C ATOM 0 H ILE A 137 -6.363 -3.972 7.594 1.00 30.52 H new ATOM 0 HA ILE A 137 -4.880 -5.148 5.614 1.00 4.50 H new ATOM 0 HB ILE A 137 -3.029 -5.201 7.315 1.00 24.31 H new ATOM 0 HG12 ILE A 137 -3.853 -3.988 9.542 1.00 34.43 H new ATOM 0 HG13 ILE A 137 -5.370 -4.768 9.144 1.00 34.43 H new ATOM 0 HG21 ILE A 137 -3.025 -2.776 7.744 1.00 52.43 H new ATOM 0 HG22 ILE A 137 -3.543 -3.149 6.082 1.00 52.43 H new ATOM 0 HG23 ILE A 137 -4.750 -2.699 7.310 1.00 52.43 H new ATOM 0 HD11 ILE A 137 -4.051 -6.148 10.671 1.00 4.14 H new ATOM 0 HD12 ILE A 137 -4.246 -6.965 9.103 1.00 4.14 H new ATOM 0 HD13 ILE A 137 -2.705 -6.172 9.508 1.00 4.14 H new ATOM 2126 N SER A 138 -4.168 -7.550 6.225 1.00 33.30 N ATOM 2127 CA SER A 138 -4.054 -8.996 6.366 1.00 12.12 C ATOM 2128 C SER A 138 -3.694 -9.376 7.799 1.00 23.35 C ATOM 2129 O SER A 138 -2.665 -8.950 8.325 1.00 14.03 O ATOM 2130 CB SER A 138 -3.000 -9.542 5.401 1.00 33.30 C ATOM 2131 OG SER A 138 -2.773 -10.923 5.623 1.00 33.15 O ATOM 0 H SER A 138 -3.509 -7.138 5.564 1.00 33.30 H new ATOM 0 HA SER A 138 -5.021 -9.437 6.124 1.00 12.12 H new ATOM 0 HB2 SER A 138 -3.327 -9.384 4.373 1.00 33.30 H new ATOM 0 HB3 SER A 138 -2.067 -8.992 5.527 1.00 33.30 H new ATOM 0 HG SER A 138 -2.097 -11.249 4.993 1.00 33.15 H new ATOM 2137 N GLU A 139 -4.548 -10.179 8.425 1.00 73.41 N ATOM 2138 CA GLU A 139 -4.321 -10.616 9.797 1.00 32.15 C ATOM 2139 C GLU A 139 -4.008 -12.108 9.849 1.00 5.54 C ATOM 2140 O GLU A 139 -4.675 -12.869 10.549 1.00 63.51 O ATOM 2141 CB GLU A 139 -5.544 -10.309 10.664 1.00 31.35 C ATOM 2142 CG GLU A 139 -5.276 -10.414 12.155 1.00 73.33 C ATOM 2143 CD GLU A 139 -6.522 -10.754 12.950 1.00 40.35 C ATOM 2144 OE1 GLU A 139 -7.158 -11.786 12.643 1.00 55.44 O ATOM 2145 OE2 GLU A 139 -6.863 -9.991 13.876 1.00 25.42 O1- ATOM 0 H GLU A 139 -5.404 -10.540 8.004 1.00 73.41 H new ATOM 0 HA GLU A 139 -3.463 -10.069 10.187 1.00 32.15 H new ATOM 0 HB2 GLU A 139 -5.896 -9.303 10.437 1.00 31.35 H new ATOM 0 HB3 GLU A 139 -6.348 -10.996 10.399 1.00 31.35 H new ATOM 0 HG2 GLU A 139 -4.518 -11.177 12.331 1.00 73.33 H new ATOM 0 HG3 GLU A 139 -4.867 -9.470 12.514 1.00 73.33 H new ATOM 2152 N GLY A 140 -2.989 -12.520 9.101 1.00 65.11 N ATOM 2153 CA GLY A 140 -2.607 -13.920 9.074 1.00 41.24 C ATOM 2154 C GLY A 140 -2.907 -14.578 7.742 1.00 43.02 C ATOM 2155 O GLY A 140 -2.320 -15.605 7.402 1.00 23.34 O ATOM 0 H GLY A 140 -2.421 -11.909 8.513 1.00 65.11 H new ATOM 0 HA2 GLY A 140 -1.541 -14.007 9.287 1.00 41.24 H new ATOM 0 HA3 GLY A 140 -3.134 -14.452 9.866 1.00 41.24 H new ATOM 2159 N ASP A 141 -3.827 -13.988 6.987 1.00 63.32 N ATOM 2160 CA ASP A 141 -4.206 -14.524 5.684 1.00 33.42 C ATOM 2161 C ASP A 141 -3.967 -13.495 4.583 1.00 14.14 C ATOM 2162 O ASP A 141 -3.420 -13.817 3.528 1.00 20.30 O ATOM 2163 CB ASP A 141 -5.675 -14.949 5.692 1.00 74.13 C ATOM 2164 CG ASP A 141 -5.866 -16.359 6.217 1.00 34.21 C ATOM 2165 OD1 ASP A 141 -5.793 -16.547 7.449 1.00 41.30 O ATOM 2166 OD2 ASP A 141 -6.088 -17.274 5.396 1.00 23.22 O1- ATOM 0 H ASP A 141 -4.324 -13.139 7.254 1.00 63.32 H new ATOM 0 HA ASP A 141 -3.584 -15.396 5.482 1.00 33.42 H new ATOM 0 HB2 ASP A 141 -6.248 -14.255 6.307 1.00 74.13 H new ATOM 0 HB3 ASP A 141 -6.075 -14.884 4.680 1.00 74.13 H new TER 2171 ASP A 141