USER MOD reduce.3.24.130724 H: found=0, std=0, add=1087, rem=0, adj=20 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+ 131:sc= 0.128 (180deg=-1.72) USER MOD Set 1.2: A 93 THR OG1 : rot -40:sc= -0.0171 USER MOD Set 2.1: A 20 THR OG1 : rot 180:sc= 0.036 USER MOD Set 2.2: A 21 LYS NZ :NH3+ -128:sc= 0.767 (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= 0.051 USER MOD Single : A 9 HIS : no HD1:sc= -0.536 X(o=-0.54,f=-0.21) USER MOD Single : A 13 TYR OH : rot 30:sc= 0 USER MOD Single : A 15 SER OG : rot -84:sc= -2.59! USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.0487 USER MOD Single : A 33 ASN : amide:sc= -0.0389 X(o=-0.039,f=-0.039) USER MOD Single : A 41 ASN : amide:sc=-0.00668 X(o=-0.0067,f=-0.025) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0.002 USER MOD Single : A 67 LYS NZ :NH3+ -120:sc= -0.0389 (180deg=-0.512) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 THR OG1 : rot 180:sc= -0.133 USER MOD Single : A 80 HIS : no HE2:sc= -0.41 K(o=-0.41,f=-1.1) USER MOD Single : A 86 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.00914) USER MOD Single : A 94 SER OG : rot 70:sc= -0.589 USER MOD Single : A 99 HIS : no HD1:sc= -0.458 X(o=-0.46,f=-0.28) USER MOD Single : A 106 HIS : no HD1:sc= -0.278 X(o=-0.28,f=0) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 ASN : amide:sc= 0.175 X(o=0.17,f=-0.015) USER MOD Single : A 124 ASN : amide:sc= 1.11 K(o=1.1,f=-1.3) USER MOD Single : A 125 GLN : amide:sc= -5.74 X(o=-5.7,f=-6!) USER MOD Single : A 130 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 GLN : amide:sc= -0.973 X(o=-0.97,f=-1) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ -146:sc=0.000773 (180deg=-0.373) USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 3 -18.119 -11.004 4.288 1.00 63.21 N ATOM 2 CA ASP A 3 -17.722 -9.829 3.521 1.00 1.10 C ATOM 3 C ASP A 3 -16.453 -10.106 2.721 1.00 54.11 C ATOM 4 O ASP A 3 -15.683 -11.008 3.051 1.00 24.32 O ATOM 5 CB ASP A 3 -17.501 -8.636 4.453 1.00 23.13 C ATOM 6 CG ASP A 3 -18.793 -8.140 5.074 1.00 5.44 C ATOM 7 OD1 ASP A 3 -19.549 -7.427 4.381 1.00 40.21 O ATOM 8 OD2 ASP A 3 -19.047 -8.464 6.252 1.00 10.33 O1- ATOM 0 HA ASP A 3 -18.526 -9.592 2.824 1.00 1.10 H new ATOM 0 HB2 ASP A 3 -16.807 -8.920 5.244 1.00 23.13 H new ATOM 0 HB3 ASP A 3 -17.034 -7.824 3.895 1.00 23.13 H new ATOM 13 N VAL A 4 -16.242 -9.325 1.666 1.00 1.21 N ATOM 14 CA VAL A 4 -15.068 -9.486 0.818 1.00 45.01 C ATOM 15 C VAL A 4 -14.267 -8.191 0.736 1.00 4.33 C ATOM 16 O VAL A 4 -14.829 -7.097 0.791 1.00 12.14 O ATOM 17 CB VAL A 4 -15.459 -9.926 -0.605 1.00 11.04 C ATOM 18 CG1 VAL A 4 -16.305 -8.858 -1.281 1.00 11.12 C ATOM 19 CG2 VAL A 4 -14.217 -10.234 -1.427 1.00 24.21 C ATOM 0 H VAL A 4 -16.870 -8.574 1.379 1.00 1.21 H new ATOM 0 HA VAL A 4 -14.453 -10.262 1.274 1.00 45.01 H new ATOM 0 HB VAL A 4 -16.055 -10.836 -0.534 1.00 11.04 H new ATOM 0 HG11 VAL A 4 -16.572 -9.187 -2.285 1.00 11.12 H new ATOM 0 HG12 VAL A 4 -17.213 -8.692 -0.701 1.00 11.12 H new ATOM 0 HG13 VAL A 4 -15.738 -7.929 -1.342 1.00 11.12 H new ATOM 0 HG21 VAL A 4 -14.512 -10.543 -2.430 1.00 24.21 H new ATOM 0 HG22 VAL A 4 -13.593 -9.343 -1.491 1.00 24.21 H new ATOM 0 HG23 VAL A 4 -13.655 -11.037 -0.950 1.00 24.21 H new ATOM 29 N TYR A 5 -12.952 -8.322 0.602 1.00 14.41 N ATOM 30 CA TYR A 5 -12.074 -7.162 0.515 1.00 14.11 C ATOM 31 C TYR A 5 -11.789 -6.804 -0.942 1.00 34.31 C ATOM 32 O TYR A 5 -11.137 -7.560 -1.663 1.00 3.50 O ATOM 33 CB TYR A 5 -10.761 -7.433 1.251 1.00 22.13 C ATOM 34 CG TYR A 5 -10.950 -8.061 2.613 1.00 23.14 C ATOM 35 CD1 TYR A 5 -11.322 -7.293 3.709 1.00 4.24 C ATOM 36 CD2 TYR A 5 -10.757 -9.424 2.804 1.00 11.34 C ATOM 37 CE1 TYR A 5 -11.495 -7.864 4.956 1.00 42.42 C ATOM 38 CE2 TYR A 5 -10.929 -10.003 4.046 1.00 71.45 C ATOM 39 CZ TYR A 5 -11.297 -9.218 5.119 1.00 3.24 C ATOM 40 OH TYR A 5 -11.470 -9.790 6.359 1.00 3.20 O ATOM 0 H TYR A 5 -12.471 -9.220 0.551 1.00 14.41 H new ATOM 0 HA TYR A 5 -12.579 -6.319 0.986 1.00 14.11 H new ATOM 0 HB2 TYR A 5 -10.141 -8.089 0.640 1.00 22.13 H new ATOM 0 HB3 TYR A 5 -10.217 -6.495 1.365 1.00 22.13 H new ATOM 0 HD1 TYR A 5 -11.479 -6.232 3.585 1.00 4.24 H new ATOM 0 HD2 TYR A 5 -10.467 -10.041 1.966 1.00 11.34 H new ATOM 0 HE1 TYR A 5 -11.784 -7.252 5.798 1.00 42.42 H new ATOM 0 HE2 TYR A 5 -10.776 -11.064 4.176 1.00 71.45 H new ATOM 0 HH TYR A 5 -11.293 -10.752 6.303 1.00 3.20 H new ATOM 50 N THR A 6 -12.281 -5.644 -1.366 1.00 71.00 N ATOM 51 CA THR A 6 -12.080 -5.185 -2.734 1.00 14.31 C ATOM 52 C THR A 6 -11.510 -3.771 -2.761 1.00 73.50 C ATOM 53 O THR A 6 -11.193 -3.199 -1.719 1.00 43.33 O ATOM 54 CB THR A 6 -13.396 -5.210 -3.534 1.00 51.52 C ATOM 55 OG1 THR A 6 -14.333 -4.289 -2.965 1.00 70.22 O ATOM 56 CG2 THR A 6 -13.995 -6.609 -3.546 1.00 71.11 C ATOM 0 H THR A 6 -12.821 -5.006 -0.782 1.00 71.00 H new ATOM 0 HA THR A 6 -11.369 -5.870 -3.196 1.00 14.31 H new ATOM 0 HB THR A 6 -13.177 -4.917 -4.561 1.00 51.52 H new ATOM 0 HG1 THR A 6 -15.166 -4.310 -3.480 1.00 70.22 H new ATOM 0 HG21 THR A 6 -14.924 -6.602 -4.117 1.00 71.11 H new ATOM 0 HG22 THR A 6 -13.291 -7.302 -4.006 1.00 71.11 H new ATOM 0 HG23 THR A 6 -14.200 -6.926 -2.523 1.00 71.11 H new ATOM 64 N SER A 7 -11.384 -3.212 -3.961 1.00 24.13 N ATOM 65 CA SER A 7 -10.849 -1.865 -4.124 1.00 4.43 C ATOM 66 C SER A 7 -11.704 -0.846 -3.377 1.00 34.24 C ATOM 67 O SER A 7 -12.637 -1.211 -2.660 1.00 13.42 O ATOM 68 CB SER A 7 -10.777 -1.498 -5.607 1.00 10.54 C ATOM 69 OG SER A 7 -10.550 -2.646 -6.406 1.00 74.54 O ATOM 0 H SER A 7 -11.645 -3.671 -4.834 1.00 24.13 H new ATOM 0 HA SER A 7 -9.844 -1.847 -3.703 1.00 4.43 H new ATOM 0 HB2 SER A 7 -11.707 -1.017 -5.911 1.00 10.54 H new ATOM 0 HB3 SER A 7 -9.977 -0.775 -5.768 1.00 10.54 H new ATOM 0 HG SER A 7 -10.510 -2.385 -7.350 1.00 74.54 H new ATOM 75 N ILE A 8 -11.381 0.430 -3.552 1.00 55.43 N ATOM 76 CA ILE A 8 -12.120 1.502 -2.895 1.00 25.01 C ATOM 77 C ILE A 8 -13.210 2.055 -3.807 1.00 21.43 C ATOM 78 O ILE A 8 -12.921 2.677 -4.831 1.00 13.54 O ATOM 79 CB ILE A 8 -11.186 2.652 -2.473 1.00 54.34 C ATOM 80 CG1 ILE A 8 -10.091 2.131 -1.539 1.00 4.33 C ATOM 81 CG2 ILE A 8 -11.983 3.759 -1.798 1.00 52.02 C ATOM 82 CD1 ILE A 8 -8.855 1.652 -2.267 1.00 12.02 C ATOM 0 H ILE A 8 -10.613 0.748 -4.143 1.00 55.43 H new ATOM 0 HA ILE A 8 -12.578 1.072 -2.004 1.00 25.01 H new ATOM 0 HB ILE A 8 -10.712 3.063 -3.364 1.00 54.34 H new ATOM 0 HG12 ILE A 8 -9.810 2.923 -0.844 1.00 4.33 H new ATOM 0 HG13 ILE A 8 -10.492 1.311 -0.943 1.00 4.33 H new ATOM 0 HG21 ILE A 8 -11.310 4.565 -1.505 1.00 52.02 H new ATOM 0 HG22 ILE A 8 -12.730 4.144 -2.492 1.00 52.02 H new ATOM 0 HG23 ILE A 8 -12.480 3.362 -0.913 1.00 52.02 H new ATOM 0 HD11 ILE A 8 -8.121 1.297 -1.543 1.00 12.02 H new ATOM 0 HD12 ILE A 8 -9.122 0.839 -2.942 1.00 12.02 H new ATOM 0 HD13 ILE A 8 -8.429 2.475 -2.841 1.00 12.02 H new ATOM 94 N HIS A 9 -14.463 1.828 -3.427 1.00 22.41 N ATOM 95 CA HIS A 9 -15.597 2.307 -4.210 1.00 40.14 C ATOM 96 C HIS A 9 -16.850 2.407 -3.344 1.00 0.44 C ATOM 97 O HIS A 9 -16.941 1.773 -2.293 1.00 31.34 O ATOM 98 CB HIS A 9 -15.856 1.376 -5.394 1.00 13.31 C ATOM 99 CG HIS A 9 -15.127 1.775 -6.640 1.00 14.24 C ATOM 100 ND1 HIS A 9 -14.650 0.865 -7.559 1.00 60.14 N ATOM 101 CD2 HIS A 9 -14.798 2.998 -7.120 1.00 65.44 C ATOM 102 CE1 HIS A 9 -14.057 1.509 -8.547 1.00 42.51 C ATOM 103 NE2 HIS A 9 -14.134 2.805 -8.306 1.00 14.34 N ATOM 0 H HIS A 9 -14.719 1.316 -2.583 1.00 22.41 H new ATOM 0 HA HIS A 9 -15.354 3.301 -4.585 1.00 40.14 H new ATOM 0 HB2 HIS A 9 -15.563 0.363 -5.120 1.00 13.31 H new ATOM 0 HB3 HIS A 9 -16.926 1.353 -5.600 1.00 13.31 H new ATOM 0 HD2 HIS A 9 -15.017 3.948 -6.656 1.00 65.44 H new ATOM 0 HE1 HIS A 9 -13.588 1.053 -9.407 1.00 42.51 H new ATOM 0 HE2 HIS A 9 -13.761 3.543 -8.904 1.00 14.34 H new ATOM 111 N ILE A 10 -17.810 3.209 -3.793 1.00 62.41 N ATOM 112 CA ILE A 10 -19.056 3.392 -3.060 1.00 5.23 C ATOM 113 C ILE A 10 -20.249 2.896 -3.870 1.00 41.15 C ATOM 114 O ILE A 10 -20.292 3.054 -5.089 1.00 13.04 O ATOM 115 CB ILE A 10 -19.279 4.871 -2.691 1.00 51.44 C ATOM 116 CG1 ILE A 10 -18.181 5.354 -1.741 1.00 72.52 C ATOM 117 CG2 ILE A 10 -20.652 5.058 -2.062 1.00 54.40 C ATOM 118 CD1 ILE A 10 -18.252 6.835 -1.439 1.00 33.02 C ATOM 0 H ILE A 10 -17.748 3.742 -4.660 1.00 62.41 H new ATOM 0 HA ILE A 10 -18.973 2.806 -2.145 1.00 5.23 H new ATOM 0 HB ILE A 10 -19.233 5.469 -3.601 1.00 51.44 H new ATOM 0 HG12 ILE A 10 -18.249 4.797 -0.806 1.00 72.52 H new ATOM 0 HG13 ILE A 10 -17.208 5.127 -2.177 1.00 72.52 H new ATOM 0 HG21 ILE A 10 -20.795 6.108 -1.807 1.00 54.40 H new ATOM 0 HG22 ILE A 10 -21.421 4.748 -2.769 1.00 54.40 H new ATOM 0 HG23 ILE A 10 -20.724 4.452 -1.159 1.00 54.40 H new ATOM 0 HD11 ILE A 10 -17.444 7.107 -0.760 1.00 33.02 H new ATOM 0 HD12 ILE A 10 -18.153 7.400 -2.366 1.00 33.02 H new ATOM 0 HD13 ILE A 10 -19.210 7.066 -0.974 1.00 33.02 H new ATOM 130 N GLU A 11 -21.216 2.297 -3.182 1.00 14.33 N ATOM 131 CA GLU A 11 -22.411 1.779 -3.838 1.00 21.25 C ATOM 132 C GLU A 11 -23.446 2.883 -4.036 1.00 42.40 C ATOM 133 O GLU A 11 -23.310 3.978 -3.491 1.00 51.11 O ATOM 134 CB GLU A 11 -23.016 0.638 -3.019 1.00 50.43 C ATOM 135 CG GLU A 11 -22.691 -0.743 -3.566 1.00 44.11 C ATOM 136 CD GLU A 11 -23.436 -1.050 -4.850 1.00 11.42 C ATOM 137 OE1 GLU A 11 -24.637 -1.385 -4.774 1.00 55.02 O ATOM 138 OE2 GLU A 11 -22.817 -0.957 -5.931 1.00 31.51 O1- ATOM 0 H GLU A 11 -21.195 2.159 -2.172 1.00 14.33 H new ATOM 0 HA GLU A 11 -22.120 1.399 -4.817 1.00 21.25 H new ATOM 0 HB2 GLU A 11 -22.655 0.707 -1.993 1.00 50.43 H new ATOM 0 HB3 GLU A 11 -24.099 0.761 -2.985 1.00 50.43 H new ATOM 0 HG2 GLU A 11 -21.618 -0.816 -3.746 1.00 44.11 H new ATOM 0 HG3 GLU A 11 -22.940 -1.495 -2.817 1.00 44.11 H new ATOM 145 N GLU A 12 -24.479 2.585 -4.817 1.00 22.22 N ATOM 146 CA GLU A 12 -25.537 3.552 -5.086 1.00 35.34 C ATOM 147 C GLU A 12 -26.900 2.868 -5.139 1.00 30.44 C ATOM 148 O GLU A 12 -27.182 2.092 -6.052 1.00 41.32 O ATOM 149 CB GLU A 12 -25.267 4.281 -6.404 1.00 64.20 C ATOM 150 CG GLU A 12 -25.055 3.346 -7.584 1.00 75.35 C ATOM 151 CD GLU A 12 -24.431 4.045 -8.776 1.00 25.02 C ATOM 152 OE1 GLU A 12 -24.731 5.239 -8.988 1.00 51.50 O ATOM 153 OE2 GLU A 12 -23.643 3.398 -9.497 1.00 22.11 O1- ATOM 0 H GLU A 12 -24.606 1.682 -5.274 1.00 22.22 H new ATOM 0 HA GLU A 12 -25.547 4.278 -4.273 1.00 35.34 H new ATOM 0 HB2 GLU A 12 -26.105 4.943 -6.622 1.00 64.20 H new ATOM 0 HB3 GLU A 12 -24.385 4.911 -6.287 1.00 64.20 H new ATOM 0 HG2 GLU A 12 -24.416 2.518 -7.277 1.00 75.35 H new ATOM 0 HG3 GLU A 12 -26.012 2.917 -7.879 1.00 75.35 H new ATOM 160 N TYR A 13 -27.740 3.161 -4.154 1.00 22.50 N ATOM 161 CA TYR A 13 -29.072 2.573 -4.085 1.00 61.54 C ATOM 162 C TYR A 13 -30.149 3.640 -4.258 1.00 2.15 C ATOM 163 O TYR A 13 -30.033 4.745 -3.730 1.00 12.31 O ATOM 164 CB TYR A 13 -29.265 1.849 -2.751 1.00 3.33 C ATOM 165 CG TYR A 13 -28.506 0.545 -2.654 1.00 52.40 C ATOM 166 CD1 TYR A 13 -27.149 0.528 -2.360 1.00 2.40 C ATOM 167 CD2 TYR A 13 -29.149 -0.671 -2.855 1.00 44.14 C ATOM 168 CE1 TYR A 13 -26.452 -0.661 -2.271 1.00 40.42 C ATOM 169 CE2 TYR A 13 -28.460 -1.865 -2.766 1.00 2.10 C ATOM 170 CZ TYR A 13 -27.111 -1.855 -2.475 1.00 52.02 C ATOM 171 OH TYR A 13 -26.421 -3.041 -2.386 1.00 41.41 O ATOM 0 H TYR A 13 -27.522 3.803 -3.392 1.00 22.50 H new ATOM 0 HA TYR A 13 -29.166 1.853 -4.898 1.00 61.54 H new ATOM 0 HB2 TYR A 13 -28.947 2.506 -1.941 1.00 3.33 H new ATOM 0 HB3 TYR A 13 -30.327 1.653 -2.604 1.00 3.33 H new ATOM 0 HD1 TYR A 13 -26.630 1.461 -2.198 1.00 2.40 H new ATOM 0 HD2 TYR A 13 -30.204 -0.682 -3.084 1.00 44.14 H new ATOM 0 HE1 TYR A 13 -25.396 -0.656 -2.043 1.00 40.42 H new ATOM 0 HE2 TYR A 13 -28.974 -2.802 -2.923 1.00 2.10 H new ATOM 0 HH TYR A 13 -25.683 -2.943 -1.749 1.00 41.41 H new ATOM 181 N GLU A 14 -31.196 3.299 -5.002 1.00 51.13 N ATOM 182 CA GLU A 14 -32.294 4.227 -5.246 1.00 44.05 C ATOM 183 C GLU A 14 -33.592 3.709 -4.632 1.00 34.43 C ATOM 184 O GLU A 14 -33.793 2.501 -4.507 1.00 43.23 O ATOM 185 CB GLU A 14 -32.481 4.448 -6.749 1.00 41.01 C ATOM 186 CG GLU A 14 -32.830 5.881 -7.115 1.00 63.43 C ATOM 187 CD GLU A 14 -32.680 6.157 -8.598 1.00 53.14 C ATOM 188 OE1 GLU A 14 -31.531 6.167 -9.086 1.00 2.11 O ATOM 189 OE2 GLU A 14 -33.712 6.364 -9.270 1.00 40.11 O1- ATOM 0 H GLU A 14 -31.307 2.388 -5.446 1.00 51.13 H new ATOM 0 HA GLU A 14 -32.043 5.177 -4.775 1.00 44.05 H new ATOM 0 HB2 GLU A 14 -31.565 4.163 -7.266 1.00 41.01 H new ATOM 0 HB3 GLU A 14 -33.270 3.788 -7.109 1.00 41.01 H new ATOM 0 HG2 GLU A 14 -33.856 6.090 -6.812 1.00 63.43 H new ATOM 0 HG3 GLU A 14 -32.188 6.562 -6.556 1.00 63.43 H new ATOM 196 N SER A 15 -34.469 4.631 -4.250 1.00 45.22 N ATOM 197 CA SER A 15 -35.745 4.269 -3.645 1.00 21.12 C ATOM 198 C SER A 15 -36.700 5.458 -3.641 1.00 40.40 C ATOM 199 O SER A 15 -36.507 6.420 -2.898 1.00 61.11 O ATOM 200 CB SER A 15 -35.532 3.766 -2.217 1.00 50.55 C ATOM 201 OG SER A 15 -36.375 2.663 -1.932 1.00 60.35 O ATOM 0 H SER A 15 -34.319 5.635 -4.349 1.00 45.22 H new ATOM 0 HA SER A 15 -36.188 3.471 -4.241 1.00 21.12 H new ATOM 0 HB2 SER A 15 -34.490 3.475 -2.082 1.00 50.55 H new ATOM 0 HB3 SER A 15 -35.732 4.572 -1.511 1.00 50.55 H new ATOM 0 HG SER A 15 -37.257 2.988 -1.654 1.00 60.35 H new ATOM 207 N GLU A 16 -37.733 5.383 -4.474 1.00 11.34 N ATOM 208 CA GLU A 16 -38.719 6.453 -4.567 1.00 40.23 C ATOM 209 C GLU A 16 -40.135 5.902 -4.427 1.00 3.23 C ATOM 210 O GLU A 16 -40.479 4.885 -5.028 1.00 64.35 O ATOM 211 CB GLU A 16 -38.578 7.193 -5.899 1.00 4.30 C ATOM 212 CG GLU A 16 -39.145 6.430 -7.083 1.00 43.20 C ATOM 213 CD GLU A 16 -38.524 6.850 -8.401 1.00 63.23 C ATOM 214 OE1 GLU A 16 -37.563 7.647 -8.377 1.00 62.45 O ATOM 215 OE2 GLU A 16 -38.998 6.380 -9.456 1.00 71.20 O1- ATOM 0 H GLU A 16 -37.909 4.592 -5.094 1.00 11.34 H new ATOM 0 HA GLU A 16 -38.537 7.151 -3.750 1.00 40.23 H new ATOM 0 HB2 GLU A 16 -39.081 8.157 -5.824 1.00 4.30 H new ATOM 0 HB3 GLU A 16 -37.523 7.398 -6.081 1.00 4.30 H new ATOM 0 HG2 GLU A 16 -38.983 5.363 -6.933 1.00 43.20 H new ATOM 0 HG3 GLU A 16 -40.223 6.586 -7.128 1.00 43.20 H new ATOM 222 N ALA A 17 -40.952 6.581 -3.629 1.00 45.31 N ATOM 223 CA ALA A 17 -42.331 6.162 -3.409 1.00 31.31 C ATOM 224 C ALA A 17 -43.194 6.453 -4.633 1.00 53.14 C ATOM 225 O ALA A 17 -43.667 7.574 -4.816 1.00 52.54 O ATOM 226 CB ALA A 17 -42.903 6.850 -2.180 1.00 33.40 C ATOM 0 H ALA A 17 -40.682 7.425 -3.123 1.00 45.31 H new ATOM 0 HA ALA A 17 -42.336 5.085 -3.242 1.00 31.31 H new ATOM 0 HB1 ALA A 17 -43.933 6.527 -2.029 1.00 33.40 H new ATOM 0 HB2 ALA A 17 -42.308 6.587 -1.306 1.00 33.40 H new ATOM 0 HB3 ALA A 17 -42.879 7.930 -2.323 1.00 33.40 H new ATOM 232 N ARG A 18 -43.394 5.437 -5.465 1.00 33.11 N ATOM 233 CA ARG A 18 -44.198 5.586 -6.673 1.00 74.51 C ATOM 234 C ARG A 18 -45.680 5.393 -6.364 1.00 1.22 C ATOM 235 O ARG A 18 -46.050 4.555 -5.541 1.00 0.43 O ATOM 236 CB ARG A 18 -43.753 4.579 -7.735 1.00 24.01 C ATOM 237 CG ARG A 18 -42.276 4.675 -8.084 1.00 71.34 C ATOM 238 CD ARG A 18 -41.916 3.757 -9.241 1.00 21.32 C ATOM 239 NE ARG A 18 -42.751 4.001 -10.413 1.00 34.15 N ATOM 240 CZ ARG A 18 -42.916 3.121 -11.395 1.00 3.12 C ATOM 241 NH1 ARG A 18 -42.306 1.945 -11.344 1.00 25.32 N1+ ATOM 242 NH2 ARG A 18 -43.692 3.416 -12.430 1.00 33.24 N ATOM 0 H ARG A 18 -43.011 4.502 -5.326 1.00 33.11 H new ATOM 0 HA ARG A 18 -44.051 6.596 -7.056 1.00 74.51 H new ATOM 0 HB2 ARG A 18 -43.969 3.571 -7.381 1.00 24.01 H new ATOM 0 HB3 ARG A 18 -44.342 4.733 -8.639 1.00 24.01 H new ATOM 0 HG2 ARG A 18 -42.029 5.704 -8.344 1.00 71.34 H new ATOM 0 HG3 ARG A 18 -41.677 4.414 -7.211 1.00 71.34 H new ATOM 0 HD2 ARG A 18 -40.869 3.901 -9.506 1.00 21.32 H new ATOM 0 HD3 ARG A 18 -42.026 2.719 -8.928 1.00 21.32 H new ATOM 0 HE ARG A 18 -43.235 4.896 -10.482 1.00 34.15 H new ATOM 0 HH11 ARG A 18 -41.709 1.714 -10.550 1.00 25.32 H new ATOM 0 HH12 ARG A 18 -42.434 1.271 -12.099 1.00 25.32 H new ATOM 0 HH21 ARG A 18 -44.163 4.320 -12.473 1.00 33.24 H new ATOM 0 HH22 ARG A 18 -43.817 2.739 -13.183 1.00 33.24 H new ATOM 256 N ASP A 19 -46.524 6.175 -7.030 1.00 32.20 N ATOM 257 CA ASP A 19 -47.965 6.091 -6.828 1.00 41.34 C ATOM 258 C ASP A 19 -48.518 4.787 -7.396 1.00 44.41 C ATOM 259 O ASP A 19 -48.252 4.435 -8.546 1.00 5.35 O ATOM 260 CB ASP A 19 -48.664 7.284 -7.483 1.00 22.55 C ATOM 261 CG ASP A 19 -48.326 8.596 -6.804 1.00 73.34 C ATOM 262 OD1 ASP A 19 -48.611 8.729 -5.594 1.00 3.01 O ATOM 263 OD2 ASP A 19 -47.777 9.490 -7.481 1.00 24.34 O1- ATOM 0 H ASP A 19 -46.234 6.874 -7.714 1.00 32.20 H new ATOM 0 HA ASP A 19 -48.159 6.111 -5.755 1.00 41.34 H new ATOM 0 HB2 ASP A 19 -48.378 7.337 -8.533 1.00 22.55 H new ATOM 0 HB3 ASP A 19 -49.743 7.130 -7.454 1.00 22.55 H new ATOM 268 N THR A 20 -49.289 4.073 -6.582 1.00 61.12 N ATOM 269 CA THR A 20 -49.879 2.808 -7.002 1.00 12.12 C ATOM 270 C THR A 20 -51.164 3.033 -7.790 1.00 54.32 C ATOM 271 O THR A 20 -51.702 4.140 -7.816 1.00 54.42 O ATOM 272 CB THR A 20 -50.183 1.901 -5.793 1.00 40.23 C ATOM 273 OG1 THR A 20 -50.683 0.637 -6.243 1.00 70.42 O ATOM 274 CG2 THR A 20 -51.199 2.556 -4.869 1.00 72.02 C ATOM 0 H THR A 20 -49.520 4.349 -5.628 1.00 61.12 H new ATOM 0 HA THR A 20 -49.147 2.316 -7.642 1.00 12.12 H new ATOM 0 HB THR A 20 -49.257 1.747 -5.238 1.00 40.23 H new ATOM 0 HG1 THR A 20 -50.872 0.066 -5.469 1.00 70.42 H new ATOM 0 HG21 THR A 20 -51.398 1.898 -4.023 1.00 72.02 H new ATOM 0 HG22 THR A 20 -50.802 3.504 -4.506 1.00 72.02 H new ATOM 0 HG23 THR A 20 -52.125 2.735 -5.415 1.00 72.02 H new ATOM 282 N LYS A 21 -51.652 1.978 -8.432 1.00 3.44 N ATOM 283 CA LYS A 21 -52.876 2.059 -9.220 1.00 22.44 C ATOM 284 C LYS A 21 -54.097 1.747 -8.361 1.00 14.33 C ATOM 285 O LYS A 21 -55.216 1.653 -8.867 1.00 74.45 O ATOM 286 CB LYS A 21 -52.810 1.091 -10.403 1.00 24.43 C ATOM 287 CG LYS A 21 -52.811 -0.371 -9.994 1.00 51.34 C ATOM 288 CD LYS A 21 -51.398 -0.909 -9.840 1.00 33.02 C ATOM 289 CE LYS A 21 -51.146 -1.419 -8.429 1.00 63.52 C ATOM 290 NZ LYS A 21 -49.716 -1.287 -8.039 1.00 64.01 N1+ ATOM 0 H LYS A 21 -51.218 1.055 -8.422 1.00 3.44 H new ATOM 0 HA LYS A 21 -52.970 3.077 -9.597 1.00 22.44 H new ATOM 0 HB2 LYS A 21 -53.659 1.276 -11.061 1.00 24.43 H new ATOM 0 HB3 LYS A 21 -51.909 1.297 -10.980 1.00 24.43 H new ATOM 0 HG2 LYS A 21 -53.349 -0.486 -9.053 1.00 51.34 H new ATOM 0 HG3 LYS A 21 -53.345 -0.958 -10.741 1.00 51.34 H new ATOM 0 HD2 LYS A 21 -51.235 -1.716 -10.554 1.00 33.02 H new ATOM 0 HD3 LYS A 21 -50.681 -0.124 -10.078 1.00 33.02 H new ATOM 0 HE2 LYS A 21 -51.767 -0.864 -7.726 1.00 63.52 H new ATOM 0 HE3 LYS A 21 -51.446 -2.465 -8.362 1.00 63.52 H new ATOM 0 HZ1 LYS A 21 -49.366 -2.202 -7.689 1.00 64.01 H new ATOM 0 HZ2 LYS A 21 -49.156 -0.995 -8.866 1.00 64.01 H new ATOM 0 HZ3 LYS A 21 -49.625 -0.572 -7.290 1.00 64.01 H new ATOM 304 N LEU A 22 -53.876 1.590 -7.061 1.00 11.11 N ATOM 305 CA LEU A 22 -54.960 1.290 -6.132 1.00 62.04 C ATOM 306 C LEU A 22 -55.409 2.547 -5.395 1.00 2.31 C ATOM 307 O LEU A 22 -56.427 2.544 -4.703 1.00 51.15 O ATOM 308 CB LEU A 22 -54.516 0.227 -5.125 1.00 32.22 C ATOM 309 CG LEU A 22 -55.147 -1.157 -5.287 1.00 53.13 C ATOM 310 CD1 LEU A 22 -54.174 -2.241 -4.851 1.00 24.41 C ATOM 311 CD2 LEU A 22 -56.442 -1.248 -4.493 1.00 34.53 C ATOM 0 H LEU A 22 -52.956 1.665 -6.626 1.00 11.11 H new ATOM 0 HA LEU A 22 -55.803 0.907 -6.708 1.00 62.04 H new ATOM 0 HB2 LEU A 22 -53.433 0.121 -5.193 1.00 32.22 H new ATOM 0 HB3 LEU A 22 -54.738 0.590 -4.122 1.00 32.22 H new ATOM 0 HG LEU A 22 -55.379 -1.309 -6.341 1.00 53.13 H new ATOM 0 HD11 LEU A 22 -54.640 -3.219 -4.973 1.00 24.41 H new ATOM 0 HD12 LEU A 22 -53.273 -2.189 -5.463 1.00 24.41 H new ATOM 0 HD13 LEU A 22 -53.910 -2.093 -3.804 1.00 24.41 H new ATOM 0 HD21 LEU A 22 -56.878 -2.239 -4.620 1.00 34.53 H new ATOM 0 HD22 LEU A 22 -56.234 -1.075 -3.437 1.00 34.53 H new ATOM 0 HD23 LEU A 22 -57.143 -0.495 -4.853 1.00 34.53 H new ATOM 323 N GLY A 23 -54.643 3.623 -5.550 1.00 52.15 N ATOM 324 CA GLY A 23 -54.981 4.874 -4.895 1.00 43.34 C ATOM 325 C GLY A 23 -54.141 5.126 -3.659 1.00 14.33 C ATOM 326 O GLY A 23 -54.594 4.947 -2.528 1.00 42.31 O ATOM 0 H GLY A 23 -53.795 3.651 -6.117 1.00 52.15 H new ATOM 0 HA2 GLY A 23 -54.845 5.697 -5.597 1.00 43.34 H new ATOM 0 HA3 GLY A 23 -56.035 4.862 -4.618 1.00 43.34 H new ATOM 330 N PRO A 24 -52.885 5.549 -3.867 1.00 42.45 N ATOM 331 CA PRO A 24 -51.954 5.833 -2.772 1.00 55.11 C ATOM 332 C PRO A 24 -52.348 7.078 -1.984 1.00 31.25 C ATOM 333 O PRO A 24 -53.193 7.858 -2.422 1.00 23.44 O ATOM 334 CB PRO A 24 -50.619 6.054 -3.488 1.00 4.11 C ATOM 335 CG PRO A 24 -50.996 6.496 -4.861 1.00 61.03 C ATOM 336 CD PRO A 24 -52.279 5.784 -5.188 1.00 45.53 C ATOM 0 HA PRO A 24 -51.931 5.027 -2.038 1.00 55.11 H new ATOM 0 HB2 PRO A 24 -50.017 6.808 -2.980 1.00 4.11 H new ATOM 0 HB3 PRO A 24 -50.027 5.139 -3.515 1.00 4.11 H new ATOM 0 HG2 PRO A 24 -51.129 7.577 -4.900 1.00 61.03 H new ATOM 0 HG3 PRO A 24 -50.216 6.245 -5.580 1.00 61.03 H new ATOM 0 HD2 PRO A 24 -52.924 6.390 -5.824 1.00 45.53 H new ATOM 0 HD3 PRO A 24 -52.096 4.849 -5.718 1.00 45.53 H new ATOM 344 N GLU A 25 -51.728 7.258 -0.821 1.00 30.43 N ATOM 345 CA GLU A 25 -52.016 8.409 0.026 1.00 61.13 C ATOM 346 C GLU A 25 -50.736 8.958 0.651 1.00 2.52 C ATOM 347 O GLU A 25 -50.517 10.168 0.679 1.00 75.32 O ATOM 348 CB GLU A 25 -53.009 8.026 1.125 1.00 32.13 C ATOM 349 CG GLU A 25 -52.674 6.717 1.819 1.00 54.54 C ATOM 350 CD GLU A 25 -53.747 6.286 2.799 1.00 55.02 C ATOM 351 OE1 GLU A 25 -54.701 5.601 2.371 1.00 54.21 O ATOM 352 OE2 GLU A 25 -53.634 6.632 3.994 1.00 12.11 O1- ATOM 0 H GLU A 25 -51.024 6.622 -0.445 1.00 30.43 H new ATOM 0 HA GLU A 25 -52.458 9.186 -0.598 1.00 61.13 H new ATOM 0 HB2 GLU A 25 -53.041 8.823 1.868 1.00 32.13 H new ATOM 0 HB3 GLU A 25 -54.007 7.953 0.692 1.00 32.13 H new ATOM 0 HG2 GLU A 25 -52.537 5.937 1.070 1.00 54.54 H new ATOM 0 HG3 GLU A 25 -51.726 6.822 2.347 1.00 54.54 H new ATOM 359 N GLU A 26 -49.896 8.057 1.151 1.00 43.40 N ATOM 360 CA GLU A 26 -48.638 8.451 1.777 1.00 42.11 C ATOM 361 C GLU A 26 -47.716 7.248 1.947 1.00 25.51 C ATOM 362 O GLU A 26 -48.170 6.104 1.983 1.00 40.12 O ATOM 363 CB GLU A 26 -48.903 9.103 3.135 1.00 74.23 C ATOM 364 CG GLU A 26 -49.334 8.119 4.210 1.00 70.14 C ATOM 365 CD GLU A 26 -50.225 8.754 5.260 1.00 31.34 C ATOM 366 OE1 GLU A 26 -51.204 9.427 4.879 1.00 24.24 O ATOM 367 OE2 GLU A 26 -49.940 8.577 6.463 1.00 61.41 O1- ATOM 0 H GLU A 26 -50.063 7.051 1.135 1.00 43.40 H new ATOM 0 HA GLU A 26 -48.146 9.173 1.126 1.00 42.11 H new ATOM 0 HB2 GLU A 26 -47.999 9.615 3.465 1.00 74.23 H new ATOM 0 HB3 GLU A 26 -49.676 9.863 3.019 1.00 74.23 H new ATOM 0 HG2 GLU A 26 -49.863 7.287 3.745 1.00 70.14 H new ATOM 0 HG3 GLU A 26 -48.449 7.704 4.693 1.00 70.14 H new ATOM 374 N ILE A 27 -46.419 7.516 2.052 1.00 34.23 N ATOM 375 CA ILE A 27 -45.431 6.456 2.220 1.00 51.54 C ATOM 376 C ILE A 27 -45.251 6.100 3.692 1.00 3.43 C ATOM 377 O ILE A 27 -45.343 6.963 4.567 1.00 75.14 O ATOM 378 CB ILE A 27 -44.068 6.859 1.630 1.00 31.11 C ATOM 379 CG1 ILE A 27 -43.166 5.631 1.487 1.00 64.55 C ATOM 380 CG2 ILE A 27 -43.403 7.912 2.503 1.00 22.12 C ATOM 381 CD1 ILE A 27 -41.773 5.957 0.996 1.00 33.44 C ATOM 0 H ILE A 27 -46.027 8.457 2.024 1.00 34.23 H new ATOM 0 HA ILE A 27 -45.807 5.586 1.682 1.00 51.54 H new ATOM 0 HB ILE A 27 -44.230 7.285 0.640 1.00 31.11 H new ATOM 0 HG12 ILE A 27 -43.094 5.129 2.452 1.00 64.55 H new ATOM 0 HG13 ILE A 27 -43.631 4.928 0.796 1.00 64.55 H new ATOM 0 HG21 ILE A 27 -42.440 8.186 2.072 1.00 22.12 H new ATOM 0 HG22 ILE A 27 -44.041 8.794 2.558 1.00 22.12 H new ATOM 0 HG23 ILE A 27 -43.251 7.511 3.505 1.00 22.12 H new ATOM 0 HD11 ILE A 27 -41.190 5.039 0.919 1.00 33.44 H new ATOM 0 HD12 ILE A 27 -41.834 6.431 0.017 1.00 33.44 H new ATOM 0 HD13 ILE A 27 -41.289 6.636 1.698 1.00 33.44 H new ATOM 393 N THR A 28 -44.992 4.825 3.960 1.00 23.51 N ATOM 394 CA THR A 28 -44.798 4.355 5.325 1.00 45.35 C ATOM 395 C THR A 28 -43.844 3.166 5.368 1.00 32.33 C ATOM 396 O THR A 28 -43.384 2.691 4.329 1.00 33.43 O ATOM 397 CB THR A 28 -46.134 3.949 5.976 1.00 53.03 C ATOM 398 OG1 THR A 28 -45.952 3.738 7.380 1.00 4.11 O ATOM 399 CG2 THR A 28 -46.687 2.685 5.335 1.00 21.31 C ATOM 0 H THR A 28 -44.912 4.098 3.249 1.00 23.51 H new ATOM 0 HA THR A 28 -44.366 5.185 5.885 1.00 45.35 H new ATOM 0 HB THR A 28 -46.848 4.758 5.821 1.00 53.03 H new ATOM 0 HG1 THR A 28 -46.807 3.482 7.786 1.00 4.11 H new ATOM 0 HG21 THR A 28 -47.630 2.418 5.811 1.00 21.31 H new ATOM 0 HG22 THR A 28 -46.854 2.859 4.272 1.00 21.31 H new ATOM 0 HG23 THR A 28 -45.974 1.871 5.462 1.00 21.31 H new ATOM 407 N ARG A 29 -43.552 2.690 6.574 1.00 14.42 N ATOM 408 CA ARG A 29 -42.653 1.556 6.749 1.00 74.04 C ATOM 409 C ARG A 29 -43.384 0.375 7.380 1.00 61.04 C ATOM 410 O ARG A 29 -43.914 0.480 8.487 1.00 23.41 O ATOM 411 CB ARG A 29 -41.460 1.955 7.620 1.00 13.44 C ATOM 412 CG ARG A 29 -41.841 2.803 8.823 1.00 21.03 C ATOM 413 CD ARG A 29 -41.822 4.286 8.487 1.00 15.43 C ATOM 414 NE ARG A 29 -42.782 5.041 9.288 1.00 11.32 N ATOM 415 CZ ARG A 29 -42.958 6.353 9.182 1.00 74.13 C ATOM 416 NH1 ARG A 29 -42.241 7.052 8.313 1.00 53.55 N1+ ATOM 417 NH2 ARG A 29 -43.851 6.968 9.946 1.00 74.03 N ATOM 0 H ARG A 29 -43.925 3.072 7.443 1.00 14.42 H new ATOM 0 HA ARG A 29 -42.293 1.254 5.766 1.00 74.04 H new ATOM 0 HB2 ARG A 29 -40.956 1.053 7.967 1.00 13.44 H new ATOM 0 HB3 ARG A 29 -40.744 2.506 7.010 1.00 13.44 H new ATOM 0 HG2 ARG A 29 -42.835 2.520 9.169 1.00 21.03 H new ATOM 0 HG3 ARG A 29 -41.150 2.605 9.642 1.00 21.03 H new ATOM 0 HD2 ARG A 29 -40.820 4.682 8.653 1.00 15.43 H new ATOM 0 HD3 ARG A 29 -42.047 4.421 7.429 1.00 15.43 H new ATOM 0 HE ARG A 29 -43.349 4.532 9.967 1.00 11.32 H new ATOM 0 HH11 ARG A 29 -41.553 6.582 7.725 1.00 53.55 H new ATOM 0 HH12 ARG A 29 -42.377 8.060 8.233 1.00 53.55 H new ATOM 0 HH21 ARG A 29 -44.404 6.433 10.616 1.00 74.03 H new ATOM 0 HH22 ARG A 29 -43.985 7.976 9.863 1.00 74.03 H new ATOM 431 N ASP A 30 -43.409 -0.748 6.670 1.00 64.35 N ATOM 432 CA ASP A 30 -44.074 -1.949 7.160 1.00 0.23 C ATOM 433 C ASP A 30 -43.375 -3.204 6.648 1.00 34.02 C ATOM 434 O ASP A 30 -43.719 -3.731 5.589 1.00 14.01 O ATOM 435 CB ASP A 30 -45.541 -1.956 6.730 1.00 31.35 C ATOM 436 CG ASP A 30 -46.229 -3.272 7.040 1.00 31.41 C ATOM 437 OD1 ASP A 30 -46.703 -3.439 8.183 1.00 64.23 O ATOM 438 OD2 ASP A 30 -46.293 -4.133 6.138 1.00 50.33 O1- ATOM 0 H ASP A 30 -42.976 -0.851 5.752 1.00 64.35 H new ATOM 0 HA ASP A 30 -44.023 -1.945 8.249 1.00 0.23 H new ATOM 0 HB2 ASP A 30 -46.068 -1.146 7.234 1.00 31.35 H new ATOM 0 HB3 ASP A 30 -45.604 -1.760 5.660 1.00 31.35 H new ATOM 443 N ILE A 31 -42.391 -3.679 7.405 1.00 63.23 N ATOM 444 CA ILE A 31 -41.645 -4.872 7.029 1.00 25.31 C ATOM 445 C ILE A 31 -41.965 -6.038 7.958 1.00 64.24 C ATOM 446 O ILE A 31 -41.240 -6.323 8.910 1.00 20.01 O ATOM 447 CB ILE A 31 -40.126 -4.616 7.049 1.00 73.13 C ATOM 448 CG1 ILE A 31 -39.814 -3.220 6.506 1.00 24.14 C ATOM 449 CG2 ILE A 31 -39.398 -5.680 6.241 1.00 43.12 C ATOM 450 CD1 ILE A 31 -40.347 -2.982 5.111 1.00 71.21 C ATOM 0 H ILE A 31 -42.092 -3.255 8.283 1.00 63.23 H new ATOM 0 HA ILE A 31 -41.949 -5.126 6.014 1.00 25.31 H new ATOM 0 HB ILE A 31 -39.778 -4.670 8.080 1.00 73.13 H new ATOM 0 HG12 ILE A 31 -40.236 -2.474 7.180 1.00 24.14 H new ATOM 0 HG13 ILE A 31 -38.734 -3.073 6.504 1.00 24.14 H new ATOM 0 HG21 ILE A 31 -38.326 -5.485 6.265 1.00 43.12 H new ATOM 0 HG22 ILE A 31 -39.598 -6.662 6.669 1.00 43.12 H new ATOM 0 HG23 ILE A 31 -39.748 -5.656 5.209 1.00 43.12 H new ATOM 0 HD11 ILE A 31 -40.089 -1.973 4.790 1.00 71.21 H new ATOM 0 HD12 ILE A 31 -39.906 -3.705 4.425 1.00 71.21 H new ATOM 0 HD13 ILE A 31 -41.431 -3.097 5.111 1.00 71.21 H new ATOM 462 N PRO A 32 -43.078 -6.731 7.674 1.00 34.15 N ATOM 463 CA PRO A 32 -43.520 -7.879 8.472 1.00 63.53 C ATOM 464 C PRO A 32 -42.606 -9.088 8.302 1.00 74.13 C ATOM 465 O PRO A 32 -41.815 -9.154 7.362 1.00 52.54 O ATOM 466 CB PRO A 32 -44.914 -8.182 7.916 1.00 61.33 C ATOM 467 CG PRO A 32 -44.891 -7.652 6.524 1.00 72.25 C ATOM 468 CD PRO A 32 -43.991 -6.447 6.554 1.00 11.40 C ATOM 0 HA PRO A 32 -43.510 -7.661 9.540 1.00 63.53 H new ATOM 0 HB2 PRO A 32 -45.121 -9.252 7.929 1.00 61.33 H new ATOM 0 HB3 PRO A 32 -45.690 -7.700 8.510 1.00 61.33 H new ATOM 0 HG2 PRO A 32 -44.516 -8.402 5.827 1.00 72.25 H new ATOM 0 HG3 PRO A 32 -45.894 -7.382 6.193 1.00 72.25 H new ATOM 0 HD2 PRO A 32 -43.450 -6.326 5.615 1.00 11.40 H new ATOM 0 HD3 PRO A 32 -44.555 -5.528 6.718 1.00 11.40 H new ATOM 476 N ASN A 33 -42.721 -10.045 9.217 1.00 71.22 N ATOM 477 CA ASN A 33 -41.905 -11.253 9.169 1.00 2.45 C ATOM 478 C ASN A 33 -40.425 -10.915 9.332 1.00 2.05 C ATOM 479 O ASN A 33 -39.554 -11.721 9.004 1.00 32.14 O ATOM 480 CB ASN A 33 -42.129 -11.991 7.848 1.00 52.30 C ATOM 481 CG ASN A 33 -43.599 -12.127 7.504 1.00 14.10 C ATOM 482 OD1 ASN A 33 -44.328 -12.892 8.135 1.00 31.13 O ATOM 483 ND2 ASN A 33 -44.041 -11.383 6.496 1.00 31.33 N ATOM 0 H ASN A 33 -43.372 -10.007 10.001 1.00 71.22 H new ATOM 0 HA ASN A 33 -42.205 -11.899 9.994 1.00 2.45 H new ATOM 0 HB2 ASN A 33 -41.619 -11.458 7.046 1.00 52.30 H new ATOM 0 HB3 ASN A 33 -41.679 -12.982 7.908 1.00 52.30 H new ATOM 0 HD21 ASN A 33 -45.021 -11.432 6.217 1.00 31.33 H new ATOM 0 HD22 ASN A 33 -43.400 -10.762 6.001 1.00 31.33 H new ATOM 490 N VAL A 34 -40.149 -9.720 9.842 1.00 34.42 N ATOM 491 CA VAL A 34 -38.776 -9.276 10.051 1.00 3.55 C ATOM 492 C VAL A 34 -38.537 -8.895 11.508 1.00 63.25 C ATOM 493 O VAL A 34 -39.391 -8.284 12.149 1.00 72.34 O ATOM 494 CB VAL A 34 -38.432 -8.072 9.154 1.00 61.54 C ATOM 495 CG1 VAL A 34 -37.016 -7.589 9.427 1.00 74.44 C ATOM 496 CG2 VAL A 34 -38.607 -8.435 7.686 1.00 63.24 C ATOM 0 H VAL A 34 -40.858 -9.041 10.118 1.00 34.42 H new ATOM 0 HA VAL A 34 -38.130 -10.113 9.786 1.00 3.55 H new ATOM 0 HB VAL A 34 -39.118 -7.258 9.388 1.00 61.54 H new ATOM 0 HG11 VAL A 34 -36.791 -6.738 8.784 1.00 74.44 H new ATOM 0 HG12 VAL A 34 -36.929 -7.288 10.471 1.00 74.44 H new ATOM 0 HG13 VAL A 34 -36.311 -8.395 9.222 1.00 74.44 H new ATOM 0 HG21 VAL A 34 -38.360 -7.573 7.066 1.00 63.24 H new ATOM 0 HG22 VAL A 34 -37.946 -9.264 7.435 1.00 63.24 H new ATOM 0 HG23 VAL A 34 -39.641 -8.728 7.504 1.00 63.24 H new ATOM 506 N GLY A 35 -37.368 -9.260 12.025 1.00 71.54 N ATOM 507 CA GLY A 35 -37.037 -8.948 13.404 1.00 61.21 C ATOM 508 C GLY A 35 -36.918 -7.457 13.647 1.00 63.23 C ATOM 509 O GLY A 35 -36.751 -6.680 12.708 1.00 50.52 O ATOM 0 H GLY A 35 -36.644 -9.766 11.514 1.00 71.54 H new ATOM 0 HA2 GLY A 35 -37.803 -9.360 14.061 1.00 61.21 H new ATOM 0 HA3 GLY A 35 -36.097 -9.432 13.668 1.00 61.21 H new ATOM 513 N GLU A 36 -37.004 -7.056 14.912 1.00 25.34 N ATOM 514 CA GLU A 36 -36.907 -5.648 15.274 1.00 23.30 C ATOM 515 C GLU A 36 -35.477 -5.142 15.113 1.00 75.14 C ATOM 516 O GLU A 36 -35.246 -3.948 14.922 1.00 34.31 O ATOM 517 CB GLU A 36 -37.375 -5.436 16.716 1.00 11.14 C ATOM 518 CG GLU A 36 -36.553 -6.197 17.741 1.00 41.24 C ATOM 519 CD GLU A 36 -37.094 -6.050 19.150 1.00 1.32 C ATOM 520 OE1 GLU A 36 -38.172 -6.614 19.434 1.00 11.12 O ATOM 521 OE2 GLU A 36 -36.440 -5.369 19.969 1.00 24.50 O1- ATOM 0 H GLU A 36 -37.141 -7.687 15.702 1.00 25.34 H new ATOM 0 HA GLU A 36 -37.552 -5.081 14.603 1.00 23.30 H new ATOM 0 HB2 GLU A 36 -37.336 -4.372 16.949 1.00 11.14 H new ATOM 0 HB3 GLU A 36 -38.418 -5.742 16.799 1.00 11.14 H new ATOM 0 HG2 GLU A 36 -36.532 -7.253 17.472 1.00 41.24 H new ATOM 0 HG3 GLU A 36 -35.523 -5.840 17.712 1.00 41.24 H new ATOM 528 N ASP A 37 -34.518 -6.059 15.193 1.00 22.02 N ATOM 529 CA ASP A 37 -33.110 -5.707 15.056 1.00 32.15 C ATOM 530 C ASP A 37 -32.847 -5.031 13.714 1.00 14.55 C ATOM 531 O ASP A 37 -32.052 -4.097 13.623 1.00 61.42 O ATOM 532 CB ASP A 37 -32.236 -6.954 15.195 1.00 75.52 C ATOM 533 CG ASP A 37 -32.714 -8.096 14.321 1.00 61.23 C ATOM 534 OD1 ASP A 37 -33.578 -8.871 14.779 1.00 2.44 O ATOM 535 OD2 ASP A 37 -32.222 -8.216 13.178 1.00 44.23 O1- ATOM 0 H ASP A 37 -34.691 -7.052 15.352 1.00 22.02 H new ATOM 0 HA ASP A 37 -32.856 -5.005 15.850 1.00 32.15 H new ATOM 0 HB2 ASP A 37 -31.208 -6.705 14.932 1.00 75.52 H new ATOM 0 HB3 ASP A 37 -32.230 -7.275 16.237 1.00 75.52 H new ATOM 540 N ALA A 38 -33.519 -5.514 12.673 1.00 41.12 N ATOM 541 CA ALA A 38 -33.359 -4.957 11.335 1.00 33.22 C ATOM 542 C ALA A 38 -33.832 -3.508 11.284 1.00 61.11 C ATOM 543 O ALA A 38 -33.424 -2.741 10.410 1.00 73.30 O ATOM 544 CB ALA A 38 -34.115 -5.798 10.318 1.00 54.45 C ATOM 0 H ALA A 38 -34.179 -6.290 12.731 1.00 41.12 H new ATOM 0 HA ALA A 38 -32.298 -4.975 11.086 1.00 33.22 H new ATOM 0 HB1 ALA A 38 -33.986 -5.370 9.324 1.00 54.45 H new ATOM 0 HB2 ALA A 38 -33.727 -6.816 10.327 1.00 54.45 H new ATOM 0 HB3 ALA A 38 -35.175 -5.811 10.573 1.00 54.45 H new ATOM 550 N LEU A 39 -34.697 -3.140 12.222 1.00 44.35 N ATOM 551 CA LEU A 39 -35.228 -1.782 12.284 1.00 51.12 C ATOM 552 C LEU A 39 -34.818 -1.094 13.582 1.00 25.44 C ATOM 553 O LEU A 39 -35.378 -0.063 13.953 1.00 75.32 O ATOM 554 CB LEU A 39 -36.753 -1.804 12.165 1.00 75.42 C ATOM 555 CG LEU A 39 -37.490 -2.700 13.161 1.00 63.45 C ATOM 556 CD1 LEU A 39 -37.647 -1.994 14.500 1.00 3.12 C ATOM 557 CD2 LEU A 39 -38.850 -3.106 12.609 1.00 33.13 C ATOM 0 H LEU A 39 -35.046 -3.763 12.951 1.00 44.35 H new ATOM 0 HA LEU A 39 -34.812 -1.218 11.449 1.00 51.12 H new ATOM 0 HB2 LEU A 39 -37.121 -0.785 12.282 1.00 75.42 H new ATOM 0 HB3 LEU A 39 -37.014 -2.124 11.156 1.00 75.42 H new ATOM 0 HG LEU A 39 -36.898 -3.602 13.315 1.00 63.45 H new ATOM 0 HD11 LEU A 39 -38.174 -2.647 15.196 1.00 3.12 H new ATOM 0 HD12 LEU A 39 -36.663 -1.753 14.902 1.00 3.12 H new ATOM 0 HD13 LEU A 39 -38.217 -1.075 14.362 1.00 3.12 H new ATOM 0 HD21 LEU A 39 -39.360 -3.743 13.331 1.00 33.13 H new ATOM 0 HD22 LEU A 39 -39.449 -2.214 12.425 1.00 33.13 H new ATOM 0 HD23 LEU A 39 -38.715 -3.652 11.675 1.00 33.13 H new ATOM 569 N ARG A 40 -33.834 -1.671 14.265 1.00 20.52 N ATOM 570 CA ARG A 40 -33.347 -1.113 15.521 1.00 43.52 C ATOM 571 C ARG A 40 -32.740 0.270 15.302 1.00 33.33 C ATOM 572 O ARG A 40 -32.814 1.136 16.172 1.00 61.33 O ATOM 573 CB ARG A 40 -32.309 -2.045 16.149 1.00 31.43 C ATOM 574 CG ARG A 40 -30.985 -2.073 15.403 1.00 41.24 C ATOM 575 CD ARG A 40 -30.169 -3.304 15.763 1.00 43.45 C ATOM 576 NE ARG A 40 -29.604 -3.212 17.107 1.00 63.04 N ATOM 577 CZ ARG A 40 -29.023 -4.232 17.730 1.00 32.22 C ATOM 578 NH1 ARG A 40 -28.929 -5.412 17.133 1.00 22.50 N1+ ATOM 579 NH2 ARG A 40 -28.534 -4.070 18.953 1.00 20.05 N ATOM 0 H ARG A 40 -33.359 -2.524 13.970 1.00 20.52 H new ATOM 0 HA ARG A 40 -34.194 -1.015 16.200 1.00 43.52 H new ATOM 0 HB2 ARG A 40 -32.130 -1.734 17.178 1.00 31.43 H new ATOM 0 HB3 ARG A 40 -32.716 -3.055 16.187 1.00 31.43 H new ATOM 0 HG2 ARG A 40 -31.171 -2.060 14.329 1.00 41.24 H new ATOM 0 HG3 ARG A 40 -30.414 -1.175 15.639 1.00 41.24 H new ATOM 0 HD2 ARG A 40 -30.800 -4.190 15.695 1.00 43.45 H new ATOM 0 HD3 ARG A 40 -29.364 -3.430 15.039 1.00 43.45 H new ATOM 0 HE ARG A 40 -29.658 -2.317 17.593 1.00 63.04 H new ATOM 0 HH11 ARG A 40 -29.303 -5.539 16.193 1.00 22.50 H new ATOM 0 HH12 ARG A 40 -28.482 -6.193 17.614 1.00 22.50 H new ATOM 0 HH21 ARG A 40 -28.604 -3.163 19.414 1.00 20.05 H new ATOM 0 HH22 ARG A 40 -28.088 -4.853 19.432 1.00 20.05 H new ATOM 593 N ASN A 41 -32.138 0.468 14.133 1.00 55.32 N ATOM 594 CA ASN A 41 -31.516 1.744 13.800 1.00 71.13 C ATOM 595 C ASN A 41 -32.502 2.657 13.079 1.00 35.30 C ATOM 596 O ASN A 41 -32.342 3.879 13.070 1.00 31.23 O ATOM 597 CB ASN A 41 -30.278 1.521 12.930 1.00 34.41 C ATOM 598 CG ASN A 41 -29.177 0.788 13.669 1.00 10.32 C ATOM 599 OD1 ASN A 41 -28.749 1.208 14.744 1.00 32.53 O ATOM 600 ND2 ASN A 41 -28.710 -0.315 13.093 1.00 61.32 N ATOM 0 H ASN A 41 -32.068 -0.239 13.401 1.00 55.32 H new ATOM 0 HA ASN A 41 -31.215 2.227 14.730 1.00 71.13 H new ATOM 0 HB2 ASN A 41 -30.558 0.952 12.043 1.00 34.41 H new ATOM 0 HB3 ASN A 41 -29.902 2.484 12.585 1.00 34.41 H new ATOM 0 HD21 ASN A 41 -27.967 -0.850 13.543 1.00 61.32 H new ATOM 0 HD22 ASN A 41 -29.094 -0.627 12.201 1.00 61.32 H new ATOM 607 N LEU A 42 -33.522 2.057 12.474 1.00 5.31 N ATOM 608 CA LEU A 42 -34.535 2.816 11.749 1.00 1.45 C ATOM 609 C LEU A 42 -35.101 3.936 12.617 1.00 41.30 C ATOM 610 O LEU A 42 -35.321 3.756 13.814 1.00 64.12 O ATOM 611 CB LEU A 42 -35.663 1.890 11.291 1.00 35.41 C ATOM 612 CG LEU A 42 -36.338 2.258 9.969 1.00 32.44 C ATOM 613 CD1 LEU A 42 -35.628 1.587 8.803 1.00 21.05 C ATOM 614 CD2 LEU A 42 -37.810 1.870 9.995 1.00 43.22 C ATOM 0 H LEU A 42 -33.669 1.048 12.471 1.00 5.31 H new ATOM 0 HA LEU A 42 -34.063 3.263 10.874 1.00 1.45 H new ATOM 0 HB2 LEU A 42 -35.264 0.880 11.203 1.00 35.41 H new ATOM 0 HB3 LEU A 42 -36.425 1.865 12.070 1.00 35.41 H new ATOM 0 HG LEU A 42 -36.270 3.338 9.836 1.00 32.44 H new ATOM 0 HD11 LEU A 42 -36.122 1.860 7.870 1.00 21.05 H new ATOM 0 HD12 LEU A 42 -34.589 1.914 8.773 1.00 21.05 H new ATOM 0 HD13 LEU A 42 -35.664 0.505 8.929 1.00 21.05 H new ATOM 0 HD21 LEU A 42 -38.274 2.139 9.046 1.00 43.22 H new ATOM 0 HD22 LEU A 42 -37.900 0.795 10.151 1.00 43.22 H new ATOM 0 HD23 LEU A 42 -38.311 2.398 10.807 1.00 43.22 H new ATOM 626 N ASP A 43 -35.338 5.090 12.003 1.00 10.14 N ATOM 627 CA ASP A 43 -35.882 6.239 12.718 1.00 31.33 C ATOM 628 C ASP A 43 -37.344 6.466 12.348 1.00 31.33 C ATOM 629 O ASP A 43 -37.938 5.680 11.610 1.00 2.34 O ATOM 630 CB ASP A 43 -35.063 7.494 12.411 1.00 44.20 C ATOM 631 CG ASP A 43 -34.946 7.757 10.922 1.00 54.04 C ATOM 632 OD1 ASP A 43 -35.684 7.115 10.146 1.00 1.31 O ATOM 633 OD2 ASP A 43 -34.117 8.606 10.535 1.00 30.34 O1- ATOM 0 H ASP A 43 -35.162 5.255 11.012 1.00 10.14 H new ATOM 0 HA ASP A 43 -35.824 6.031 13.786 1.00 31.33 H new ATOM 0 HB2 ASP A 43 -35.526 8.354 12.894 1.00 44.20 H new ATOM 0 HB3 ASP A 43 -34.066 7.387 12.838 1.00 44.20 H new ATOM 638 N ASP A 44 -37.920 7.547 12.866 1.00 73.33 N ATOM 639 CA ASP A 44 -39.312 7.878 12.589 1.00 11.43 C ATOM 640 C ASP A 44 -39.513 8.187 11.109 1.00 44.41 C ATOM 641 O ASP A 44 -40.636 8.147 10.604 1.00 0.12 O ATOM 642 CB ASP A 44 -39.752 9.073 13.437 1.00 63.23 C ATOM 643 CG ASP A 44 -40.216 8.662 14.820 1.00 31.34 C ATOM 644 OD1 ASP A 44 -39.352 8.431 15.691 1.00 40.13 O ATOM 645 OD2 ASP A 44 -41.444 8.571 15.031 1.00 13.32 O1- ATOM 0 H ASP A 44 -37.443 8.208 13.480 1.00 73.33 H new ATOM 0 HA ASP A 44 -39.924 7.014 12.847 1.00 11.43 H new ATOM 0 HB2 ASP A 44 -38.923 9.775 13.529 1.00 63.23 H new ATOM 0 HB3 ASP A 44 -40.559 9.599 12.927 1.00 63.23 H new ATOM 650 N ARG A 45 -38.420 8.496 10.420 1.00 71.11 N ATOM 651 CA ARG A 45 -38.478 8.814 8.999 1.00 52.13 C ATOM 652 C ARG A 45 -38.635 7.547 8.163 1.00 35.45 C ATOM 653 O ARG A 45 -39.094 7.595 7.023 1.00 3.22 O ATOM 654 CB ARG A 45 -37.215 9.565 8.571 1.00 65.04 C ATOM 655 CG ARG A 45 -37.128 10.977 9.127 1.00 43.34 C ATOM 656 CD ARG A 45 -36.452 10.998 10.489 1.00 43.42 C ATOM 657 NE ARG A 45 -36.327 12.354 11.017 1.00 64.23 N ATOM 658 CZ ARG A 45 -35.567 12.670 12.060 1.00 23.12 C ATOM 659 NH1 ARG A 45 -34.868 11.731 12.682 1.00 63.01 N1+ ATOM 660 NH2 ARG A 45 -35.505 13.927 12.480 1.00 3.01 N ATOM 0 H ARG A 45 -37.484 8.533 10.823 1.00 71.11 H new ATOM 0 HA ARG A 45 -39.347 9.450 8.831 1.00 52.13 H new ATOM 0 HB2 ARG A 45 -36.340 9.001 8.895 1.00 65.04 H new ATOM 0 HB3 ARG A 45 -37.180 9.609 7.482 1.00 65.04 H new ATOM 0 HG2 ARG A 45 -36.572 11.609 8.434 1.00 43.34 H new ATOM 0 HG3 ARG A 45 -38.130 11.399 9.210 1.00 43.34 H new ATOM 0 HD2 ARG A 45 -37.025 10.388 11.188 1.00 43.42 H new ATOM 0 HD3 ARG A 45 -35.463 10.547 10.410 1.00 43.42 H new ATOM 0 HE ARG A 45 -36.852 13.099 10.560 1.00 64.23 H new ATOM 0 HH11 ARG A 45 -34.913 10.764 12.360 1.00 63.01 H new ATOM 0 HH12 ARG A 45 -34.285 11.975 13.483 1.00 63.01 H new ATOM 0 HH21 ARG A 45 -36.041 14.651 12.002 1.00 3.01 H new ATOM 0 HH22 ARG A 45 -34.921 14.169 13.281 1.00 3.01 H new ATOM 674 N GLY A 46 -38.252 6.412 8.741 1.00 63.25 N ATOM 675 CA GLY A 46 -38.358 5.148 8.036 1.00 13.20 C ATOM 676 C GLY A 46 -37.057 4.745 7.369 1.00 41.41 C ATOM 677 O GLY A 46 -37.050 3.922 6.453 1.00 11.40 O ATOM 0 H GLY A 46 -37.870 6.346 9.685 1.00 63.25 H new ATOM 0 HA2 GLY A 46 -38.660 4.369 8.736 1.00 13.20 H new ATOM 0 HA3 GLY A 46 -39.142 5.221 7.282 1.00 13.20 H new ATOM 681 N VAL A 47 -35.953 5.326 7.829 1.00 30.53 N ATOM 682 CA VAL A 47 -34.641 5.023 7.271 1.00 42.32 C ATOM 683 C VAL A 47 -33.642 4.682 8.370 1.00 35.22 C ATOM 684 O VAL A 47 -33.672 5.266 9.453 1.00 74.45 O ATOM 685 CB VAL A 47 -34.096 6.204 6.445 1.00 33.24 C ATOM 686 CG1 VAL A 47 -34.000 7.456 7.304 1.00 62.32 C ATOM 687 CG2 VAL A 47 -32.743 5.855 5.845 1.00 11.24 C ATOM 0 H VAL A 47 -35.942 6.009 8.587 1.00 30.53 H new ATOM 0 HA VAL A 47 -34.767 4.160 6.618 1.00 42.32 H new ATOM 0 HB VAL A 47 -34.789 6.404 5.628 1.00 33.24 H new ATOM 0 HG11 VAL A 47 -33.613 8.280 6.704 1.00 62.32 H new ATOM 0 HG12 VAL A 47 -34.989 7.715 7.681 1.00 62.32 H new ATOM 0 HG13 VAL A 47 -33.329 7.271 8.143 1.00 62.32 H new ATOM 0 HG21 VAL A 47 -32.373 6.701 5.265 1.00 11.24 H new ATOM 0 HG22 VAL A 47 -32.038 5.627 6.645 1.00 11.24 H new ATOM 0 HG23 VAL A 47 -32.847 4.986 5.195 1.00 11.24 H new ATOM 697 N ILE A 48 -32.759 3.731 8.084 1.00 4.11 N ATOM 698 CA ILE A 48 -31.749 3.312 9.048 1.00 23.31 C ATOM 699 C ILE A 48 -30.730 4.420 9.294 1.00 42.35 C ATOM 700 O ILE A 48 -30.227 5.035 8.353 1.00 21.41 O ATOM 701 CB ILE A 48 -31.010 2.047 8.576 1.00 74.51 C ATOM 702 CG1 ILE A 48 -31.987 0.877 8.445 1.00 2.21 C ATOM 703 CG2 ILE A 48 -29.885 1.699 9.539 1.00 61.43 C ATOM 704 CD1 ILE A 48 -32.593 0.446 9.762 1.00 11.41 C ATOM 0 H ILE A 48 -32.723 3.236 7.193 1.00 4.11 H new ATOM 0 HA ILE A 48 -32.274 3.091 9.977 1.00 23.31 H new ATOM 0 HB ILE A 48 -30.575 2.244 7.596 1.00 74.51 H new ATOM 0 HG12 ILE A 48 -32.787 1.157 7.760 1.00 2.21 H new ATOM 0 HG13 ILE A 48 -31.468 0.029 7.998 1.00 2.21 H new ATOM 0 HG21 ILE A 48 -29.372 0.802 9.191 1.00 61.43 H new ATOM 0 HG22 ILE A 48 -29.177 2.526 9.586 1.00 61.43 H new ATOM 0 HG23 ILE A 48 -30.298 1.519 10.531 1.00 61.43 H new ATOM 0 HD11 ILE A 48 -33.275 -0.387 9.593 1.00 11.41 H new ATOM 0 HD12 ILE A 48 -31.801 0.134 10.442 1.00 11.41 H new ATOM 0 HD13 ILE A 48 -33.141 1.280 10.201 1.00 11.41 H new ATOM 716 N ARG A 49 -30.430 4.670 10.564 1.00 61.21 N ATOM 717 CA ARG A 49 -29.471 5.704 10.934 1.00 55.21 C ATOM 718 C ARG A 49 -28.107 5.429 10.305 1.00 4.43 C ATOM 719 O ARG A 49 -27.840 4.323 9.835 1.00 74.42 O ATOM 720 CB ARG A 49 -29.335 5.782 12.455 1.00 75.12 C ATOM 721 CG ARG A 49 -28.672 7.061 12.942 1.00 63.14 C ATOM 722 CD ARG A 49 -28.754 7.189 14.456 1.00 21.00 C ATOM 723 NE ARG A 49 -28.179 8.446 14.929 1.00 40.53 N ATOM 724 CZ ARG A 49 -28.296 8.882 16.179 1.00 35.01 C ATOM 725 NH1 ARG A 49 -28.962 8.167 17.074 1.00 2.42 N1+ ATOM 726 NH2 ARG A 49 -27.746 10.036 16.534 1.00 44.41 N ATOM 0 H ARG A 49 -30.837 4.170 11.355 1.00 61.21 H new ATOM 0 HA ARG A 49 -29.840 6.659 10.559 1.00 55.21 H new ATOM 0 HB2 ARG A 49 -30.325 5.702 12.905 1.00 75.12 H new ATOM 0 HB3 ARG A 49 -28.756 4.927 12.804 1.00 75.12 H new ATOM 0 HG2 ARG A 49 -27.627 7.072 12.631 1.00 63.14 H new ATOM 0 HG3 ARG A 49 -29.152 7.921 12.476 1.00 63.14 H new ATOM 0 HD2 ARG A 49 -29.796 7.126 14.770 1.00 21.00 H new ATOM 0 HD3 ARG A 49 -28.230 6.353 14.920 1.00 21.00 H new ATOM 0 HE ARG A 49 -27.660 9.020 14.264 1.00 40.53 H new ATOM 0 HH11 ARG A 49 -29.386 7.280 16.804 1.00 2.42 H new ATOM 0 HH12 ARG A 49 -29.050 8.504 18.033 1.00 2.42 H new ATOM 0 HH21 ARG A 49 -27.233 10.589 15.847 1.00 44.41 H new ATOM 0 HH22 ARG A 49 -27.836 10.370 17.493 1.00 44.41 H new ATOM 740 N ILE A 50 -27.250 6.445 10.301 1.00 42.34 N ATOM 741 CA ILE A 50 -25.914 6.312 9.731 1.00 64.41 C ATOM 742 C ILE A 50 -24.979 5.580 10.686 1.00 25.51 C ATOM 743 O ILE A 50 -25.165 5.613 11.901 1.00 50.31 O ATOM 744 CB ILE A 50 -25.309 7.688 9.392 1.00 4.21 C ATOM 745 CG1 ILE A 50 -26.339 8.559 8.670 1.00 31.11 C ATOM 746 CG2 ILE A 50 -24.059 7.521 8.542 1.00 54.25 C ATOM 747 CD1 ILE A 50 -26.837 7.956 7.374 1.00 54.33 C ATOM 0 H ILE A 50 -27.456 7.367 10.685 1.00 42.34 H new ATOM 0 HA ILE A 50 -26.018 5.732 8.814 1.00 64.41 H new ATOM 0 HB ILE A 50 -25.029 8.185 10.321 1.00 4.21 H new ATOM 0 HG12 ILE A 50 -27.188 8.729 9.332 1.00 31.11 H new ATOM 0 HG13 ILE A 50 -25.897 9.533 8.462 1.00 31.11 H new ATOM 0 HG21 ILE A 50 -23.643 8.501 8.310 1.00 54.25 H new ATOM 0 HG22 ILE A 50 -23.322 6.934 9.090 1.00 54.25 H new ATOM 0 HG23 ILE A 50 -24.315 7.008 7.615 1.00 54.25 H new ATOM 0 HD11 ILE A 50 -27.564 8.627 6.916 1.00 54.33 H new ATOM 0 HD12 ILE A 50 -25.998 7.812 6.694 1.00 54.33 H new ATOM 0 HD13 ILE A 50 -27.308 6.995 7.578 1.00 54.33 H new ATOM 759 N GLY A 51 -23.971 4.917 10.126 1.00 2.14 N ATOM 760 CA GLY A 51 -23.019 4.186 10.942 1.00 43.44 C ATOM 761 C GLY A 51 -23.501 2.792 11.286 1.00 53.24 C ATOM 762 O GLY A 51 -22.960 2.143 12.181 1.00 63.33 O ATOM 0 H GLY A 51 -23.797 4.873 9.122 1.00 2.14 H new ATOM 0 HA2 GLY A 51 -22.068 4.118 10.413 1.00 43.44 H new ATOM 0 HA3 GLY A 51 -22.833 4.740 11.862 1.00 43.44 H new ATOM 766 N ALA A 52 -24.524 2.328 10.573 1.00 53.13 N ATOM 767 CA ALA A 52 -25.079 1.001 10.807 1.00 25.41 C ATOM 768 C ALA A 52 -24.640 0.023 9.723 1.00 3.24 C ATOM 769 O ALA A 52 -24.803 0.289 8.532 1.00 33.21 O ATOM 770 CB ALA A 52 -26.597 1.069 10.876 1.00 4.44 C ATOM 0 H ALA A 52 -24.984 2.852 9.829 1.00 53.13 H new ATOM 0 HA ALA A 52 -24.699 0.638 11.762 1.00 25.41 H new ATOM 0 HB1 ALA A 52 -26.998 0.071 11.051 1.00 4.44 H new ATOM 0 HB2 ALA A 52 -26.895 1.728 11.691 1.00 4.44 H new ATOM 0 HB3 ALA A 52 -26.987 1.457 9.935 1.00 4.44 H new ATOM 776 N GLU A 53 -24.082 -1.108 10.142 1.00 24.44 N ATOM 777 CA GLU A 53 -23.618 -2.124 9.205 1.00 12.23 C ATOM 778 C GLU A 53 -24.793 -2.760 8.467 1.00 61.23 C ATOM 779 O GLU A 53 -25.828 -3.057 9.065 1.00 62.55 O ATOM 780 CB GLU A 53 -22.819 -3.201 9.940 1.00 5.05 C ATOM 781 CG GLU A 53 -22.040 -4.120 9.014 1.00 63.31 C ATOM 782 CD GLU A 53 -21.809 -5.494 9.614 1.00 65.35 C ATOM 783 OE1 GLU A 53 -21.784 -5.601 10.858 1.00 22.21 O ATOM 784 OE2 GLU A 53 -21.652 -6.461 8.839 1.00 42.20 O1- ATOM 0 H GLU A 53 -23.940 -1.344 11.124 1.00 24.44 H new ATOM 0 HA GLU A 53 -22.971 -1.639 8.474 1.00 12.23 H new ATOM 0 HB2 GLU A 53 -22.125 -2.720 10.629 1.00 5.05 H new ATOM 0 HB3 GLU A 53 -23.502 -3.800 10.543 1.00 5.05 H new ATOM 0 HG2 GLU A 53 -22.580 -4.225 8.073 1.00 63.31 H new ATOM 0 HG3 GLU A 53 -21.078 -3.664 8.780 1.00 63.31 H new ATOM 791 N VAL A 54 -24.624 -2.969 7.166 1.00 22.21 N ATOM 792 CA VAL A 54 -25.669 -3.570 6.346 1.00 62.55 C ATOM 793 C VAL A 54 -25.509 -5.085 6.277 1.00 25.30 C ATOM 794 O VAL A 54 -24.410 -5.613 6.447 1.00 72.42 O ATOM 795 CB VAL A 54 -25.661 -2.998 4.916 1.00 34.21 C ATOM 796 CG1 VAL A 54 -24.489 -3.558 4.123 1.00 11.11 C ATOM 797 CG2 VAL A 54 -26.977 -3.294 4.217 1.00 22.21 C ATOM 0 H VAL A 54 -23.773 -2.731 6.657 1.00 22.21 H new ATOM 0 HA VAL A 54 -26.621 -3.328 6.819 1.00 62.55 H new ATOM 0 HB VAL A 54 -25.544 -1.916 4.977 1.00 34.21 H new ATOM 0 HG11 VAL A 54 -24.500 -3.143 3.115 1.00 11.11 H new ATOM 0 HG12 VAL A 54 -23.555 -3.290 4.616 1.00 11.11 H new ATOM 0 HG13 VAL A 54 -24.572 -4.643 4.069 1.00 11.11 H new ATOM 0 HG21 VAL A 54 -26.954 -2.883 3.208 1.00 22.21 H new ATOM 0 HG22 VAL A 54 -27.127 -4.372 4.166 1.00 22.21 H new ATOM 0 HG23 VAL A 54 -27.796 -2.840 4.775 1.00 22.21 H new ATOM 807 N LYS A 55 -26.613 -5.780 6.024 1.00 32.13 N ATOM 808 CA LYS A 55 -26.597 -7.235 5.930 1.00 11.44 C ATOM 809 C LYS A 55 -27.830 -7.745 5.192 1.00 24.20 C ATOM 810 O LYS A 55 -28.715 -6.970 4.831 1.00 53.12 O ATOM 811 CB LYS A 55 -26.531 -7.856 7.327 1.00 13.34 C ATOM 812 CG LYS A 55 -27.836 -7.757 8.099 1.00 34.42 C ATOM 813 CD LYS A 55 -27.592 -7.653 9.595 1.00 72.33 C ATOM 814 CE LYS A 55 -27.303 -9.014 10.208 1.00 54.12 C ATOM 815 NZ LYS A 55 -28.552 -9.765 10.510 1.00 75.44 N1+ ATOM 0 H LYS A 55 -27.531 -5.359 5.880 1.00 32.13 H new ATOM 0 HA LYS A 55 -25.711 -7.529 5.367 1.00 11.44 H new ATOM 0 HB2 LYS A 55 -26.251 -8.906 7.236 1.00 13.34 H new ATOM 0 HB3 LYS A 55 -25.743 -7.364 7.897 1.00 13.34 H new ATOM 0 HG2 LYS A 55 -28.396 -6.886 7.759 1.00 34.42 H new ATOM 0 HG3 LYS A 55 -28.451 -8.632 7.890 1.00 34.42 H new ATOM 0 HD2 LYS A 55 -26.753 -6.983 9.782 1.00 72.33 H new ATOM 0 HD3 LYS A 55 -28.465 -7.213 10.077 1.00 72.33 H new ATOM 0 HE2 LYS A 55 -26.686 -9.596 9.524 1.00 54.12 H new ATOM 0 HE3 LYS A 55 -26.727 -8.884 11.124 1.00 54.12 H new ATOM 0 HZ1 LYS A 55 -28.311 -10.687 10.926 1.00 75.44 H new ATOM 0 HZ2 LYS A 55 -29.130 -9.222 11.183 1.00 75.44 H new ATOM 0 HZ3 LYS A 55 -29.090 -9.912 9.632 1.00 75.44 H new ATOM 829 N ASP A 56 -27.882 -9.055 4.972 1.00 1.11 N ATOM 830 CA ASP A 56 -29.009 -9.670 4.280 1.00 50.12 C ATOM 831 C ASP A 56 -30.299 -9.489 5.074 1.00 51.21 C ATOM 832 O ASP A 56 -30.338 -9.735 6.279 1.00 22.43 O ATOM 833 CB ASP A 56 -28.741 -11.158 4.047 1.00 24.03 C ATOM 834 CG ASP A 56 -29.293 -11.645 2.723 1.00 74.11 C ATOM 835 OD1 ASP A 56 -29.179 -10.904 1.723 1.00 70.55 O ATOM 836 OD2 ASP A 56 -29.839 -12.767 2.684 1.00 42.54 O1- ATOM 0 H ASP A 56 -27.157 -9.711 5.263 1.00 1.11 H new ATOM 0 HA ASP A 56 -29.126 -9.175 3.316 1.00 50.12 H new ATOM 0 HB2 ASP A 56 -27.667 -11.340 4.078 1.00 24.03 H new ATOM 0 HB3 ASP A 56 -29.186 -11.736 4.857 1.00 24.03 H new ATOM 841 N GLY A 57 -31.354 -9.058 4.389 1.00 23.23 N ATOM 842 CA GLY A 57 -32.631 -8.852 5.047 1.00 2.42 C ATOM 843 C GLY A 57 -32.807 -7.428 5.537 1.00 30.44 C ATOM 844 O GLY A 57 -33.819 -7.098 6.155 1.00 50.43 O ATOM 0 H GLY A 57 -31.347 -8.848 3.391 1.00 23.23 H new ATOM 0 HA2 GLY A 57 -33.437 -9.097 4.355 1.00 2.42 H new ATOM 0 HA3 GLY A 57 -32.716 -9.537 5.891 1.00 2.42 H new ATOM 848 N ASP A 58 -31.819 -6.583 5.261 1.00 1.23 N ATOM 849 CA ASP A 58 -31.869 -5.187 5.679 1.00 24.33 C ATOM 850 C ASP A 58 -32.122 -4.272 4.485 1.00 44.22 C ATOM 851 O ASP A 58 -31.197 -3.914 3.755 1.00 4.32 O ATOM 852 CB ASP A 58 -30.564 -4.793 6.372 1.00 74.23 C ATOM 853 CG ASP A 58 -30.444 -5.386 7.761 1.00 42.34 C ATOM 854 OD1 ASP A 58 -30.856 -6.550 7.947 1.00 52.45 O ATOM 855 OD2 ASP A 58 -29.936 -4.687 8.662 1.00 60.24 O1- ATOM 0 H ASP A 58 -30.975 -6.841 4.750 1.00 1.23 H new ATOM 0 HA ASP A 58 -32.693 -5.073 6.383 1.00 24.33 H new ATOM 0 HB2 ASP A 58 -29.720 -5.122 5.766 1.00 74.23 H new ATOM 0 HB3 ASP A 58 -30.505 -3.707 6.438 1.00 74.23 H new ATOM 860 N LEU A 59 -33.382 -3.895 4.291 1.00 1.10 N ATOM 861 CA LEU A 59 -33.758 -3.022 3.185 1.00 32.31 C ATOM 862 C LEU A 59 -33.178 -1.624 3.373 1.00 22.24 C ATOM 863 O LEU A 59 -32.767 -0.975 2.410 1.00 63.34 O ATOM 864 CB LEU A 59 -35.281 -2.942 3.067 1.00 63.13 C ATOM 865 CG LEU A 59 -36.044 -4.238 3.345 1.00 21.11 C ATOM 866 CD1 LEU A 59 -37.527 -4.056 3.061 1.00 3.32 C ATOM 867 CD2 LEU A 59 -35.477 -5.380 2.515 1.00 13.30 C ATOM 0 H LEU A 59 -34.160 -4.181 4.886 1.00 1.10 H new ATOM 0 HA LEU A 59 -33.350 -3.445 2.267 1.00 32.31 H new ATOM 0 HB2 LEU A 59 -35.639 -2.178 3.757 1.00 63.13 H new ATOM 0 HB3 LEU A 59 -35.530 -2.606 2.061 1.00 63.13 H new ATOM 0 HG LEU A 59 -35.925 -4.488 4.399 1.00 21.11 H new ATOM 0 HD11 LEU A 59 -38.054 -4.988 3.264 1.00 3.32 H new ATOM 0 HD12 LEU A 59 -37.926 -3.267 3.699 1.00 3.32 H new ATOM 0 HD13 LEU A 59 -37.666 -3.781 2.015 1.00 3.32 H new ATOM 0 HD21 LEU A 59 -36.032 -6.294 2.726 1.00 13.30 H new ATOM 0 HD22 LEU A 59 -35.565 -5.138 1.456 1.00 13.30 H new ATOM 0 HD23 LEU A 59 -34.427 -5.527 2.768 1.00 13.30 H new ATOM 879 N LEU A 60 -33.143 -1.166 4.619 1.00 4.23 N ATOM 880 CA LEU A 60 -32.611 0.155 4.936 1.00 33.23 C ATOM 881 C LEU A 60 -33.473 1.252 4.320 1.00 4.21 C ATOM 882 O LEU A 60 -33.067 2.412 4.252 1.00 64.02 O ATOM 883 CB LEU A 60 -31.172 0.279 4.433 1.00 0.12 C ATOM 884 CG LEU A 60 -30.248 -0.900 4.742 1.00 74.51 C ATOM 885 CD1 LEU A 60 -29.064 -0.914 3.788 1.00 63.21 C ATOM 886 CD2 LEU A 60 -29.770 -0.837 6.186 1.00 1.41 C ATOM 0 H LEU A 60 -33.477 -1.690 5.428 1.00 4.23 H new ATOM 0 HA LEU A 60 -32.624 0.275 6.019 1.00 33.23 H new ATOM 0 HB2 LEU A 60 -31.197 0.421 3.353 1.00 0.12 H new ATOM 0 HB3 LEU A 60 -30.734 1.180 4.863 1.00 0.12 H new ATOM 0 HG LEU A 60 -30.810 -1.824 4.605 1.00 74.51 H new ATOM 0 HD11 LEU A 60 -28.417 -1.760 4.023 1.00 63.21 H new ATOM 0 HD12 LEU A 60 -29.424 -1.006 2.763 1.00 63.21 H new ATOM 0 HD13 LEU A 60 -28.501 0.013 3.893 1.00 63.21 H new ATOM 0 HD21 LEU A 60 -29.114 -1.683 6.389 1.00 1.41 H new ATOM 0 HD22 LEU A 60 -29.225 0.093 6.348 1.00 1.41 H new ATOM 0 HD23 LEU A 60 -30.629 -0.875 6.856 1.00 1.41 H new ATOM 898 N VAL A 61 -34.669 0.877 3.875 1.00 0.20 N ATOM 899 CA VAL A 61 -35.592 1.829 3.269 1.00 71.21 C ATOM 900 C VAL A 61 -37.040 1.401 3.478 1.00 70.32 C ATOM 901 O VAL A 61 -37.423 0.282 3.139 1.00 31.11 O ATOM 902 CB VAL A 61 -35.326 1.983 1.759 1.00 31.34 C ATOM 903 CG1 VAL A 61 -36.416 2.823 1.108 1.00 4.22 C ATOM 904 CG2 VAL A 61 -33.955 2.597 1.520 1.00 2.31 C ATOM 0 H VAL A 61 -35.021 -0.079 3.923 1.00 0.20 H new ATOM 0 HA VAL A 61 -35.426 2.788 3.760 1.00 71.21 H new ATOM 0 HB VAL A 61 -35.341 0.994 1.302 1.00 31.34 H new ATOM 0 HG11 VAL A 61 -36.212 2.921 0.042 1.00 4.22 H new ATOM 0 HG12 VAL A 61 -37.382 2.338 1.249 1.00 4.22 H new ATOM 0 HG13 VAL A 61 -36.436 3.812 1.566 1.00 4.22 H new ATOM 0 HG21 VAL A 61 -33.784 2.699 0.448 1.00 2.31 H new ATOM 0 HG22 VAL A 61 -33.910 3.580 1.989 1.00 2.31 H new ATOM 0 HG23 VAL A 61 -33.188 1.953 1.951 1.00 2.31 H new ATOM 914 N GLY A 62 -37.842 2.302 4.039 1.00 71.04 N ATOM 915 CA GLY A 62 -39.240 1.999 4.284 1.00 31.12 C ATOM 916 C GLY A 62 -40.133 2.408 3.129 1.00 34.53 C ATOM 917 O GLY A 62 -40.416 3.590 2.943 1.00 41.31 O ATOM 0 H GLY A 62 -37.548 3.235 4.328 1.00 71.04 H new ATOM 0 HA2 GLY A 62 -39.351 0.930 4.464 1.00 31.12 H new ATOM 0 HA3 GLY A 62 -39.566 2.510 5.190 1.00 31.12 H new ATOM 921 N LYS A 63 -40.576 1.426 2.350 1.00 64.14 N ATOM 922 CA LYS A 63 -41.441 1.689 1.207 1.00 33.22 C ATOM 923 C LYS A 63 -42.514 0.613 1.078 1.00 20.52 C ATOM 924 O LYS A 63 -42.263 -0.466 0.541 1.00 13.53 O ATOM 925 CB LYS A 63 -40.615 1.757 -0.079 1.00 74.02 C ATOM 926 CG LYS A 63 -41.347 2.411 -1.239 1.00 20.40 C ATOM 927 CD LYS A 63 -40.395 2.776 -2.365 1.00 71.32 C ATOM 928 CE LYS A 63 -40.790 2.102 -3.670 1.00 42.40 C ATOM 929 NZ LYS A 63 -42.208 2.379 -4.030 1.00 61.51 N1+ ATOM 0 H LYS A 63 -40.350 0.441 2.490 1.00 64.14 H new ATOM 0 HA LYS A 63 -41.931 2.649 1.368 1.00 33.22 H new ATOM 0 HB2 LYS A 63 -39.697 2.310 0.118 1.00 74.02 H new ATOM 0 HB3 LYS A 63 -40.324 0.747 -0.367 1.00 74.02 H new ATOM 0 HG2 LYS A 63 -42.114 1.733 -1.615 1.00 20.40 H new ATOM 0 HG3 LYS A 63 -41.858 3.308 -0.889 1.00 20.40 H new ATOM 0 HD2 LYS A 63 -40.388 3.858 -2.501 1.00 71.32 H new ATOM 0 HD3 LYS A 63 -39.381 2.482 -2.095 1.00 71.32 H new ATOM 0 HE2 LYS A 63 -40.137 2.450 -4.471 1.00 42.40 H new ATOM 0 HE3 LYS A 63 -40.641 1.026 -3.583 1.00 42.40 H new ATOM 0 HZ1 LYS A 63 -42.260 2.690 -5.021 1.00 61.51 H new ATOM 0 HZ2 LYS A 63 -42.772 1.514 -3.908 1.00 61.51 H new ATOM 0 HZ3 LYS A 63 -42.583 3.127 -3.412 1.00 61.51 H new ATOM 943 N VAL A 64 -43.711 0.913 1.572 1.00 71.05 N ATOM 944 CA VAL A 64 -44.822 -0.028 1.510 1.00 72.21 C ATOM 945 C VAL A 64 -46.106 0.666 1.070 1.00 72.14 C ATOM 946 O VAL A 64 -46.459 1.728 1.585 1.00 61.31 O ATOM 947 CB VAL A 64 -45.060 -0.709 2.871 1.00 41.14 C ATOM 948 CG1 VAL A 64 -44.049 -1.823 3.095 1.00 41.34 C ATOM 949 CG2 VAL A 64 -44.995 0.314 3.996 1.00 71.41 C ATOM 0 H VAL A 64 -43.936 1.801 2.020 1.00 71.05 H new ATOM 0 HA VAL A 64 -44.552 -0.787 0.776 1.00 72.21 H new ATOM 0 HB VAL A 64 -46.057 -1.150 2.868 1.00 41.14 H new ATOM 0 HG11 VAL A 64 -44.233 -2.292 4.061 1.00 41.34 H new ATOM 0 HG12 VAL A 64 -44.147 -2.568 2.305 1.00 41.34 H new ATOM 0 HG13 VAL A 64 -43.041 -1.408 3.079 1.00 41.34 H new ATOM 0 HG21 VAL A 64 -45.165 -0.184 4.951 1.00 71.41 H new ATOM 0 HG22 VAL A 64 -44.012 0.785 4.003 1.00 71.41 H new ATOM 0 HG23 VAL A 64 -45.761 1.074 3.841 1.00 71.41 H new ATOM 959 N THR A 65 -46.803 0.059 0.114 1.00 75.31 N ATOM 960 CA THR A 65 -48.049 0.619 -0.396 1.00 21.11 C ATOM 961 C THR A 65 -49.246 -0.217 0.041 1.00 50.33 C ATOM 962 O THR A 65 -49.133 -1.411 0.317 1.00 22.30 O ATOM 963 CB THR A 65 -48.035 0.711 -1.933 1.00 51.22 C ATOM 964 OG1 THR A 65 -47.077 -0.207 -2.471 1.00 52.43 O ATOM 965 CG2 THR A 65 -47.699 2.125 -2.387 1.00 65.41 C ATOM 0 H THR A 65 -46.526 -0.820 -0.323 1.00 75.31 H new ATOM 0 HA THR A 65 -48.139 1.623 0.020 1.00 21.11 H new ATOM 0 HB THR A 65 -49.029 0.454 -2.299 1.00 51.22 H new ATOM 0 HG1 THR A 65 -47.076 -0.143 -3.449 1.00 52.43 H new ATOM 0 HG21 THR A 65 -47.695 2.166 -3.476 1.00 65.41 H new ATOM 0 HG22 THR A 65 -48.446 2.818 -2.001 1.00 65.41 H new ATOM 0 HG23 THR A 65 -46.715 2.404 -2.010 1.00 65.41 H new ATOM 973 N PRO A 66 -50.424 0.424 0.105 1.00 71.34 N ATOM 974 CA PRO A 66 -51.666 -0.243 0.506 1.00 72.00 C ATOM 975 C PRO A 66 -52.154 -1.240 -0.540 1.00 31.14 C ATOM 976 O PRO A 66 -51.772 -1.166 -1.708 1.00 4.01 O ATOM 977 CB PRO A 66 -52.659 0.913 0.647 1.00 54.11 C ATOM 978 CG PRO A 66 -52.130 1.979 -0.249 1.00 72.32 C ATOM 979 CD PRO A 66 -50.633 1.846 -0.210 1.00 51.54 C ATOM 0 HA PRO A 66 -51.538 -0.828 1.417 1.00 72.00 H new ATOM 0 HB2 PRO A 66 -53.664 0.610 0.352 1.00 54.11 H new ATOM 0 HB3 PRO A 66 -52.721 1.258 1.679 1.00 54.11 H new ATOM 0 HG2 PRO A 66 -52.506 1.858 -1.265 1.00 72.32 H new ATOM 0 HG3 PRO A 66 -52.443 2.966 0.091 1.00 72.32 H new ATOM 0 HD2 PRO A 66 -50.181 2.117 -1.164 1.00 51.54 H new ATOM 0 HD3 PRO A 66 -50.192 2.494 0.547 1.00 51.54 H new ATOM 987 N LYS A 67 -52.999 -2.172 -0.114 1.00 13.34 N ATOM 988 CA LYS A 67 -53.541 -3.182 -1.014 1.00 22.03 C ATOM 989 C LYS A 67 -55.055 -3.296 -0.858 1.00 61.40 C ATOM 990 O LYS A 67 -55.572 -3.319 0.258 1.00 45.12 O ATOM 991 CB LYS A 67 -52.888 -4.540 -0.743 1.00 13.12 C ATOM 992 CG LYS A 67 -51.566 -4.734 -1.467 1.00 24.12 C ATOM 993 CD LYS A 67 -51.124 -6.187 -1.440 1.00 43.33 C ATOM 994 CE LYS A 67 -51.942 -7.036 -2.402 1.00 51.24 C ATOM 995 NZ LYS A 67 -51.670 -6.682 -3.823 1.00 22.33 N1+ ATOM 0 H LYS A 67 -53.324 -2.249 0.850 1.00 13.34 H new ATOM 0 HA LYS A 67 -53.320 -2.876 -2.037 1.00 22.03 H new ATOM 0 HB2 LYS A 67 -52.725 -4.648 0.329 1.00 13.12 H new ATOM 0 HB3 LYS A 67 -53.576 -5.331 -1.042 1.00 13.12 H new ATOM 0 HG2 LYS A 67 -51.664 -4.402 -2.500 1.00 24.12 H new ATOM 0 HG3 LYS A 67 -50.801 -4.111 -1.003 1.00 24.12 H new ATOM 0 HD2 LYS A 67 -50.068 -6.252 -1.703 1.00 43.33 H new ATOM 0 HD3 LYS A 67 -51.226 -6.581 -0.429 1.00 43.33 H new ATOM 0 HE2 LYS A 67 -51.714 -8.090 -2.240 1.00 51.24 H new ATOM 0 HE3 LYS A 67 -53.003 -6.903 -2.191 1.00 51.24 H new ATOM 0 HZ1 LYS A 67 -52.551 -6.366 -4.277 1.00 22.33 H new ATOM 0 HZ2 LYS A 67 -50.967 -5.917 -3.862 1.00 22.33 H new ATOM 0 HZ3 LYS A 67 -51.302 -7.516 -4.324 1.00 22.33 H new ATOM 1009 N GLY A 68 -55.758 -3.366 -1.984 1.00 41.33 N ATOM 1010 CA GLY A 68 -57.205 -3.477 -1.949 1.00 62.55 C ATOM 1011 C GLY A 68 -57.671 -4.849 -1.506 1.00 22.32 C ATOM 1012 O GLY A 68 -56.874 -5.785 -1.415 1.00 24.52 O ATOM 0 H GLY A 68 -55.352 -3.348 -2.919 1.00 41.33 H new ATOM 0 HA2 GLY A 68 -57.608 -2.724 -1.272 1.00 62.55 H new ATOM 0 HA3 GLY A 68 -57.607 -3.263 -2.939 1.00 62.55 H new ATOM 1016 N VAL A 69 -58.964 -4.973 -1.226 1.00 13.52 N ATOM 1017 CA VAL A 69 -59.535 -6.241 -0.789 1.00 23.11 C ATOM 1018 C VAL A 69 -60.133 -7.008 -1.963 1.00 22.23 C ATOM 1019 O VAL A 69 -60.251 -8.234 -1.923 1.00 32.21 O ATOM 1020 CB VAL A 69 -60.624 -6.028 0.280 1.00 70.31 C ATOM 1021 CG1 VAL A 69 -60.027 -5.412 1.535 1.00 51.03 C ATOM 1022 CG2 VAL A 69 -61.745 -5.159 -0.270 1.00 34.25 C ATOM 0 H VAL A 69 -59.637 -4.209 -1.294 1.00 13.52 H new ATOM 0 HA VAL A 69 -58.721 -6.822 -0.356 1.00 23.11 H new ATOM 0 HB VAL A 69 -61.044 -6.998 0.546 1.00 70.31 H new ATOM 0 HG11 VAL A 69 -60.811 -5.269 2.279 1.00 51.03 H new ATOM 0 HG12 VAL A 69 -59.262 -6.076 1.938 1.00 51.03 H new ATOM 0 HG13 VAL A 69 -59.579 -4.449 1.290 1.00 51.03 H new ATOM 0 HG21 VAL A 69 -62.506 -5.018 0.497 1.00 34.25 H new ATOM 0 HG22 VAL A 69 -61.343 -4.190 -0.564 1.00 34.25 H new ATOM 0 HG23 VAL A 69 -62.190 -5.646 -1.138 1.00 34.25 H new ATOM 1032 N THR A 70 -60.510 -6.279 -3.009 1.00 55.35 N ATOM 1033 CA THR A 70 -61.097 -6.891 -4.194 1.00 0.23 C ATOM 1034 C THR A 70 -60.050 -7.660 -4.993 1.00 24.22 C ATOM 1035 O THR A 70 -60.363 -8.653 -5.646 1.00 33.12 O ATOM 1036 CB THR A 70 -61.747 -5.834 -5.108 1.00 23.51 C ATOM 1037 OG1 THR A 70 -62.359 -4.811 -4.314 1.00 74.35 O ATOM 1038 CG2 THR A 70 -62.789 -6.471 -6.015 1.00 3.05 C ATOM 0 H THR A 70 -60.419 -5.264 -3.059 1.00 55.35 H new ATOM 0 HA THR A 70 -61.864 -7.582 -3.845 1.00 0.23 H new ATOM 0 HB THR A 70 -60.968 -5.393 -5.730 1.00 23.51 H new ATOM 0 HG1 THR A 70 -62.768 -4.142 -4.901 1.00 74.35 H new ATOM 0 HG21 THR A 70 -63.234 -5.706 -6.651 1.00 3.05 H new ATOM 0 HG22 THR A 70 -62.315 -7.229 -6.638 1.00 3.05 H new ATOM 0 HG23 THR A 70 -63.566 -6.935 -5.407 1.00 3.05 H new ATOM 1046 N GLU A 71 -58.807 -7.194 -4.931 1.00 11.11 N ATOM 1047 CA GLU A 71 -57.714 -7.839 -5.649 1.00 34.23 C ATOM 1048 C GLU A 71 -56.848 -8.660 -4.698 1.00 23.33 C ATOM 1049 O GLU A 71 -55.620 -8.560 -4.715 1.00 53.31 O ATOM 1050 CB GLU A 71 -56.856 -6.794 -6.365 1.00 54.35 C ATOM 1051 CG GLU A 71 -55.957 -7.378 -7.442 1.00 72.01 C ATOM 1052 CD GLU A 71 -56.740 -7.931 -8.617 1.00 25.40 C ATOM 1053 OE1 GLU A 71 -57.836 -7.405 -8.900 1.00 5.12 O ATOM 1054 OE2 GLU A 71 -56.256 -8.891 -9.253 1.00 23.50 O1- ATOM 0 H GLU A 71 -58.532 -6.373 -4.392 1.00 11.11 H new ATOM 0 HA GLU A 71 -58.147 -8.511 -6.390 1.00 34.23 H new ATOM 0 HB2 GLU A 71 -57.509 -6.046 -6.815 1.00 54.35 H new ATOM 0 HB3 GLU A 71 -56.239 -6.277 -5.630 1.00 54.35 H new ATOM 0 HG2 GLU A 71 -55.273 -6.607 -7.796 1.00 72.01 H new ATOM 0 HG3 GLU A 71 -55.347 -8.172 -7.010 1.00 72.01 H new ATOM 1061 N LEU A 72 -57.496 -9.471 -3.869 1.00 12.50 N ATOM 1062 CA LEU A 72 -56.785 -10.309 -2.908 1.00 60.42 C ATOM 1063 C LEU A 72 -56.377 -11.636 -3.542 1.00 51.14 C ATOM 1064 O LEU A 72 -56.855 -11.996 -4.617 1.00 34.14 O ATOM 1065 CB LEU A 72 -57.661 -10.565 -1.681 1.00 44.10 C ATOM 1066 CG LEU A 72 -57.735 -9.429 -0.661 1.00 41.21 C ATOM 1067 CD1 LEU A 72 -58.785 -9.729 0.398 1.00 14.22 C ATOM 1068 CD2 LEU A 72 -56.375 -9.201 -0.016 1.00 4.04 C ATOM 0 H LEU A 72 -58.511 -9.567 -3.842 1.00 12.50 H new ATOM 0 HA LEU A 72 -55.882 -9.782 -2.599 1.00 60.42 H new ATOM 0 HB2 LEU A 72 -58.672 -10.787 -2.021 1.00 44.10 H new ATOM 0 HB3 LEU A 72 -57.292 -11.457 -1.175 1.00 44.10 H new ATOM 0 HG LEU A 72 -58.025 -8.517 -1.183 1.00 41.21 H new ATOM 0 HD11 LEU A 72 -58.823 -8.909 1.115 1.00 14.22 H new ATOM 0 HD12 LEU A 72 -59.760 -9.841 -0.077 1.00 14.22 H new ATOM 0 HD13 LEU A 72 -58.526 -10.652 0.916 1.00 14.22 H new ATOM 0 HD21 LEU A 72 -56.447 -8.389 0.707 1.00 4.04 H new ATOM 0 HD22 LEU A 72 -56.056 -10.111 0.491 1.00 4.04 H new ATOM 0 HD23 LEU A 72 -55.647 -8.939 -0.784 1.00 4.04 H new ATOM 1080 N THR A 73 -55.490 -12.359 -2.866 1.00 73.31 N ATOM 1081 CA THR A 73 -55.018 -13.647 -3.361 1.00 33.52 C ATOM 1082 C THR A 73 -55.815 -14.796 -2.754 1.00 24.20 C ATOM 1083 O THR A 73 -56.631 -14.591 -1.856 1.00 22.42 O ATOM 1084 CB THR A 73 -53.523 -13.853 -3.050 1.00 30.40 C ATOM 1085 OG1 THR A 73 -53.275 -13.617 -1.660 1.00 65.52 O ATOM 1086 CG2 THR A 73 -52.661 -12.922 -3.890 1.00 71.53 C ATOM 0 H THR A 73 -55.084 -12.075 -1.974 1.00 73.31 H new ATOM 0 HA THR A 73 -55.160 -13.642 -4.442 1.00 33.52 H new ATOM 0 HB THR A 73 -53.262 -14.882 -3.296 1.00 30.40 H new ATOM 0 HG1 THR A 73 -52.323 -13.752 -1.470 1.00 65.52 H new ATOM 0 HG21 THR A 73 -51.610 -13.086 -3.652 1.00 71.53 H new ATOM 0 HG22 THR A 73 -52.830 -13.125 -4.948 1.00 71.53 H new ATOM 0 HG23 THR A 73 -52.925 -11.887 -3.673 1.00 71.53 H new ATOM 1094 N ALA A 74 -55.574 -16.004 -3.252 1.00 25.51 N ATOM 1095 CA ALA A 74 -56.269 -17.185 -2.756 1.00 22.05 C ATOM 1096 C ALA A 74 -55.885 -17.483 -1.311 1.00 64.11 C ATOM 1097 O ALA A 74 -56.662 -18.074 -0.562 1.00 22.20 O ATOM 1098 CB ALA A 74 -55.966 -18.385 -3.642 1.00 52.43 C ATOM 0 H ALA A 74 -54.904 -16.190 -3.998 1.00 25.51 H new ATOM 0 HA ALA A 74 -57.340 -16.985 -2.785 1.00 22.05 H new ATOM 0 HB1 ALA A 74 -56.491 -19.261 -3.261 1.00 52.43 H new ATOM 0 HB2 ALA A 74 -56.297 -18.178 -4.660 1.00 52.43 H new ATOM 0 HB3 ALA A 74 -54.893 -18.576 -3.641 1.00 52.43 H new ATOM 1104 N GLU A 75 -54.682 -17.070 -0.926 1.00 71.15 N ATOM 1105 CA GLU A 75 -54.195 -17.293 0.430 1.00 23.11 C ATOM 1106 C GLU A 75 -54.822 -16.300 1.404 1.00 12.34 C ATOM 1107 O GLU A 75 -55.085 -16.630 2.560 1.00 50.21 O ATOM 1108 CB GLU A 75 -52.671 -17.175 0.476 1.00 42.41 C ATOM 1109 CG GLU A 75 -51.962 -18.038 -0.555 1.00 25.54 C ATOM 1110 CD GLU A 75 -50.472 -18.147 -0.300 1.00 73.13 C ATOM 1111 OE1 GLU A 75 -50.087 -18.810 0.687 1.00 41.51 O ATOM 1112 OE2 GLU A 75 -49.691 -17.572 -1.086 1.00 65.41 O1- ATOM 0 H GLU A 75 -54.027 -16.579 -1.534 1.00 71.15 H new ATOM 0 HA GLU A 75 -54.483 -18.301 0.729 1.00 23.11 H new ATOM 0 HB2 GLU A 75 -52.391 -16.133 0.320 1.00 42.41 H new ATOM 0 HB3 GLU A 75 -52.323 -17.453 1.471 1.00 42.41 H new ATOM 0 HG2 GLU A 75 -52.401 -19.036 -0.552 1.00 25.54 H new ATOM 0 HG3 GLU A 75 -52.127 -17.620 -1.548 1.00 25.54 H new ATOM 1119 N GLU A 76 -55.058 -15.082 0.928 1.00 50.31 N ATOM 1120 CA GLU A 76 -55.652 -14.039 1.756 1.00 72.21 C ATOM 1121 C GLU A 76 -57.163 -14.225 1.865 1.00 22.24 C ATOM 1122 O GLU A 76 -57.729 -14.168 2.956 1.00 10.21 O ATOM 1123 CB GLU A 76 -55.338 -12.657 1.180 1.00 62.24 C ATOM 1124 CG GLU A 76 -53.851 -12.355 1.098 1.00 64.30 C ATOM 1125 CD GLU A 76 -53.275 -11.897 2.424 1.00 33.44 C ATOM 1126 OE1 GLU A 76 -54.044 -11.371 3.256 1.00 31.41 O ATOM 1127 OE2 GLU A 76 -52.055 -12.066 2.630 1.00 3.21 O1- ATOM 0 H GLU A 76 -54.847 -14.793 -0.027 1.00 50.31 H new ATOM 0 HA GLU A 76 -55.221 -14.115 2.754 1.00 72.21 H new ATOM 0 HB2 GLU A 76 -55.771 -12.582 0.183 1.00 62.24 H new ATOM 0 HB3 GLU A 76 -55.821 -11.898 1.795 1.00 62.24 H new ATOM 0 HG2 GLU A 76 -53.321 -13.247 0.764 1.00 64.30 H new ATOM 0 HG3 GLU A 76 -53.682 -11.584 0.347 1.00 64.30 H new ATOM 1134 N ARG A 77 -57.809 -14.448 0.724 1.00 60.41 N ATOM 1135 CA ARG A 77 -59.254 -14.641 0.690 1.00 75.45 C ATOM 1136 C ARG A 77 -59.682 -15.718 1.683 1.00 5.25 C ATOM 1137 O ARG A 77 -60.758 -15.637 2.276 1.00 54.11 O ATOM 1138 CB ARG A 77 -59.705 -15.024 -0.721 1.00 61.41 C ATOM 1139 CG ARG A 77 -59.360 -16.454 -1.104 1.00 55.33 C ATOM 1140 CD ARG A 77 -59.901 -16.808 -2.481 1.00 52.34 C ATOM 1141 NE ARG A 77 -61.353 -16.965 -2.474 1.00 62.33 N ATOM 1142 CZ ARG A 77 -61.974 -18.040 -2.001 1.00 34.33 C ATOM 1143 NH1 ARG A 77 -61.273 -19.047 -1.499 1.00 23.02 N1+ ATOM 1144 NH2 ARG A 77 -63.299 -18.108 -2.031 1.00 22.33 N ATOM 0 H ARG A 77 -57.355 -14.499 -0.188 1.00 60.41 H new ATOM 0 HA ARG A 77 -59.728 -13.701 0.973 1.00 75.45 H new ATOM 0 HB2 ARG A 77 -60.783 -14.886 -0.798 1.00 61.41 H new ATOM 0 HB3 ARG A 77 -59.245 -14.344 -1.438 1.00 61.41 H new ATOM 0 HG2 ARG A 77 -58.278 -16.584 -1.093 1.00 55.33 H new ATOM 0 HG3 ARG A 77 -59.771 -17.140 -0.363 1.00 55.33 H new ATOM 0 HD2 ARG A 77 -59.624 -16.029 -3.191 1.00 52.34 H new ATOM 0 HD3 ARG A 77 -59.438 -17.733 -2.826 1.00 52.34 H new ATOM 0 HE ARG A 77 -61.922 -16.208 -2.853 1.00 62.33 H new ATOM 0 HH11 ARG A 77 -60.254 -18.998 -1.475 1.00 23.02 H new ATOM 0 HH12 ARG A 77 -61.752 -19.871 -1.136 1.00 23.02 H new ATOM 0 HH21 ARG A 77 -63.841 -17.335 -2.417 1.00 22.33 H new ATOM 0 HH22 ARG A 77 -63.776 -18.933 -1.668 1.00 22.33 H new ATOM 1158 N LEU A 78 -58.834 -16.726 1.856 1.00 4.11 N ATOM 1159 CA LEU A 78 -59.124 -17.820 2.777 1.00 63.30 C ATOM 1160 C LEU A 78 -58.721 -17.454 4.201 1.00 1.51 C ATOM 1161 O LEU A 78 -59.277 -17.977 5.169 1.00 72.43 O ATOM 1162 CB LEU A 78 -58.393 -19.089 2.337 1.00 62.25 C ATOM 1163 CG LEU A 78 -56.985 -19.283 2.902 1.00 4.10 C ATOM 1164 CD1 LEU A 78 -57.038 -20.027 4.226 1.00 71.01 C ATOM 1165 CD2 LEU A 78 -56.109 -20.026 1.904 1.00 24.05 C ATOM 0 H LEU A 78 -57.940 -16.809 1.371 1.00 4.11 H new ATOM 0 HA LEU A 78 -60.198 -18.003 2.760 1.00 63.30 H new ATOM 0 HB2 LEU A 78 -58.998 -19.950 2.621 1.00 62.25 H new ATOM 0 HB3 LEU A 78 -58.329 -19.089 1.249 1.00 62.25 H new ATOM 0 HG LEU A 78 -56.547 -18.301 3.080 1.00 4.10 H new ATOM 0 HD11 LEU A 78 -56.027 -20.155 4.612 1.00 71.01 H new ATOM 0 HD12 LEU A 78 -57.630 -19.455 4.941 1.00 71.01 H new ATOM 0 HD13 LEU A 78 -57.496 -21.005 4.076 1.00 71.01 H new ATOM 0 HD21 LEU A 78 -55.111 -20.156 2.322 1.00 24.05 H new ATOM 0 HD22 LEU A 78 -56.544 -21.003 1.695 1.00 24.05 H new ATOM 0 HD23 LEU A 78 -56.044 -19.452 0.980 1.00 24.05 H new ATOM 1177 N LEU A 79 -57.754 -16.553 4.324 1.00 73.12 N ATOM 1178 CA LEU A 79 -57.277 -16.115 5.631 1.00 25.52 C ATOM 1179 C LEU A 79 -58.423 -15.556 6.470 1.00 13.43 C ATOM 1180 O LEU A 79 -58.455 -15.726 7.689 1.00 45.51 O ATOM 1181 CB LEU A 79 -56.185 -15.056 5.469 1.00 42.42 C ATOM 1182 CG LEU A 79 -55.136 -14.998 6.581 1.00 44.11 C ATOM 1183 CD1 LEU A 79 -54.164 -16.162 6.458 1.00 40.45 C ATOM 1184 CD2 LEU A 79 -54.391 -13.671 6.543 1.00 24.32 C ATOM 0 H LEU A 79 -57.284 -16.111 3.534 1.00 73.12 H new ATOM 0 HA LEU A 79 -56.862 -16.980 6.147 1.00 25.52 H new ATOM 0 HB2 LEU A 79 -55.673 -15.232 4.523 1.00 42.42 H new ATOM 0 HB3 LEU A 79 -56.662 -14.079 5.396 1.00 42.42 H new ATOM 0 HG LEU A 79 -55.646 -15.077 7.541 1.00 44.11 H new ATOM 0 HD11 LEU A 79 -53.425 -16.105 7.257 1.00 40.45 H new ATOM 0 HD12 LEU A 79 -54.710 -17.102 6.536 1.00 40.45 H new ATOM 0 HD13 LEU A 79 -53.659 -16.114 5.493 1.00 40.45 H new ATOM 0 HD21 LEU A 79 -53.649 -13.647 7.341 1.00 24.32 H new ATOM 0 HD22 LEU A 79 -53.892 -13.561 5.580 1.00 24.32 H new ATOM 0 HD23 LEU A 79 -55.098 -12.853 6.681 1.00 24.32 H new ATOM 1196 N HIS A 80 -59.364 -14.890 5.807 1.00 75.01 N ATOM 1197 CA HIS A 80 -60.514 -14.308 6.491 1.00 1.10 C ATOM 1198 C HIS A 80 -61.272 -15.372 7.280 1.00 41.42 C ATOM 1199 O HIS A 80 -61.909 -15.072 8.289 1.00 43.25 O ATOM 1200 CB HIS A 80 -61.450 -13.642 5.483 1.00 42.21 C ATOM 1201 CG HIS A 80 -61.127 -12.201 5.229 1.00 54.33 C ATOM 1202 ND1 HIS A 80 -60.383 -11.776 4.149 1.00 50.24 N ATOM 1203 CD2 HIS A 80 -61.455 -11.085 5.921 1.00 45.33 C ATOM 1204 CE1 HIS A 80 -60.264 -10.460 4.189 1.00 33.42 C ATOM 1205 NE2 HIS A 80 -60.907 -10.017 5.254 1.00 55.02 N ATOM 0 H HIS A 80 -59.353 -14.740 4.798 1.00 75.01 H new ATOM 0 HA HIS A 80 -60.148 -13.555 7.189 1.00 1.10 H new ATOM 0 HB2 HIS A 80 -61.404 -14.188 4.541 1.00 42.21 H new ATOM 0 HB3 HIS A 80 -62.475 -13.718 5.846 1.00 42.21 H new ATOM 0 HD1 HIS A 80 -59.986 -12.382 3.431 1.00 50.24 H new ATOM 0 HD2 HIS A 80 -62.039 -11.042 6.829 1.00 45.33 H new ATOM 0 HE1 HIS A 80 -59.732 -9.851 3.473 1.00 33.42 H new ATOM 1213 N ALA A 81 -61.197 -16.614 6.812 1.00 63.15 N ATOM 1214 CA ALA A 81 -61.874 -17.721 7.475 1.00 52.51 C ATOM 1215 C ALA A 81 -61.131 -18.143 8.738 1.00 71.02 C ATOM 1216 O ALA A 81 -61.729 -18.682 9.671 1.00 50.32 O ATOM 1217 CB ALA A 81 -62.013 -18.900 6.524 1.00 34.12 C ATOM 0 H ALA A 81 -60.674 -16.878 5.977 1.00 63.15 H new ATOM 0 HA ALA A 81 -62.869 -17.383 7.766 1.00 52.51 H new ATOM 0 HB1 ALA A 81 -62.520 -19.720 7.033 1.00 34.12 H new ATOM 0 HB2 ALA A 81 -62.594 -18.598 5.653 1.00 34.12 H new ATOM 0 HB3 ALA A 81 -61.024 -19.228 6.204 1.00 34.12 H new ATOM 1223 N ILE A 82 -59.826 -17.895 8.762 1.00 14.21 N ATOM 1224 CA ILE A 82 -59.002 -18.249 9.911 1.00 11.44 C ATOM 1225 C ILE A 82 -59.217 -17.274 11.063 1.00 25.11 C ATOM 1226 O ILE A 82 -59.634 -17.666 12.153 1.00 24.25 O ATOM 1227 CB ILE A 82 -57.506 -18.273 9.546 1.00 54.10 C ATOM 1228 CG1 ILE A 82 -57.290 -19.036 8.237 1.00 55.43 C ATOM 1229 CG2 ILE A 82 -56.696 -18.899 10.670 1.00 73.32 C ATOM 1230 CD1 ILE A 82 -55.841 -19.102 7.808 1.00 45.00 C ATOM 0 H ILE A 82 -59.316 -17.450 7.999 1.00 14.21 H new ATOM 0 HA ILE A 82 -59.307 -19.248 10.222 1.00 11.44 H new ATOM 0 HB ILE A 82 -57.165 -17.247 9.407 1.00 54.10 H new ATOM 0 HG12 ILE A 82 -57.674 -20.050 8.349 1.00 55.43 H new ATOM 0 HG13 ILE A 82 -57.873 -18.560 7.448 1.00 55.43 H new ATOM 0 HG21 ILE A 82 -55.641 -18.909 10.397 1.00 73.32 H new ATOM 0 HG22 ILE A 82 -56.829 -18.317 11.582 1.00 73.32 H new ATOM 0 HG23 ILE A 82 -57.036 -19.921 10.838 1.00 73.32 H new ATOM 0 HD11 ILE A 82 -55.763 -19.657 6.873 1.00 45.00 H new ATOM 0 HD12 ILE A 82 -55.458 -18.092 7.663 1.00 45.00 H new ATOM 0 HD13 ILE A 82 -55.256 -19.605 8.578 1.00 45.00 H new ATOM 1242 N PHE A 83 -58.931 -16.000 10.813 1.00 72.31 N ATOM 1243 CA PHE A 83 -59.093 -14.967 11.830 1.00 63.53 C ATOM 1244 C PHE A 83 -60.568 -14.627 12.028 1.00 3.44 C ATOM 1245 O PHE A 83 -60.973 -14.172 13.098 1.00 52.42 O ATOM 1246 CB PHE A 83 -58.316 -13.708 11.437 1.00 53.14 C ATOM 1247 CG PHE A 83 -56.996 -13.576 12.141 1.00 4.12 C ATOM 1248 CD1 PHE A 83 -56.077 -14.612 12.118 1.00 53.02 C ATOM 1249 CD2 PHE A 83 -56.674 -12.414 12.825 1.00 44.11 C ATOM 1250 CE1 PHE A 83 -54.861 -14.493 12.765 1.00 32.53 C ATOM 1251 CE2 PHE A 83 -55.460 -12.290 13.473 1.00 2.50 C ATOM 1252 CZ PHE A 83 -54.553 -13.330 13.443 1.00 24.31 C ATOM 0 H PHE A 83 -58.586 -15.659 9.916 1.00 72.31 H new ATOM 0 HA PHE A 83 -58.697 -15.351 12.770 1.00 63.53 H new ATOM 0 HB2 PHE A 83 -58.146 -13.717 10.360 1.00 53.14 H new ATOM 0 HB3 PHE A 83 -58.925 -12.831 11.656 1.00 53.14 H new ATOM 0 HD1 PHE A 83 -56.313 -15.523 11.589 1.00 53.02 H new ATOM 0 HD2 PHE A 83 -57.380 -11.597 12.852 1.00 44.11 H new ATOM 0 HE1 PHE A 83 -54.153 -15.308 12.740 1.00 32.53 H new ATOM 0 HE2 PHE A 83 -55.221 -11.380 14.003 1.00 2.50 H new ATOM 0 HZ PHE A 83 -53.604 -13.234 13.949 1.00 24.31 H new ATOM 1262 N GLY A 84 -61.366 -14.848 10.987 1.00 11.45 N ATOM 1263 CA GLY A 84 -62.785 -14.559 11.066 1.00 21.23 C ATOM 1264 C GLY A 84 -63.069 -13.075 11.191 1.00 34.15 C ATOM 1265 O GLY A 84 -64.153 -12.679 11.615 1.00 1.13 O ATOM 0 H GLY A 84 -61.054 -15.222 10.091 1.00 11.45 H new ATOM 0 HA2 GLY A 84 -63.282 -14.947 10.177 1.00 21.23 H new ATOM 0 HA3 GLY A 84 -63.212 -15.081 11.923 1.00 21.23 H new ATOM 1269 N GLU A 85 -62.091 -12.254 10.821 1.00 71.23 N ATOM 1270 CA GLU A 85 -62.241 -10.806 10.896 1.00 3.24 C ATOM 1271 C GLU A 85 -61.638 -10.132 9.667 1.00 45.31 C ATOM 1272 O GLU A 85 -60.831 -10.728 8.951 1.00 43.43 O ATOM 1273 CB GLU A 85 -61.577 -10.267 12.164 1.00 62.14 C ATOM 1274 CG GLU A 85 -62.224 -10.762 13.447 1.00 3.03 C ATOM 1275 CD GLU A 85 -61.760 -9.993 14.669 1.00 22.13 C ATOM 1276 OE1 GLU A 85 -60.546 -9.717 14.771 1.00 62.10 O ATOM 1277 OE2 GLU A 85 -62.611 -9.668 15.523 1.00 0.10 O1- ATOM 0 H GLU A 85 -61.187 -12.567 10.467 1.00 71.23 H new ATOM 0 HA GLU A 85 -63.306 -10.578 10.928 1.00 3.24 H new ATOM 0 HB2 GLU A 85 -60.525 -10.554 12.163 1.00 62.14 H new ATOM 0 HB3 GLU A 85 -61.611 -9.178 12.147 1.00 62.14 H new ATOM 0 HG2 GLU A 85 -63.307 -10.678 13.359 1.00 3.03 H new ATOM 0 HG3 GLU A 85 -61.996 -11.820 13.580 1.00 3.03 H new ATOM 1284 N LYS A 86 -62.032 -8.886 9.429 1.00 0.31 N ATOM 1285 CA LYS A 86 -61.532 -8.130 8.287 1.00 50.23 C ATOM 1286 C LYS A 86 -60.174 -7.509 8.600 1.00 62.42 C ATOM 1287 O LYS A 86 -60.079 -6.559 9.376 1.00 1.22 O ATOM 1288 CB LYS A 86 -62.527 -7.034 7.899 1.00 52.31 C ATOM 1289 CG LYS A 86 -63.849 -7.571 7.377 1.00 22.44 C ATOM 1290 CD LYS A 86 -64.993 -6.613 7.668 1.00 14.40 C ATOM 1291 CE LYS A 86 -66.343 -7.290 7.492 1.00 71.34 C ATOM 1292 NZ LYS A 86 -66.567 -7.725 6.085 1.00 0.31 N1+ ATOM 0 H LYS A 86 -62.697 -8.378 10.012 1.00 0.31 H new ATOM 0 HA LYS A 86 -61.415 -8.819 7.450 1.00 50.23 H new ATOM 0 HB2 LYS A 86 -62.718 -6.404 8.768 1.00 52.31 H new ATOM 0 HB3 LYS A 86 -62.076 -6.398 7.137 1.00 52.31 H new ATOM 0 HG2 LYS A 86 -63.777 -7.737 6.302 1.00 22.44 H new ATOM 0 HG3 LYS A 86 -64.057 -8.538 7.836 1.00 22.44 H new ATOM 0 HD2 LYS A 86 -64.904 -6.236 8.687 1.00 14.40 H new ATOM 0 HD3 LYS A 86 -64.927 -5.752 7.003 1.00 14.40 H new ATOM 0 HE2 LYS A 86 -66.405 -8.154 8.153 1.00 71.34 H new ATOM 0 HE3 LYS A 86 -67.135 -6.603 7.790 1.00 71.34 H new ATOM 0 HZ1 LYS A 86 -67.524 -8.120 5.992 1.00 0.31 H new ATOM 0 HZ2 LYS A 86 -66.466 -6.908 5.449 1.00 0.31 H new ATOM 0 HZ3 LYS A 86 -65.867 -8.451 5.830 1.00 0.31 H new ATOM 1306 N ALA A 87 -59.125 -8.052 7.990 1.00 21.22 N ATOM 1307 CA ALA A 87 -57.774 -7.550 8.200 1.00 63.11 C ATOM 1308 C ALA A 87 -57.283 -6.767 6.987 1.00 4.23 C ATOM 1309 O ALA A 87 -57.619 -7.094 5.848 1.00 21.02 O ATOM 1310 CB ALA A 87 -56.825 -8.698 8.508 1.00 2.10 C ATOM 0 H ALA A 87 -59.186 -8.840 7.346 1.00 21.22 H new ATOM 0 HA ALA A 87 -57.795 -6.872 9.053 1.00 63.11 H new ATOM 0 HB1 ALA A 87 -55.819 -8.307 8.662 1.00 2.10 H new ATOM 0 HB2 ALA A 87 -57.157 -9.212 9.410 1.00 2.10 H new ATOM 0 HB3 ALA A 87 -56.818 -9.398 7.673 1.00 2.10 H new ATOM 1316 N ARG A 88 -56.488 -5.731 7.238 1.00 51.52 N ATOM 1317 CA ARG A 88 -55.954 -4.902 6.165 1.00 72.01 C ATOM 1318 C ARG A 88 -54.682 -5.514 5.587 1.00 43.43 C ATOM 1319 O ARG A 88 -53.825 -6.001 6.325 1.00 52.35 O ATOM 1320 CB ARG A 88 -55.665 -3.490 6.680 1.00 64.15 C ATOM 1321 CG ARG A 88 -56.915 -2.708 7.049 1.00 10.34 C ATOM 1322 CD ARG A 88 -57.471 -1.950 5.854 1.00 52.23 C ATOM 1323 NE ARG A 88 -58.383 -0.883 6.258 1.00 54.25 N ATOM 1324 CZ ARG A 88 -59.212 -0.269 5.421 1.00 53.44 C ATOM 1325 NH1 ARG A 88 -59.244 -0.615 4.141 1.00 14.44 N1+ ATOM 1326 NH2 ARG A 88 -60.012 0.693 5.865 1.00 23.21 N ATOM 0 H ARG A 88 -56.200 -5.447 8.174 1.00 51.52 H new ATOM 0 HA ARG A 88 -56.702 -4.848 5.374 1.00 72.01 H new ATOM 0 HB2 ARG A 88 -55.017 -3.557 7.554 1.00 64.15 H new ATOM 0 HB3 ARG A 88 -55.115 -2.940 5.917 1.00 64.15 H new ATOM 0 HG2 ARG A 88 -57.673 -3.391 7.433 1.00 10.34 H new ATOM 0 HG3 ARG A 88 -56.683 -2.007 7.850 1.00 10.34 H new ATOM 0 HD2 ARG A 88 -56.648 -1.525 5.280 1.00 52.23 H new ATOM 0 HD3 ARG A 88 -57.994 -2.644 5.196 1.00 52.23 H new ATOM 0 HE ARG A 88 -58.383 -0.594 7.236 1.00 54.25 H new ATOM 0 HH11 ARG A 88 -58.631 -1.354 3.797 1.00 14.44 H new ATOM 0 HH12 ARG A 88 -59.882 -0.142 3.501 1.00 14.44 H new ATOM 0 HH21 ARG A 88 -59.990 0.961 6.849 1.00 23.21 H new ATOM 0 HH22 ARG A 88 -60.648 1.164 5.222 1.00 23.21 H new ATOM 1340 N GLU A 89 -54.565 -5.484 4.263 1.00 51.11 N ATOM 1341 CA GLU A 89 -53.398 -6.037 3.587 1.00 3.21 C ATOM 1342 C GLU A 89 -52.516 -4.925 3.028 1.00 11.30 C ATOM 1343 O GLU A 89 -53.004 -3.865 2.638 1.00 53.52 O ATOM 1344 CB GLU A 89 -53.832 -6.974 2.457 1.00 74.52 C ATOM 1345 CG GLU A 89 -54.878 -7.992 2.880 1.00 45.43 C ATOM 1346 CD GLU A 89 -56.293 -7.463 2.747 1.00 12.21 C ATOM 1347 OE1 GLU A 89 -56.454 -6.285 2.367 1.00 23.33 O ATOM 1348 OE2 GLU A 89 -57.240 -8.230 3.023 1.00 4.44 O1- ATOM 0 H GLU A 89 -55.264 -5.083 3.638 1.00 51.11 H new ATOM 0 HA GLU A 89 -52.821 -6.603 4.318 1.00 3.21 H new ATOM 0 HB2 GLU A 89 -54.228 -6.379 1.634 1.00 74.52 H new ATOM 0 HB3 GLU A 89 -52.957 -7.501 2.077 1.00 74.52 H new ATOM 0 HG2 GLU A 89 -54.771 -8.891 2.273 1.00 45.43 H new ATOM 0 HG3 GLU A 89 -54.699 -8.283 3.915 1.00 45.43 H new ATOM 1355 N VAL A 90 -51.210 -5.175 2.993 1.00 14.00 N ATOM 1356 CA VAL A 90 -50.258 -4.196 2.483 1.00 43.15 C ATOM 1357 C VAL A 90 -49.179 -4.867 1.640 1.00 34.22 C ATOM 1358 O VAL A 90 -48.903 -6.056 1.798 1.00 14.45 O ATOM 1359 CB VAL A 90 -49.586 -3.416 3.629 1.00 61.31 C ATOM 1360 CG1 VAL A 90 -48.565 -4.288 4.344 1.00 61.42 C ATOM 1361 CG2 VAL A 90 -48.937 -2.145 3.099 1.00 63.51 C ATOM 0 H VAL A 90 -50.788 -6.047 3.312 1.00 14.00 H new ATOM 0 HA VAL A 90 -50.822 -3.500 1.861 1.00 43.15 H new ATOM 0 HB VAL A 90 -50.353 -3.132 4.350 1.00 61.31 H new ATOM 0 HG11 VAL A 90 -48.101 -3.719 5.150 1.00 61.42 H new ATOM 0 HG12 VAL A 90 -49.062 -5.165 4.758 1.00 61.42 H new ATOM 0 HG13 VAL A 90 -47.799 -4.606 3.637 1.00 61.42 H new ATOM 0 HG21 VAL A 90 -48.467 -1.606 3.922 1.00 63.51 H new ATOM 0 HG22 VAL A 90 -48.182 -2.404 2.357 1.00 63.51 H new ATOM 0 HG23 VAL A 90 -49.697 -1.513 2.639 1.00 63.51 H new ATOM 1371 N ARG A 91 -48.572 -4.096 0.743 1.00 25.45 N ATOM 1372 CA ARG A 91 -47.522 -4.616 -0.126 1.00 3.45 C ATOM 1373 C ARG A 91 -46.190 -3.930 0.160 1.00 15.52 C ATOM 1374 O ARG A 91 -46.132 -2.712 0.336 1.00 10.53 O ATOM 1375 CB ARG A 91 -47.904 -4.421 -1.593 1.00 35.24 C ATOM 1376 CG ARG A 91 -47.195 -5.375 -2.540 1.00 1.41 C ATOM 1377 CD ARG A 91 -47.939 -5.510 -3.859 1.00 62.05 C ATOM 1378 NE ARG A 91 -47.088 -6.047 -4.916 1.00 32.31 N ATOM 1379 CZ ARG A 91 -46.715 -7.321 -4.984 1.00 62.40 C ATOM 1380 NH1 ARG A 91 -47.118 -8.183 -4.061 1.00 60.23 N1+ ATOM 1381 NH2 ARG A 91 -45.939 -7.734 -5.978 1.00 63.42 N ATOM 0 H ARG A 91 -48.789 -3.110 0.599 1.00 25.45 H new ATOM 0 HA ARG A 91 -47.412 -5.682 0.076 1.00 3.45 H new ATOM 0 HB2 ARG A 91 -48.981 -4.551 -1.699 1.00 35.24 H new ATOM 0 HB3 ARG A 91 -47.676 -3.396 -1.886 1.00 35.24 H new ATOM 0 HG2 ARG A 91 -46.183 -5.017 -2.728 1.00 1.41 H new ATOM 0 HG3 ARG A 91 -47.105 -6.355 -2.071 1.00 1.41 H new ATOM 0 HD2 ARG A 91 -48.802 -6.161 -3.723 1.00 62.05 H new ATOM 0 HD3 ARG A 91 -48.320 -4.535 -4.161 1.00 62.05 H new ATOM 0 HE ARG A 91 -46.762 -5.410 -5.642 1.00 32.31 H new ATOM 0 HH11 ARG A 91 -47.716 -7.869 -3.296 1.00 60.23 H new ATOM 0 HH12 ARG A 91 -46.830 -9.160 -4.115 1.00 60.23 H new ATOM 0 HH21 ARG A 91 -45.628 -7.074 -6.691 1.00 63.42 H new ATOM 0 HH22 ARG A 91 -45.653 -8.712 -6.029 1.00 63.42 H new ATOM 1395 N ASP A 92 -45.122 -4.719 0.206 1.00 43.34 N ATOM 1396 CA ASP A 92 -43.790 -4.188 0.470 1.00 22.20 C ATOM 1397 C ASP A 92 -43.007 -4.014 -0.828 1.00 4.24 C ATOM 1398 O ASP A 92 -42.522 -4.986 -1.409 1.00 43.15 O ATOM 1399 CB ASP A 92 -43.028 -5.112 1.420 1.00 42.30 C ATOM 1400 CG ASP A 92 -43.941 -5.804 2.412 1.00 10.14 C ATOM 1401 OD1 ASP A 92 -44.877 -5.146 2.915 1.00 24.00 O ATOM 1402 OD2 ASP A 92 -43.722 -7.002 2.685 1.00 53.42 O1- ATOM 0 H ASP A 92 -45.153 -5.729 0.064 1.00 43.34 H new ATOM 0 HA ASP A 92 -43.902 -3.211 0.939 1.00 22.20 H new ATOM 0 HB2 ASP A 92 -42.492 -5.863 0.839 1.00 42.30 H new ATOM 0 HB3 ASP A 92 -42.280 -4.534 1.962 1.00 42.30 H new ATOM 1407 N THR A 93 -42.890 -2.770 -1.282 1.00 3.24 N ATOM 1408 CA THR A 93 -42.169 -2.469 -2.511 1.00 15.11 C ATOM 1409 C THR A 93 -40.775 -1.926 -2.214 1.00 15.23 C ATOM 1410 O THR A 93 -40.148 -1.297 -3.066 1.00 31.43 O ATOM 1411 CB THR A 93 -42.931 -1.446 -3.374 1.00 51.14 C ATOM 1412 OG1 THR A 93 -42.817 -0.139 -2.801 1.00 20.55 O ATOM 1413 CG2 THR A 93 -44.399 -1.826 -3.492 1.00 32.22 C ATOM 0 H THR A 93 -43.286 -1.954 -0.816 1.00 3.24 H new ATOM 0 HA THR A 93 -42.082 -3.406 -3.062 1.00 15.11 H new ATOM 0 HB THR A 93 -42.490 -1.445 -4.371 1.00 51.14 H new ATOM 0 HG1 THR A 93 -42.891 -0.202 -1.826 1.00 20.55 H new ATOM 0 HG21 THR A 93 -44.917 -1.089 -4.106 1.00 32.22 H new ATOM 0 HG22 THR A 93 -44.484 -2.809 -3.955 1.00 32.22 H new ATOM 0 HG23 THR A 93 -44.849 -1.852 -2.500 1.00 32.22 H new ATOM 1421 N SER A 94 -40.296 -2.174 -0.998 1.00 41.23 N ATOM 1422 CA SER A 94 -38.977 -1.707 -0.587 1.00 71.52 C ATOM 1423 C SER A 94 -37.888 -2.316 -1.464 1.00 43.33 C ATOM 1424 O SER A 94 -38.142 -3.236 -2.243 1.00 3.02 O ATOM 1425 CB SER A 94 -38.723 -2.058 0.880 1.00 20.52 C ATOM 1426 OG SER A 94 -39.641 -3.037 1.337 1.00 2.23 O ATOM 0 H SER A 94 -40.801 -2.695 -0.281 1.00 41.23 H new ATOM 0 HA SER A 94 -38.949 -0.624 -0.704 1.00 71.52 H new ATOM 0 HB2 SER A 94 -37.704 -2.427 0.998 1.00 20.52 H new ATOM 0 HB3 SER A 94 -38.809 -1.160 1.492 1.00 20.52 H new ATOM 0 HG SER A 94 -39.442 -3.897 0.911 1.00 2.23 H new ATOM 1432 N LEU A 95 -36.672 -1.797 -1.332 1.00 11.13 N ATOM 1433 CA LEU A 95 -35.540 -2.289 -2.112 1.00 34.44 C ATOM 1434 C LEU A 95 -34.942 -3.538 -1.474 1.00 62.22 C ATOM 1435 O LEU A 95 -34.999 -3.713 -0.257 1.00 61.44 O ATOM 1436 CB LEU A 95 -34.471 -1.202 -2.236 1.00 53.31 C ATOM 1437 CG LEU A 95 -33.921 -0.650 -0.920 1.00 14.14 C ATOM 1438 CD1 LEU A 95 -32.743 -1.485 -0.441 1.00 71.33 C ATOM 1439 CD2 LEU A 95 -33.511 0.808 -1.084 1.00 61.44 C ATOM 0 H LEU A 95 -36.444 -1.036 -0.693 1.00 11.13 H new ATOM 0 HA LEU A 95 -35.901 -2.550 -3.107 1.00 34.44 H new ATOM 0 HB2 LEU A 95 -33.639 -1.603 -2.815 1.00 53.31 H new ATOM 0 HB3 LEU A 95 -34.888 -0.374 -2.809 1.00 53.31 H new ATOM 0 HG LEU A 95 -34.708 -0.704 -0.168 1.00 14.14 H new ATOM 0 HD11 LEU A 95 -32.365 -1.077 0.496 1.00 71.33 H new ATOM 0 HD12 LEU A 95 -33.066 -2.514 -0.285 1.00 71.33 H new ATOM 0 HD13 LEU A 95 -31.952 -1.463 -1.191 1.00 71.33 H new ATOM 0 HD21 LEU A 95 -33.122 1.185 -0.138 1.00 61.44 H new ATOM 0 HD22 LEU A 95 -32.740 0.885 -1.850 1.00 61.44 H new ATOM 0 HD23 LEU A 95 -34.378 1.398 -1.381 1.00 61.44 H new ATOM 1451 N ARG A 96 -34.367 -4.403 -2.304 1.00 22.20 N ATOM 1452 CA ARG A 96 -33.757 -5.635 -1.822 1.00 2.41 C ATOM 1453 C ARG A 96 -32.250 -5.466 -1.654 1.00 14.45 C ATOM 1454 O ARG A 96 -31.543 -5.135 -2.605 1.00 63.30 O ATOM 1455 CB ARG A 96 -34.048 -6.786 -2.787 1.00 44.25 C ATOM 1456 CG ARG A 96 -33.496 -6.561 -4.185 1.00 63.41 C ATOM 1457 CD ARG A 96 -32.197 -7.319 -4.400 1.00 52.41 C ATOM 1458 NE ARG A 96 -32.430 -8.694 -4.835 1.00 50.34 N ATOM 1459 CZ ARG A 96 -32.772 -9.023 -6.075 1.00 2.41 C ATOM 1460 NH1 ARG A 96 -32.920 -8.083 -6.999 1.00 13.23 N1+ ATOM 1461 NH2 ARG A 96 -32.966 -10.297 -6.395 1.00 2.33 N ATOM 0 H ARG A 96 -34.311 -4.272 -3.314 1.00 22.20 H new ATOM 0 HA ARG A 96 -34.190 -5.868 -0.849 1.00 2.41 H new ATOM 0 HB2 ARG A 96 -33.625 -7.705 -2.382 1.00 44.25 H new ATOM 0 HB3 ARG A 96 -35.126 -6.933 -2.850 1.00 44.25 H new ATOM 0 HG2 ARG A 96 -34.231 -6.881 -4.923 1.00 63.41 H new ATOM 0 HG3 ARG A 96 -33.327 -5.496 -4.344 1.00 63.41 H new ATOM 0 HD2 ARG A 96 -31.594 -6.800 -5.145 1.00 52.41 H new ATOM 0 HD3 ARG A 96 -31.623 -7.324 -3.473 1.00 52.41 H new ATOM 0 HE ARG A 96 -32.324 -9.442 -4.149 1.00 50.34 H new ATOM 0 HH11 ARG A 96 -32.771 -7.103 -6.758 1.00 13.23 H new ATOM 0 HH12 ARG A 96 -33.183 -8.340 -7.950 1.00 13.23 H new ATOM 0 HH21 ARG A 96 -32.852 -11.023 -5.688 1.00 2.33 H new ATOM 0 HH22 ARG A 96 -33.229 -10.549 -7.348 1.00 2.33 H new ATOM 1475 N VAL A 97 -31.765 -5.696 -0.438 1.00 32.32 N ATOM 1476 CA VAL A 97 -30.342 -5.570 -0.145 1.00 32.11 C ATOM 1477 C VAL A 97 -29.658 -6.932 -0.145 1.00 2.42 C ATOM 1478 O VAL A 97 -30.147 -7.899 0.440 1.00 4.01 O ATOM 1479 CB VAL A 97 -30.107 -4.890 1.217 1.00 24.41 C ATOM 1480 CG1 VAL A 97 -28.742 -5.264 1.772 1.00 40.42 C ATOM 1481 CG2 VAL A 97 -30.244 -3.380 1.088 1.00 52.15 C ATOM 0 H VAL A 97 -32.337 -5.971 0.361 1.00 32.32 H new ATOM 0 HA VAL A 97 -29.911 -4.950 -0.931 1.00 32.11 H new ATOM 0 HB VAL A 97 -30.865 -5.243 1.916 1.00 24.41 H new ATOM 0 HG11 VAL A 97 -28.594 -4.774 2.734 1.00 40.42 H new ATOM 0 HG12 VAL A 97 -28.686 -6.345 1.902 1.00 40.42 H new ATOM 0 HG13 VAL A 97 -27.966 -4.942 1.078 1.00 40.42 H new ATOM 0 HG21 VAL A 97 -30.075 -2.915 2.059 1.00 52.15 H new ATOM 0 HG22 VAL A 97 -29.509 -3.008 0.375 1.00 52.15 H new ATOM 0 HG23 VAL A 97 -31.246 -3.134 0.738 1.00 52.15 H new ATOM 1491 N PRO A 98 -28.500 -7.013 -0.816 1.00 12.13 N ATOM 1492 CA PRO A 98 -27.723 -8.253 -0.908 1.00 3.14 C ATOM 1493 C PRO A 98 -27.091 -8.641 0.424 1.00 31.21 C ATOM 1494 O PRO A 98 -26.912 -7.800 1.306 1.00 54.31 O ATOM 1495 CB PRO A 98 -26.640 -7.916 -1.937 1.00 5.32 C ATOM 1496 CG PRO A 98 -26.493 -6.436 -1.862 1.00 31.15 C ATOM 1497 CD PRO A 98 -27.859 -5.900 -1.537 1.00 23.22 C ATOM 0 HA PRO A 98 -28.344 -9.105 -1.186 1.00 3.14 H new ATOM 0 HB2 PRO A 98 -25.702 -8.419 -1.703 1.00 5.32 H new ATOM 0 HB3 PRO A 98 -26.932 -8.235 -2.938 1.00 5.32 H new ATOM 0 HG2 PRO A 98 -25.771 -6.154 -1.096 1.00 31.15 H new ATOM 0 HG3 PRO A 98 -26.130 -6.032 -2.807 1.00 31.15 H new ATOM 0 HD2 PRO A 98 -27.802 -5.002 -0.921 1.00 23.22 H new ATOM 0 HD3 PRO A 98 -28.411 -5.634 -2.438 1.00 23.22 H new ATOM 1505 N HIS A 99 -26.754 -9.918 0.564 1.00 2.03 N ATOM 1506 CA HIS A 99 -26.140 -10.418 1.790 1.00 40.20 C ATOM 1507 C HIS A 99 -24.804 -9.728 2.048 1.00 23.32 C ATOM 1508 O HIS A 99 -23.918 -9.729 1.193 1.00 3.54 O ATOM 1509 CB HIS A 99 -25.938 -11.931 1.704 1.00 10.22 C ATOM 1510 CG HIS A 99 -25.117 -12.361 0.528 1.00 63.35 C ATOM 1511 ND1 HIS A 99 -23.767 -12.630 0.611 1.00 22.30 N ATOM 1512 CD2 HIS A 99 -25.462 -12.567 -0.764 1.00 12.11 C ATOM 1513 CE1 HIS A 99 -23.317 -12.984 -0.579 1.00 51.45 C ATOM 1514 NE2 HIS A 99 -24.325 -12.954 -1.431 1.00 54.33 N ATOM 0 H HIS A 99 -26.895 -10.627 -0.156 1.00 2.03 H new ATOM 0 HA HIS A 99 -26.810 -10.196 2.620 1.00 40.20 H new ATOM 0 HB2 HIS A 99 -25.457 -12.277 2.619 1.00 10.22 H new ATOM 0 HB3 HIS A 99 -26.912 -12.417 1.653 1.00 10.22 H new ATOM 0 HD2 HIS A 99 -26.447 -12.449 -1.191 1.00 12.11 H new ATOM 0 HE1 HIS A 99 -22.298 -13.252 -0.815 1.00 51.45 H new ATOM 0 HE2 HIS A 99 -24.269 -13.181 -2.424 1.00 54.33 H new ATOM 1522 N GLY A 100 -24.666 -9.138 3.232 1.00 52.11 N ATOM 1523 CA GLY A 100 -23.436 -8.453 3.581 1.00 34.40 C ATOM 1524 C GLY A 100 -23.399 -7.028 3.064 1.00 32.53 C ATOM 1525 O GLY A 100 -23.123 -6.095 3.815 1.00 13.43 O ATOM 0 H GLY A 100 -25.385 -9.123 3.955 1.00 52.11 H new ATOM 0 HA2 GLY A 100 -23.323 -8.446 4.665 1.00 34.40 H new ATOM 0 HA3 GLY A 100 -22.588 -9.005 3.175 1.00 34.40 H new ATOM 1529 N GLY A 101 -23.679 -6.860 1.774 1.00 3.44 N ATOM 1530 CA GLY A 101 -23.671 -5.536 1.179 1.00 63.32 C ATOM 1531 C GLY A 101 -22.295 -5.131 0.690 1.00 13.11 C ATOM 1532 O GLY A 101 -22.166 -4.440 -0.321 1.00 41.12 O ATOM 0 H GLY A 101 -23.911 -7.617 1.131 1.00 3.44 H new ATOM 0 HA2 GLY A 101 -24.372 -5.511 0.345 1.00 63.32 H new ATOM 0 HA3 GLY A 101 -24.022 -4.809 1.912 1.00 63.32 H new ATOM 1536 N GLY A 102 -21.262 -5.559 1.409 1.00 35.30 N ATOM 1537 CA GLY A 102 -19.902 -5.223 1.027 1.00 42.33 C ATOM 1538 C GLY A 102 -19.320 -4.110 1.874 1.00 11.11 C ATOM 1539 O GLY A 102 -18.140 -4.139 2.225 1.00 65.03 O ATOM 0 H GLY A 102 -21.342 -6.132 2.249 1.00 35.30 H new ATOM 0 HA2 GLY A 102 -19.274 -6.109 1.116 1.00 42.33 H new ATOM 0 HA3 GLY A 102 -19.886 -4.924 -0.021 1.00 42.33 H new ATOM 1543 N GLY A 103 -20.148 -3.124 2.204 1.00 42.51 N ATOM 1544 CA GLY A 103 -19.689 -2.009 3.012 1.00 70.24 C ATOM 1545 C GLY A 103 -20.648 -1.674 4.137 1.00 14.31 C ATOM 1546 O GLY A 103 -21.464 -2.507 4.533 1.00 75.45 O ATOM 0 H GLY A 103 -21.128 -3.077 1.926 1.00 42.51 H new ATOM 0 HA2 GLY A 103 -18.711 -2.246 3.431 1.00 70.24 H new ATOM 0 HA3 GLY A 103 -19.559 -1.133 2.376 1.00 70.24 H new ATOM 1550 N ILE A 104 -20.550 -0.454 4.654 1.00 10.42 N ATOM 1551 CA ILE A 104 -21.415 -0.013 5.740 1.00 73.30 C ATOM 1552 C ILE A 104 -22.054 1.335 5.421 1.00 61.32 C ATOM 1553 O ILE A 104 -21.463 2.165 4.730 1.00 74.25 O ATOM 1554 CB ILE A 104 -20.640 0.100 7.066 1.00 31.42 C ATOM 1555 CG1 ILE A 104 -19.960 -1.230 7.399 1.00 73.31 C ATOM 1556 CG2 ILE A 104 -21.575 0.518 8.191 1.00 75.13 C ATOM 1557 CD1 ILE A 104 -19.012 -1.145 8.575 1.00 42.35 C ATOM 0 H ILE A 104 -19.880 0.247 4.338 1.00 10.42 H new ATOM 0 HA ILE A 104 -22.196 -0.766 5.848 1.00 73.30 H new ATOM 0 HB ILE A 104 -19.870 0.863 6.956 1.00 31.42 H new ATOM 0 HG12 ILE A 104 -20.725 -1.977 7.612 1.00 73.31 H new ATOM 0 HG13 ILE A 104 -19.411 -1.577 6.524 1.00 73.31 H new ATOM 0 HG21 ILE A 104 -21.013 0.594 9.122 1.00 75.13 H new ATOM 0 HG22 ILE A 104 -22.018 1.485 7.955 1.00 75.13 H new ATOM 0 HG23 ILE A 104 -22.364 -0.225 8.303 1.00 75.13 H new ATOM 0 HD11 ILE A 104 -18.566 -2.123 8.754 1.00 42.35 H new ATOM 0 HD12 ILE A 104 -18.226 -0.422 8.357 1.00 42.35 H new ATOM 0 HD13 ILE A 104 -19.560 -0.828 9.462 1.00 42.35 H new ATOM 1569 N ILE A 105 -23.262 1.546 5.932 1.00 72.41 N ATOM 1570 CA ILE A 105 -23.980 2.794 5.703 1.00 11.13 C ATOM 1571 C ILE A 105 -23.254 3.971 6.347 1.00 43.31 C ATOM 1572 O ILE A 105 -23.351 4.188 7.555 1.00 71.54 O ATOM 1573 CB ILE A 105 -25.416 2.727 6.255 1.00 21.24 C ATOM 1574 CG1 ILE A 105 -26.129 1.478 5.732 1.00 33.43 C ATOM 1575 CG2 ILE A 105 -26.188 3.981 5.876 1.00 13.51 C ATOM 1576 CD1 ILE A 105 -26.344 1.487 4.235 1.00 11.11 C ATOM 0 H ILE A 105 -23.764 0.869 6.507 1.00 72.41 H new ATOM 0 HA ILE A 105 -24.021 2.941 4.624 1.00 11.13 H new ATOM 0 HB ILE A 105 -25.369 2.667 7.342 1.00 21.24 H new ATOM 0 HG12 ILE A 105 -25.546 0.597 6.002 1.00 33.43 H new ATOM 0 HG13 ILE A 105 -27.095 1.386 6.229 1.00 33.43 H new ATOM 0 HG21 ILE A 105 -27.201 3.919 6.273 1.00 13.51 H new ATOM 0 HG22 ILE A 105 -25.688 4.856 6.292 1.00 13.51 H new ATOM 0 HG23 ILE A 105 -26.229 4.069 4.790 1.00 13.51 H new ATOM 0 HD11 ILE A 105 -26.854 0.572 3.935 1.00 11.11 H new ATOM 0 HD12 ILE A 105 -26.953 2.348 3.960 1.00 11.11 H new ATOM 0 HD13 ILE A 105 -25.380 1.547 3.729 1.00 11.11 H new ATOM 1588 N HIS A 106 -22.529 4.728 5.532 1.00 44.11 N ATOM 1589 CA HIS A 106 -21.788 5.886 6.021 1.00 34.34 C ATOM 1590 C HIS A 106 -22.487 7.184 5.630 1.00 52.02 C ATOM 1591 O HIS A 106 -22.299 8.219 6.269 1.00 2.51 O ATOM 1592 CB HIS A 106 -20.361 5.876 5.471 1.00 22.33 C ATOM 1593 CG HIS A 106 -19.470 6.901 6.099 1.00 1.11 C ATOM 1594 ND1 HIS A 106 -18.288 7.325 5.526 1.00 2.12 N ATOM 1595 CD2 HIS A 106 -19.592 7.592 7.257 1.00 44.21 C ATOM 1596 CE1 HIS A 106 -17.722 8.229 6.305 1.00 70.15 C ATOM 1597 NE2 HIS A 106 -18.494 8.410 7.363 1.00 4.01 N ATOM 0 H HIS A 106 -22.438 4.561 4.530 1.00 44.11 H new ATOM 0 HA HIS A 106 -21.750 5.828 7.109 1.00 34.34 H new ATOM 0 HB2 HIS A 106 -19.928 4.887 5.625 1.00 22.33 H new ATOM 0 HB3 HIS A 106 -20.394 6.046 4.395 1.00 22.33 H new ATOM 0 HD2 HIS A 106 -20.403 7.514 7.966 1.00 44.21 H new ATOM 0 HE1 HIS A 106 -16.788 8.734 6.111 1.00 70.15 H new ATOM 0 HE2 HIS A 106 -18.305 9.052 8.132 1.00 4.01 H new ATOM 1605 N ASP A 107 -23.293 7.122 4.576 1.00 2.53 N ATOM 1606 CA ASP A 107 -24.022 8.292 4.100 1.00 2.33 C ATOM 1607 C ASP A 107 -25.403 7.900 3.584 1.00 53.53 C ATOM 1608 O ASP A 107 -25.589 6.809 3.047 1.00 42.21 O ATOM 1609 CB ASP A 107 -23.232 8.995 2.994 1.00 13.01 C ATOM 1610 CG ASP A 107 -22.279 10.039 3.539 1.00 51.05 C ATOM 1611 OD1 ASP A 107 -22.719 10.881 4.351 1.00 40.31 O ATOM 1612 OD2 ASP A 107 -21.090 10.017 3.155 1.00 71.12 O1- ATOM 0 H ASP A 107 -23.458 6.274 4.035 1.00 2.53 H new ATOM 0 HA ASP A 107 -24.149 8.977 4.939 1.00 2.33 H new ATOM 0 HB2 ASP A 107 -22.669 8.254 2.426 1.00 13.01 H new ATOM 0 HB3 ASP A 107 -23.926 9.468 2.300 1.00 13.01 H new ATOM 1617 N VAL A 108 -26.368 8.797 3.755 1.00 40.23 N ATOM 1618 CA VAL A 108 -27.733 8.546 3.308 1.00 11.03 C ATOM 1619 C VAL A 108 -28.437 9.845 2.932 1.00 62.13 C ATOM 1620 O VAL A 108 -28.629 10.725 3.773 1.00 23.34 O ATOM 1621 CB VAL A 108 -28.556 7.824 4.392 1.00 20.20 C ATOM 1622 CG1 VAL A 108 -29.992 7.631 3.932 1.00 12.41 C ATOM 1623 CG2 VAL A 108 -27.916 6.489 4.743 1.00 33.40 C ATOM 0 H VAL A 108 -26.230 9.704 4.200 1.00 40.23 H new ATOM 0 HA VAL A 108 -27.664 7.906 2.428 1.00 11.03 H new ATOM 0 HB VAL A 108 -28.568 8.444 5.289 1.00 20.20 H new ATOM 0 HG11 VAL A 108 -30.558 7.119 4.711 1.00 12.41 H new ATOM 0 HG12 VAL A 108 -30.444 8.603 3.734 1.00 12.41 H new ATOM 0 HG13 VAL A 108 -30.005 7.032 3.021 1.00 12.41 H new ATOM 0 HG21 VAL A 108 -28.509 5.992 5.510 1.00 33.40 H new ATOM 0 HG22 VAL A 108 -27.873 5.861 3.853 1.00 33.40 H new ATOM 0 HG23 VAL A 108 -26.906 6.657 5.118 1.00 33.40 H new ATOM 1633 N LYS A 109 -28.822 9.960 1.666 1.00 73.05 N ATOM 1634 CA LYS A 109 -29.506 11.151 1.178 1.00 64.22 C ATOM 1635 C LYS A 109 -31.009 10.910 1.075 1.00 55.52 C ATOM 1636 O LYS A 109 -31.450 9.899 0.526 1.00 53.24 O ATOM 1637 CB LYS A 109 -28.950 11.561 -0.187 1.00 5.12 C ATOM 1638 CG LYS A 109 -27.821 12.575 -0.104 1.00 4.01 C ATOM 1639 CD LYS A 109 -28.353 13.998 -0.052 1.00 43.23 C ATOM 1640 CE LYS A 109 -27.268 14.983 0.354 1.00 25.43 C ATOM 1641 NZ LYS A 109 -26.332 15.272 -0.768 1.00 11.23 N1+ ATOM 0 H LYS A 109 -28.672 9.241 0.958 1.00 73.05 H new ATOM 0 HA LYS A 109 -29.332 11.957 1.891 1.00 64.22 H new ATOM 0 HB2 LYS A 109 -28.591 10.672 -0.706 1.00 5.12 H new ATOM 0 HB3 LYS A 109 -29.758 11.977 -0.789 1.00 5.12 H new ATOM 0 HG2 LYS A 109 -27.218 12.378 0.783 1.00 4.01 H new ATOM 0 HG3 LYS A 109 -27.165 12.462 -0.967 1.00 4.01 H new ATOM 0 HD2 LYS A 109 -28.751 14.275 -1.028 1.00 43.23 H new ATOM 0 HD3 LYS A 109 -29.180 14.053 0.656 1.00 43.23 H new ATOM 0 HE2 LYS A 109 -27.728 15.912 0.691 1.00 25.43 H new ATOM 0 HE3 LYS A 109 -26.709 14.580 1.198 1.00 25.43 H new ATOM 0 HZ1 LYS A 109 -25.608 15.947 -0.451 1.00 11.23 H new ATOM 0 HZ2 LYS A 109 -25.873 14.390 -1.073 1.00 11.23 H new ATOM 0 HZ3 LYS A 109 -26.861 15.681 -1.565 1.00 11.23 H new ATOM 1655 N VAL A 110 -31.792 11.845 1.604 1.00 33.40 N ATOM 1656 CA VAL A 110 -33.245 11.736 1.569 1.00 62.24 C ATOM 1657 C VAL A 110 -33.889 13.081 1.255 1.00 62.33 C ATOM 1658 O VAL A 110 -33.631 14.078 1.927 1.00 72.31 O ATOM 1659 CB VAL A 110 -33.801 11.212 2.906 1.00 4.52 C ATOM 1660 CG1 VAL A 110 -33.386 12.125 4.051 1.00 44.34 C ATOM 1661 CG2 VAL A 110 -35.315 11.082 2.840 1.00 54.34 C ATOM 0 H VAL A 110 -31.444 12.687 2.062 1.00 33.40 H new ATOM 0 HA VAL A 110 -33.490 11.026 0.779 1.00 62.24 H new ATOM 0 HB VAL A 110 -33.382 10.223 3.091 1.00 4.52 H new ATOM 0 HG11 VAL A 110 -33.788 11.739 4.988 1.00 44.34 H new ATOM 0 HG12 VAL A 110 -32.298 12.162 4.111 1.00 44.34 H new ATOM 0 HG13 VAL A 110 -33.774 13.128 3.875 1.00 44.34 H new ATOM 0 HG21 VAL A 110 -35.690 10.710 3.794 1.00 54.34 H new ATOM 0 HG22 VAL A 110 -35.755 12.057 2.632 1.00 54.34 H new ATOM 0 HG23 VAL A 110 -35.586 10.385 2.047 1.00 54.34 H new ATOM 1671 N PHE A 111 -34.733 13.101 0.227 1.00 31.14 N ATOM 1672 CA PHE A 111 -35.415 14.324 -0.178 1.00 61.30 C ATOM 1673 C PHE A 111 -36.923 14.197 0.022 1.00 14.04 C ATOM 1674 O PHE A 111 -37.516 13.164 -0.284 1.00 54.20 O ATOM 1675 CB PHE A 111 -35.108 14.643 -1.642 1.00 25.34 C ATOM 1676 CG PHE A 111 -33.660 14.478 -2.001 1.00 21.54 C ATOM 1677 CD1 PHE A 111 -32.685 15.231 -1.367 1.00 61.01 C ATOM 1678 CD2 PHE A 111 -33.273 13.569 -2.973 1.00 34.24 C ATOM 1679 CE1 PHE A 111 -31.351 15.081 -1.696 1.00 62.23 C ATOM 1680 CE2 PHE A 111 -31.940 13.415 -3.306 1.00 44.30 C ATOM 1681 CZ PHE A 111 -30.978 14.171 -2.666 1.00 45.00 C ATOM 0 H PHE A 111 -34.960 12.284 -0.340 1.00 31.14 H new ATOM 0 HA PHE A 111 -35.051 15.139 0.448 1.00 61.30 H new ATOM 0 HB2 PHE A 111 -35.708 13.995 -2.280 1.00 25.34 H new ATOM 0 HB3 PHE A 111 -35.412 15.668 -1.853 1.00 25.34 H new ATOM 0 HD1 PHE A 111 -32.971 15.943 -0.607 1.00 61.01 H new ATOM 0 HD2 PHE A 111 -34.021 12.974 -3.476 1.00 34.24 H new ATOM 0 HE1 PHE A 111 -30.601 15.675 -1.195 1.00 62.23 H new ATOM 0 HE2 PHE A 111 -31.651 12.704 -4.066 1.00 44.30 H new ATOM 0 HZ PHE A 111 -29.936 14.051 -2.923 1.00 45.00 H new ATOM 1691 N ASN A 112 -37.536 15.257 0.538 1.00 50.25 N ATOM 1692 CA ASN A 112 -38.975 15.265 0.781 1.00 72.43 C ATOM 1693 C ASN A 112 -39.637 16.450 0.086 1.00 13.34 C ATOM 1694 O ASN A 112 -39.072 17.543 0.026 1.00 60.11 O ATOM 1695 CB ASN A 112 -39.260 15.316 2.284 1.00 64.11 C ATOM 1696 CG ASN A 112 -39.323 13.936 2.908 1.00 42.02 C ATOM 1697 OD1 ASN A 112 -38.329 13.209 2.937 1.00 74.51 O ATOM 1698 ND2 ASN A 112 -40.496 13.566 3.409 1.00 45.40 N ATOM 0 H ASN A 112 -37.060 16.121 0.796 1.00 50.25 H new ATOM 0 HA ASN A 112 -39.393 14.346 0.370 1.00 72.43 H new ATOM 0 HB2 ASN A 112 -38.484 15.900 2.778 1.00 64.11 H new ATOM 0 HB3 ASN A 112 -40.205 15.832 2.454 1.00 64.11 H new ATOM 0 HD21 ASN A 112 -40.600 12.647 3.840 1.00 45.40 H new ATOM 0 HD22 ASN A 112 -41.293 14.201 3.363 1.00 45.40 H new ATOM 1705 N ARG A 113 -40.838 16.227 -0.437 1.00 20.34 N ATOM 1706 CA ARG A 113 -41.578 17.277 -1.129 1.00 53.42 C ATOM 1707 C ARG A 113 -41.980 18.386 -0.161 1.00 54.43 C ATOM 1708 O ARG A 113 -42.107 19.545 -0.551 1.00 33.44 O ATOM 1709 CB ARG A 113 -42.822 16.695 -1.800 1.00 52.52 C ATOM 1710 CG ARG A 113 -43.759 17.749 -2.367 1.00 1.01 C ATOM 1711 CD ARG A 113 -44.719 17.154 -3.384 1.00 10.22 C ATOM 1712 NE ARG A 113 -45.475 18.184 -4.092 1.00 43.12 N ATOM 1713 CZ ARG A 113 -46.228 17.941 -5.159 1.00 21.52 C ATOM 1714 NH1 ARG A 113 -46.326 16.708 -5.637 1.00 31.21 N1+ ATOM 1715 NH2 ARG A 113 -46.885 18.931 -5.748 1.00 54.41 N ATOM 0 H ARG A 113 -41.320 15.329 -0.395 1.00 20.34 H new ATOM 0 HA ARG A 113 -40.928 17.703 -1.893 1.00 53.42 H new ATOM 0 HB2 ARG A 113 -42.512 16.027 -2.604 1.00 52.52 H new ATOM 0 HB3 ARG A 113 -43.366 16.090 -1.075 1.00 52.52 H new ATOM 0 HG2 ARG A 113 -44.325 18.208 -1.556 1.00 1.01 H new ATOM 0 HG3 ARG A 113 -43.175 18.541 -2.836 1.00 1.01 H new ATOM 0 HD2 ARG A 113 -44.160 16.556 -4.104 1.00 10.22 H new ATOM 0 HD3 ARG A 113 -45.411 16.480 -2.878 1.00 10.22 H new ATOM 0 HE ARG A 113 -45.422 19.143 -3.748 1.00 43.12 H new ATOM 0 HH11 ARG A 113 -45.823 15.944 -5.185 1.00 31.21 H new ATOM 0 HH12 ARG A 113 -46.905 16.523 -6.456 1.00 31.21 H new ATOM 0 HH21 ARG A 113 -46.812 19.880 -5.382 1.00 54.41 H new ATOM 0 HH22 ARG A 113 -47.463 18.743 -6.567 1.00 54.41 H new ATOM 1729 N GLU A 114 -42.179 18.019 1.101 1.00 1.14 N ATOM 1730 CA GLU A 114 -42.569 18.984 2.123 1.00 4.11 C ATOM 1731 C GLU A 114 -41.529 20.093 2.250 1.00 41.23 C ATOM 1732 O GLU A 114 -41.861 21.239 2.552 1.00 33.03 O ATOM 1733 CB GLU A 114 -42.752 18.285 3.472 1.00 54.33 C ATOM 1734 CG GLU A 114 -41.450 17.811 4.094 1.00 44.41 C ATOM 1735 CD GLU A 114 -41.631 16.583 4.964 1.00 52.21 C ATOM 1736 OE1 GLU A 114 -42.372 15.666 4.550 1.00 71.42 O ATOM 1737 OE2 GLU A 114 -41.034 16.538 6.059 1.00 73.01 O1- ATOM 0 H GLU A 114 -42.077 17.062 1.440 1.00 1.14 H new ATOM 0 HA GLU A 114 -43.516 19.431 1.821 1.00 4.11 H new ATOM 0 HB2 GLU A 114 -43.246 18.969 4.162 1.00 54.33 H new ATOM 0 HB3 GLU A 114 -43.415 17.430 3.341 1.00 54.33 H new ATOM 0 HG2 GLU A 114 -40.734 17.589 3.303 1.00 44.41 H new ATOM 0 HG3 GLU A 114 -41.024 18.616 4.693 1.00 44.41 H new ATOM 1744 N ASP A 115 -40.269 19.743 2.016 1.00 61.31 N ATOM 1745 CA ASP A 115 -39.178 20.707 2.104 1.00 32.24 C ATOM 1746 C ASP A 115 -39.191 21.651 0.906 1.00 43.43 C ATOM 1747 O ASP A 115 -38.597 22.727 0.945 1.00 43.12 O ATOM 1748 CB ASP A 115 -37.833 19.983 2.184 1.00 53.53 C ATOM 1749 CG ASP A 115 -36.734 20.863 2.746 1.00 13.43 C ATOM 1750 OD1 ASP A 115 -37.033 22.015 3.127 1.00 74.43 O ATOM 1751 OD2 ASP A 115 -35.576 20.400 2.806 1.00 32.32 O1- ATOM 0 H ASP A 115 -39.978 18.799 1.764 1.00 61.31 H new ATOM 0 HA ASP A 115 -39.318 21.296 3.010 1.00 32.24 H new ATOM 0 HB2 ASP A 115 -37.938 19.095 2.808 1.00 53.53 H new ATOM 0 HB3 ASP A 115 -37.548 19.642 1.189 1.00 53.53 H new ATOM 1756 N GLY A 116 -39.871 21.238 -0.159 1.00 54.51 N ATOM 1757 CA GLY A 116 -39.948 22.058 -1.355 1.00 23.20 C ATOM 1758 C GLY A 116 -39.127 21.494 -2.498 1.00 2.22 C ATOM 1759 O GLY A 116 -38.769 22.216 -3.429 1.00 55.14 O ATOM 0 H GLY A 116 -40.370 20.350 -0.215 1.00 54.51 H new ATOM 0 HA2 GLY A 116 -40.989 22.143 -1.667 1.00 23.20 H new ATOM 0 HA3 GLY A 116 -39.601 23.065 -1.124 1.00 23.20 H new ATOM 1763 N ASP A 117 -38.827 20.203 -2.428 1.00 71.14 N ATOM 1764 CA ASP A 117 -38.042 19.542 -3.464 1.00 22.33 C ATOM 1765 C ASP A 117 -38.947 19.001 -4.567 1.00 23.13 C ATOM 1766 O ASP A 117 -39.663 18.020 -4.370 1.00 55.15 O ATOM 1767 CB ASP A 117 -37.216 18.405 -2.862 1.00 15.40 C ATOM 1768 CG ASP A 117 -36.116 18.910 -1.949 1.00 11.35 C ATOM 1769 OD1 ASP A 117 -36.442 19.479 -0.886 1.00 73.13 O ATOM 1770 OD2 ASP A 117 -34.929 18.736 -2.295 1.00 42.23 O1- ATOM 0 H ASP A 117 -39.116 19.592 -1.664 1.00 71.14 H new ATOM 0 HA ASP A 117 -37.367 20.279 -3.900 1.00 22.33 H new ATOM 0 HB2 ASP A 117 -37.873 17.740 -2.301 1.00 15.40 H new ATOM 0 HB3 ASP A 117 -36.775 17.815 -3.666 1.00 15.40 H new ATOM 1775 N GLU A 118 -38.908 19.648 -5.728 1.00 12.24 N ATOM 1776 CA GLU A 118 -39.725 19.232 -6.861 1.00 23.12 C ATOM 1777 C GLU A 118 -39.397 17.800 -7.273 1.00 62.43 C ATOM 1778 O GLU A 118 -38.248 17.362 -7.181 1.00 43.24 O ATOM 1779 CB GLU A 118 -39.511 20.176 -8.047 1.00 34.24 C ATOM 1780 CG GLU A 118 -40.565 20.036 -9.133 1.00 62.21 C ATOM 1781 CD GLU A 118 -41.929 20.524 -8.690 1.00 42.54 C ATOM 1782 OE1 GLU A 118 -41.985 21.475 -7.882 1.00 52.30 O ATOM 1783 OE2 GLU A 118 -42.942 19.957 -9.151 1.00 0.43 O1- ATOM 0 H GLU A 118 -38.320 20.462 -5.908 1.00 12.24 H new ATOM 0 HA GLU A 118 -40.771 19.274 -6.556 1.00 23.12 H new ATOM 0 HB2 GLU A 118 -39.507 21.205 -7.686 1.00 34.24 H new ATOM 0 HB3 GLU A 118 -38.528 19.986 -8.479 1.00 34.24 H new ATOM 0 HG2 GLU A 118 -40.251 20.597 -10.013 1.00 62.21 H new ATOM 0 HG3 GLU A 118 -40.637 18.990 -9.431 1.00 62.21 H new ATOM 1790 N LEU A 119 -40.413 17.073 -7.725 1.00 53.45 N ATOM 1791 CA LEU A 119 -40.234 15.688 -8.150 1.00 44.14 C ATOM 1792 C LEU A 119 -41.020 15.404 -9.426 1.00 13.41 C ATOM 1793 O LEU A 119 -41.973 16.106 -9.766 1.00 3.34 O ATOM 1794 CB LEU A 119 -40.676 14.732 -7.041 1.00 54.15 C ATOM 1795 CG LEU A 119 -39.651 14.463 -5.939 1.00 4.14 C ATOM 1796 CD1 LEU A 119 -40.350 14.174 -4.619 1.00 75.22 C ATOM 1797 CD2 LEU A 119 -38.742 13.306 -6.328 1.00 64.10 C ATOM 0 H LEU A 119 -41.369 17.419 -7.807 1.00 53.45 H new ATOM 0 HA LEU A 119 -39.175 15.531 -8.355 1.00 44.14 H new ATOM 0 HB2 LEU A 119 -41.578 15.134 -6.580 1.00 54.15 H new ATOM 0 HB3 LEU A 119 -40.948 13.780 -7.497 1.00 54.15 H new ATOM 0 HG LEU A 119 -39.037 15.355 -5.814 1.00 4.14 H new ATOM 0 HD11 LEU A 119 -39.605 13.985 -3.846 1.00 75.22 H new ATOM 0 HD12 LEU A 119 -40.958 15.032 -4.334 1.00 75.22 H new ATOM 0 HD13 LEU A 119 -40.988 13.297 -4.730 1.00 75.22 H new ATOM 0 HD21 LEU A 119 -38.019 13.128 -5.532 1.00 64.10 H new ATOM 0 HD22 LEU A 119 -39.341 12.408 -6.481 1.00 64.10 H new ATOM 0 HD23 LEU A 119 -38.215 13.552 -7.250 1.00 64.10 H new ATOM 1809 N PRO A 120 -40.615 14.349 -10.149 1.00 20.10 N ATOM 1810 CA PRO A 120 -41.271 13.947 -11.396 1.00 0.40 C ATOM 1811 C PRO A 120 -42.664 13.375 -11.162 1.00 11.03 C ATOM 1812 O PRO A 120 -43.055 13.072 -10.033 1.00 42.43 O ATOM 1813 CB PRO A 120 -40.337 12.869 -11.955 1.00 45.01 C ATOM 1814 CG PRO A 120 -39.636 12.320 -10.761 1.00 75.10 C ATOM 1815 CD PRO A 120 -39.487 13.469 -9.803 1.00 64.30 C ATOM 0 HA PRO A 120 -41.421 14.792 -12.068 1.00 0.40 H new ATOM 0 HB2 PRO A 120 -40.896 12.093 -12.478 1.00 45.01 H new ATOM 0 HB3 PRO A 120 -39.630 13.289 -12.671 1.00 45.01 H new ATOM 0 HG2 PRO A 120 -40.208 11.509 -10.311 1.00 75.10 H new ATOM 0 HG3 PRO A 120 -38.663 11.911 -11.034 1.00 75.10 H new ATOM 0 HD2 PRO A 120 -39.539 13.137 -8.766 1.00 64.30 H new ATOM 0 HD3 PRO A 120 -38.530 13.975 -9.928 1.00 64.30 H new ATOM 1823 N PRO A 121 -43.433 13.221 -12.250 1.00 13.45 N ATOM 1824 CA PRO A 121 -44.795 12.683 -12.187 1.00 63.41 C ATOM 1825 C PRO A 121 -44.816 11.198 -11.841 1.00 74.12 C ATOM 1826 O PRO A 121 -44.266 10.374 -12.570 1.00 70.11 O ATOM 1827 CB PRO A 121 -45.332 12.911 -13.602 1.00 51.31 C ATOM 1828 CG PRO A 121 -44.120 12.950 -14.465 1.00 10.41 C ATOM 1829 CD PRO A 121 -43.032 13.560 -13.625 1.00 53.13 C ATOM 0 HA PRO A 121 -45.388 13.164 -11.409 1.00 63.41 H new ATOM 0 HB2 PRO A 121 -46.007 12.110 -13.903 1.00 51.31 H new ATOM 0 HB3 PRO A 121 -45.894 13.843 -13.667 1.00 51.31 H new ATOM 0 HG2 PRO A 121 -43.843 11.948 -14.794 1.00 10.41 H new ATOM 0 HG3 PRO A 121 -44.299 13.543 -15.362 1.00 10.41 H new ATOM 0 HD2 PRO A 121 -42.054 13.147 -13.872 1.00 53.13 H new ATOM 0 HD3 PRO A 121 -42.968 14.638 -13.771 1.00 53.13 H new ATOM 1837 N GLY A 122 -45.456 10.863 -10.725 1.00 43.21 N ATOM 1838 CA GLY A 122 -45.537 9.477 -10.304 1.00 45.50 C ATOM 1839 C GLY A 122 -44.752 9.209 -9.035 1.00 61.31 C ATOM 1840 O GLY A 122 -44.995 8.221 -8.342 1.00 64.21 O ATOM 0 H GLY A 122 -45.920 11.527 -10.105 1.00 43.21 H new ATOM 0 HA2 GLY A 122 -46.582 9.210 -10.145 1.00 45.50 H new ATOM 0 HA3 GLY A 122 -45.162 8.836 -11.102 1.00 45.50 H new ATOM 1844 N VAL A 123 -43.805 10.092 -8.730 1.00 20.12 N ATOM 1845 CA VAL A 123 -42.981 9.946 -7.537 1.00 30.11 C ATOM 1846 C VAL A 123 -43.439 10.892 -6.433 1.00 42.43 C ATOM 1847 O VAL A 123 -43.875 12.010 -6.701 1.00 35.02 O ATOM 1848 CB VAL A 123 -41.495 10.215 -7.844 1.00 72.33 C ATOM 1849 CG1 VAL A 123 -40.655 10.077 -6.584 1.00 14.23 C ATOM 1850 CG2 VAL A 123 -40.998 9.275 -8.932 1.00 34.10 C ATOM 0 H VAL A 123 -43.590 10.915 -9.293 1.00 20.12 H new ATOM 0 HA VAL A 123 -43.094 8.916 -7.199 1.00 30.11 H new ATOM 0 HB VAL A 123 -41.396 11.238 -8.206 1.00 72.33 H new ATOM 0 HG11 VAL A 123 -39.609 10.271 -6.821 1.00 14.23 H new ATOM 0 HG12 VAL A 123 -40.997 10.795 -5.838 1.00 14.23 H new ATOM 0 HG13 VAL A 123 -40.756 9.067 -6.188 1.00 14.23 H new ATOM 0 HG21 VAL A 123 -39.947 9.479 -9.136 1.00 34.10 H new ATOM 0 HG22 VAL A 123 -41.110 8.243 -8.600 1.00 34.10 H new ATOM 0 HG23 VAL A 123 -41.581 9.429 -9.840 1.00 34.10 H new ATOM 1860 N ASN A 124 -43.339 10.434 -5.189 1.00 33.12 N ATOM 1861 CA ASN A 124 -43.743 11.240 -4.043 1.00 53.53 C ATOM 1862 C ASN A 124 -42.545 11.571 -3.160 1.00 53.12 C ATOM 1863 O ASN A 124 -42.541 12.579 -2.454 1.00 73.13 O ATOM 1864 CB ASN A 124 -44.806 10.504 -3.225 1.00 43.21 C ATOM 1865 CG ASN A 124 -46.003 10.097 -4.064 1.00 42.43 C ATOM 1866 OD1 ASN A 124 -46.258 10.673 -5.122 1.00 73.31 O ATOM 1867 ND2 ASN A 124 -46.744 9.101 -3.594 1.00 3.04 N ATOM 0 H ASN A 124 -42.982 9.509 -4.949 1.00 33.12 H new ATOM 0 HA ASN A 124 -44.164 12.173 -4.418 1.00 53.53 H new ATOM 0 HB2 ASN A 124 -44.363 9.616 -2.774 1.00 43.21 H new ATOM 0 HB3 ASN A 124 -45.139 11.144 -2.408 1.00 43.21 H new ATOM 0 HD21 ASN A 124 -47.562 8.784 -4.114 1.00 3.04 H new ATOM 0 HD22 ASN A 124 -46.495 8.652 -2.712 1.00 3.04 H new ATOM 1874 N GLN A 125 -41.529 10.714 -3.205 1.00 42.31 N ATOM 1875 CA GLN A 125 -40.324 10.915 -2.408 1.00 61.22 C ATOM 1876 C GLN A 125 -39.107 10.310 -3.100 1.00 32.52 C ATOM 1877 O GLN A 125 -39.239 9.461 -3.982 1.00 3.53 O ATOM 1878 CB GLN A 125 -40.496 10.298 -1.020 1.00 74.32 C ATOM 1879 CG GLN A 125 -41.490 11.041 -0.142 1.00 12.52 C ATOM 1880 CD GLN A 125 -42.916 10.564 -0.340 1.00 12.21 C ATOM 1881 OE1 GLN A 125 -43.825 11.364 -0.561 1.00 35.21 O ATOM 1882 NE2 GLN A 125 -43.117 9.253 -0.263 1.00 13.11 N ATOM 0 H GLN A 125 -41.516 9.875 -3.784 1.00 42.31 H new ATOM 0 HA GLN A 125 -40.163 11.988 -2.303 1.00 61.22 H new ATOM 0 HB2 GLN A 125 -40.823 9.264 -1.129 1.00 74.32 H new ATOM 0 HB3 GLN A 125 -39.528 10.275 -0.519 1.00 74.32 H new ATOM 0 HG2 GLN A 125 -41.211 10.914 0.904 1.00 12.52 H new ATOM 0 HG3 GLN A 125 -41.434 12.108 -0.360 1.00 12.52 H new ATOM 0 HE21 GLN A 125 -42.333 8.627 -0.078 1.00 13.11 H new ATOM 0 HE22 GLN A 125 -44.055 8.873 -0.389 1.00 13.11 H new ATOM 1891 N LEU A 126 -37.922 10.753 -2.694 1.00 13.13 N ATOM 1892 CA LEU A 126 -36.679 10.256 -3.275 1.00 42.24 C ATOM 1893 C LEU A 126 -35.606 10.091 -2.206 1.00 22.01 C ATOM 1894 O LEU A 126 -35.262 11.043 -1.504 1.00 4.43 O ATOM 1895 CB LEU A 126 -36.187 11.207 -4.368 1.00 14.10 C ATOM 1896 CG LEU A 126 -35.146 10.640 -5.332 1.00 62.41 C ATOM 1897 CD1 LEU A 126 -33.807 10.468 -4.631 1.00 34.22 C ATOM 1898 CD2 LEU A 126 -35.620 9.315 -5.910 1.00 54.24 C ATOM 0 H LEU A 126 -37.795 11.455 -1.965 1.00 13.13 H new ATOM 0 HA LEU A 126 -36.878 9.279 -3.716 1.00 42.24 H new ATOM 0 HB2 LEU A 126 -37.048 11.538 -4.948 1.00 14.10 H new ATOM 0 HB3 LEU A 126 -35.766 12.091 -3.890 1.00 14.10 H new ATOM 0 HG LEU A 126 -35.016 11.346 -6.152 1.00 62.41 H new ATOM 0 HD11 LEU A 126 -33.078 10.063 -5.333 1.00 34.22 H new ATOM 0 HD12 LEU A 126 -33.461 11.435 -4.266 1.00 34.22 H new ATOM 0 HD13 LEU A 126 -33.921 9.783 -3.791 1.00 34.22 H new ATOM 0 HD21 LEU A 126 -34.866 8.926 -6.594 1.00 54.24 H new ATOM 0 HD22 LEU A 126 -35.779 8.601 -5.102 1.00 54.24 H new ATOM 0 HD23 LEU A 126 -36.555 9.467 -6.449 1.00 54.24 H new ATOM 1910 N VAL A 127 -35.076 8.878 -2.086 1.00 20.53 N ATOM 1911 CA VAL A 127 -34.038 8.590 -1.104 1.00 45.13 C ATOM 1912 C VAL A 127 -33.019 7.599 -1.656 1.00 1.10 C ATOM 1913 O VAL A 127 -33.377 6.646 -2.348 1.00 14.25 O ATOM 1914 CB VAL A 127 -34.638 8.021 0.196 1.00 20.41 C ATOM 1915 CG1 VAL A 127 -35.407 6.739 -0.086 1.00 10.03 C ATOM 1916 CG2 VAL A 127 -33.544 7.781 1.226 1.00 54.52 C ATOM 0 H VAL A 127 -35.349 8.078 -2.657 1.00 20.53 H new ATOM 0 HA VAL A 127 -33.540 9.534 -0.883 1.00 45.13 H new ATOM 0 HB VAL A 127 -35.336 8.752 0.604 1.00 20.41 H new ATOM 0 HG11 VAL A 127 -35.823 6.352 0.844 1.00 10.03 H new ATOM 0 HG12 VAL A 127 -36.216 6.946 -0.787 1.00 10.03 H new ATOM 0 HG13 VAL A 127 -34.734 5.998 -0.518 1.00 10.03 H new ATOM 0 HG21 VAL A 127 -33.985 7.379 2.138 1.00 54.52 H new ATOM 0 HG22 VAL A 127 -32.820 7.069 0.829 1.00 54.52 H new ATOM 0 HG23 VAL A 127 -33.042 8.722 1.450 1.00 54.52 H new ATOM 1926 N ARG A 128 -31.748 7.833 -1.346 1.00 4.20 N ATOM 1927 CA ARG A 128 -30.675 6.962 -1.812 1.00 61.44 C ATOM 1928 C ARG A 128 -29.740 6.591 -0.665 1.00 20.05 C ATOM 1929 O ARG A 128 -29.678 7.285 0.349 1.00 44.24 O ATOM 1930 CB ARG A 128 -29.884 7.645 -2.930 1.00 53.24 C ATOM 1931 CG ARG A 128 -30.750 8.129 -4.080 1.00 2.30 C ATOM 1932 CD ARG A 128 -30.021 9.156 -4.932 1.00 44.25 C ATOM 1933 NE ARG A 128 -29.061 8.531 -5.839 1.00 42.20 N ATOM 1934 CZ ARG A 128 -28.568 9.133 -6.915 1.00 12.20 C ATOM 1935 NH1 ARG A 128 -28.942 10.369 -7.218 1.00 23.30 N1+ ATOM 1936 NH2 ARG A 128 -27.698 8.499 -7.692 1.00 64.11 N ATOM 0 H ARG A 128 -31.436 8.618 -0.774 1.00 4.20 H new ATOM 0 HA ARG A 128 -31.125 6.048 -2.201 1.00 61.44 H new ATOM 0 HB2 ARG A 128 -29.341 8.493 -2.513 1.00 53.24 H new ATOM 0 HB3 ARG A 128 -29.140 6.948 -3.315 1.00 53.24 H new ATOM 0 HG2 ARG A 128 -31.041 7.281 -4.700 1.00 2.30 H new ATOM 0 HG3 ARG A 128 -31.668 8.566 -3.687 1.00 2.30 H new ATOM 0 HD2 ARG A 128 -30.746 9.728 -5.510 1.00 44.25 H new ATOM 0 HD3 ARG A 128 -29.501 9.862 -4.284 1.00 44.25 H new ATOM 0 HE ARG A 128 -28.753 7.580 -5.634 1.00 42.20 H new ATOM 0 HH11 ARG A 128 -29.610 10.860 -6.624 1.00 23.30 H new ATOM 0 HH12 ARG A 128 -28.561 10.829 -8.045 1.00 23.30 H new ATOM 0 HH21 ARG A 128 -27.408 7.548 -7.463 1.00 64.11 H new ATOM 0 HH22 ARG A 128 -27.320 8.962 -8.518 1.00 64.11 H new ATOM 1950 N VAL A 129 -29.014 5.490 -0.834 1.00 61.44 N ATOM 1951 CA VAL A 129 -28.082 5.025 0.186 1.00 71.52 C ATOM 1952 C VAL A 129 -26.645 5.063 -0.324 1.00 13.23 C ATOM 1953 O VAL A 129 -26.397 4.930 -1.523 1.00 34.03 O ATOM 1954 CB VAL A 129 -28.415 3.593 0.641 1.00 44.32 C ATOM 1955 CG1 VAL A 129 -27.582 3.211 1.857 1.00 3.32 C ATOM 1956 CG2 VAL A 129 -29.901 3.462 0.941 1.00 62.34 C ATOM 0 H VAL A 129 -29.054 4.904 -1.668 1.00 61.44 H new ATOM 0 HA VAL A 129 -28.181 5.700 1.036 1.00 71.52 H new ATOM 0 HB VAL A 129 -28.168 2.906 -0.169 1.00 44.32 H new ATOM 0 HG11 VAL A 129 -27.831 2.195 2.164 1.00 3.32 H new ATOM 0 HG12 VAL A 129 -26.523 3.264 1.604 1.00 3.32 H new ATOM 0 HG13 VAL A 129 -27.795 3.900 2.675 1.00 3.32 H new ATOM 0 HG21 VAL A 129 -30.119 2.443 1.261 1.00 62.34 H new ATOM 0 HG22 VAL A 129 -30.175 4.158 1.734 1.00 62.34 H new ATOM 0 HG23 VAL A 129 -30.475 3.691 0.043 1.00 62.34 H new ATOM 1966 N TYR A 130 -25.701 5.245 0.593 1.00 2.33 N ATOM 1967 CA TYR A 130 -24.289 5.302 0.236 1.00 2.11 C ATOM 1968 C TYR A 130 -23.473 4.334 1.086 1.00 50.21 C ATOM 1969 O TYR A 130 -23.338 4.515 2.296 1.00 35.14 O ATOM 1970 CB TYR A 130 -23.755 6.725 0.408 1.00 54.22 C ATOM 1971 CG TYR A 130 -24.299 7.704 -0.607 1.00 50.10 C ATOM 1972 CD1 TYR A 130 -25.647 8.042 -0.624 1.00 41.25 C ATOM 1973 CD2 TYR A 130 -23.465 8.290 -1.552 1.00 64.34 C ATOM 1974 CE1 TYR A 130 -26.147 8.935 -1.551 1.00 42.45 C ATOM 1975 CE2 TYR A 130 -23.957 9.185 -2.482 1.00 13.34 C ATOM 1976 CZ TYR A 130 -25.299 9.504 -2.479 1.00 23.14 C ATOM 1977 OH TYR A 130 -25.794 10.394 -3.403 1.00 43.15 O ATOM 0 H TYR A 130 -25.889 5.356 1.589 1.00 2.33 H new ATOM 0 HA TYR A 130 -24.192 5.009 -0.809 1.00 2.11 H new ATOM 0 HB2 TYR A 130 -24.002 7.078 1.409 1.00 54.22 H new ATOM 0 HB3 TYR A 130 -22.668 6.707 0.336 1.00 54.22 H new ATOM 0 HD1 TYR A 130 -26.315 7.599 0.100 1.00 41.25 H new ATOM 0 HD2 TYR A 130 -22.414 8.041 -1.559 1.00 64.34 H new ATOM 0 HE1 TYR A 130 -27.197 9.187 -1.550 1.00 42.45 H new ATOM 0 HE2 TYR A 130 -23.294 9.633 -3.208 1.00 13.34 H new ATOM 0 HH TYR A 130 -25.066 10.703 -3.982 1.00 43.15 H new ATOM 1987 N ILE A 131 -22.930 3.305 0.443 1.00 62.14 N ATOM 1988 CA ILE A 131 -22.124 2.309 1.139 1.00 14.52 C ATOM 1989 C ILE A 131 -20.689 2.305 0.623 1.00 32.22 C ATOM 1990 O ILE A 131 -20.440 2.030 -0.550 1.00 50.11 O ATOM 1991 CB ILE A 131 -22.718 0.897 0.983 1.00 53.44 C ATOM 1992 CG1 ILE A 131 -23.956 0.740 1.868 1.00 75.34 C ATOM 1993 CG2 ILE A 131 -21.676 -0.156 1.327 1.00 74.22 C ATOM 1994 CD1 ILE A 131 -25.259 0.852 1.110 1.00 41.20 C ATOM 0 H ILE A 131 -23.034 3.139 -0.558 1.00 62.14 H new ATOM 0 HA ILE A 131 -22.127 2.581 2.194 1.00 14.52 H new ATOM 0 HB ILE A 131 -23.018 0.757 -0.056 1.00 53.44 H new ATOM 0 HG12 ILE A 131 -23.917 -0.229 2.365 1.00 75.34 H new ATOM 0 HG13 ILE A 131 -23.933 1.500 2.649 1.00 75.34 H new ATOM 0 HG21 ILE A 131 -22.111 -1.149 1.212 1.00 74.22 H new ATOM 0 HG22 ILE A 131 -20.821 -0.054 0.658 1.00 74.22 H new ATOM 0 HG23 ILE A 131 -21.348 -0.020 2.358 1.00 74.22 H new ATOM 0 HD11 ILE A 131 -26.093 0.731 1.801 1.00 41.20 H new ATOM 0 HD12 ILE A 131 -25.321 1.831 0.635 1.00 41.20 H new ATOM 0 HD13 ILE A 131 -25.304 0.075 0.347 1.00 41.20 H new ATOM 2006 N VAL A 132 -19.747 2.610 1.511 1.00 41.23 N ATOM 2007 CA VAL A 132 -18.335 2.638 1.147 1.00 34.34 C ATOM 2008 C VAL A 132 -17.692 1.269 1.334 1.00 0.01 C ATOM 2009 O VAL A 132 -18.017 0.543 2.272 1.00 51.31 O ATOM 2010 CB VAL A 132 -17.561 3.676 1.983 1.00 61.21 C ATOM 2011 CG1 VAL A 132 -18.146 5.065 1.784 1.00 1.22 C ATOM 2012 CG2 VAL A 132 -17.573 3.288 3.454 1.00 73.24 C ATOM 0 H VAL A 132 -19.936 2.841 2.486 1.00 41.23 H new ATOM 0 HA VAL A 132 -18.284 2.919 0.095 1.00 34.34 H new ATOM 0 HB VAL A 132 -16.525 3.693 1.643 1.00 61.21 H new ATOM 0 HG11 VAL A 132 -17.587 5.784 2.382 1.00 1.22 H new ATOM 0 HG12 VAL A 132 -18.081 5.340 0.731 1.00 1.22 H new ATOM 0 HG13 VAL A 132 -19.190 5.068 2.096 1.00 1.22 H new ATOM 0 HG21 VAL A 132 -17.022 4.031 4.031 1.00 73.24 H new ATOM 0 HG22 VAL A 132 -18.602 3.242 3.810 1.00 73.24 H new ATOM 0 HG23 VAL A 132 -17.103 2.312 3.577 1.00 73.24 H new ATOM 2022 N GLN A 133 -16.777 0.924 0.433 1.00 42.41 N ATOM 2023 CA GLN A 133 -16.088 -0.360 0.499 1.00 12.41 C ATOM 2024 C GLN A 133 -14.780 -0.236 1.274 1.00 54.20 C ATOM 2025 O GLN A 133 -13.849 0.441 0.838 1.00 2.20 O ATOM 2026 CB GLN A 133 -15.811 -0.887 -0.910 1.00 71.20 C ATOM 2027 CG GLN A 133 -16.962 -1.689 -1.496 1.00 14.21 C ATOM 2028 CD GLN A 133 -18.004 -0.813 -2.163 1.00 65.31 C ATOM 2029 OE1 GLN A 133 -17.990 -0.628 -3.380 1.00 73.53 O ATOM 2030 NE2 GLN A 133 -18.917 -0.267 -1.367 1.00 12.32 N ATOM 0 H GLN A 133 -16.496 1.514 -0.350 1.00 42.41 H new ATOM 0 HA GLN A 133 -16.734 -1.064 1.022 1.00 12.41 H new ATOM 0 HB2 GLN A 133 -15.593 -0.045 -1.568 1.00 71.20 H new ATOM 0 HB3 GLN A 133 -14.918 -1.512 -0.886 1.00 71.20 H new ATOM 0 HG2 GLN A 133 -16.571 -2.400 -2.224 1.00 14.21 H new ATOM 0 HG3 GLN A 133 -17.435 -2.271 -0.704 1.00 14.21 H new ATOM 0 HE21 GLN A 133 -18.892 -0.447 -0.363 1.00 12.32 H new ATOM 0 HE22 GLN A 133 -19.643 0.332 -1.760 1.00 12.32 H new ATOM 2039 N LYS A 134 -14.716 -0.895 2.427 1.00 12.52 N ATOM 2040 CA LYS A 134 -13.523 -0.860 3.263 1.00 43.01 C ATOM 2041 C LYS A 134 -12.674 -2.110 3.051 1.00 3.21 C ATOM 2042 O LYS A 134 -13.174 -3.144 2.609 1.00 43.24 O ATOM 2043 CB LYS A 134 -13.912 -0.740 4.738 1.00 4.32 C ATOM 2044 CG LYS A 134 -14.723 -1.917 5.252 1.00 31.52 C ATOM 2045 CD LYS A 134 -13.842 -2.936 5.957 1.00 15.52 C ATOM 2046 CE LYS A 134 -13.708 -2.624 7.439 1.00 55.02 C ATOM 2047 NZ LYS A 134 -12.803 -3.585 8.128 1.00 1.44 N1+ ATOM 0 H LYS A 134 -15.478 -1.460 2.803 1.00 12.52 H new ATOM 0 HA LYS A 134 -12.934 0.012 2.977 1.00 43.01 H new ATOM 0 HB2 LYS A 134 -13.006 -0.645 5.337 1.00 4.32 H new ATOM 0 HB3 LYS A 134 -14.486 0.176 4.880 1.00 4.32 H new ATOM 0 HG2 LYS A 134 -15.489 -1.559 5.940 1.00 31.52 H new ATOM 0 HG3 LYS A 134 -15.240 -2.395 4.420 1.00 31.52 H new ATOM 0 HD2 LYS A 134 -14.264 -3.933 5.830 1.00 15.52 H new ATOM 0 HD3 LYS A 134 -12.855 -2.947 5.495 1.00 15.52 H new ATOM 0 HE2 LYS A 134 -13.325 -1.611 7.564 1.00 55.02 H new ATOM 0 HE3 LYS A 134 -14.692 -2.653 7.907 1.00 55.02 H new ATOM 0 HZ1 LYS A 134 -12.738 -3.339 9.136 1.00 1.44 H new ATOM 0 HZ2 LYS A 134 -13.181 -4.549 8.031 1.00 1.44 H new ATOM 0 HZ3 LYS A 134 -11.857 -3.540 7.699 1.00 1.44 H new ATOM 2061 N ARG A 135 -11.387 -2.006 3.370 1.00 73.21 N ATOM 2062 CA ARG A 135 -10.470 -3.129 3.214 1.00 2.23 C ATOM 2063 C ARG A 135 -9.468 -3.175 4.364 1.00 4.34 C ATOM 2064 O ARG A 135 -9.368 -2.235 5.154 1.00 70.31 O ATOM 2065 CB ARG A 135 -9.726 -3.026 1.881 1.00 24.23 C ATOM 2066 CG ARG A 135 -8.991 -1.709 1.694 1.00 61.24 C ATOM 2067 CD ARG A 135 -7.761 -1.878 0.816 1.00 61.52 C ATOM 2068 NE ARG A 135 -8.077 -2.530 -0.452 1.00 65.45 N ATOM 2069 CZ ARG A 135 -7.157 -2.918 -1.328 1.00 44.11 C ATOM 2070 NH1 ARG A 135 -5.871 -2.720 -1.076 1.00 2.13 N1+ ATOM 2071 NH2 ARG A 135 -7.524 -3.504 -2.460 1.00 1.42 N ATOM 0 H ARG A 135 -10.957 -1.157 3.737 1.00 73.21 H new ATOM 0 HA ARG A 135 -11.055 -4.048 3.226 1.00 2.23 H new ATOM 0 HB2 ARG A 135 -9.010 -3.845 1.810 1.00 24.23 H new ATOM 0 HB3 ARG A 135 -10.439 -3.154 1.066 1.00 24.23 H new ATOM 0 HG2 ARG A 135 -9.662 -0.977 1.245 1.00 61.24 H new ATOM 0 HG3 ARG A 135 -8.694 -1.315 2.666 1.00 61.24 H new ATOM 0 HD2 ARG A 135 -7.319 -0.901 0.621 1.00 61.52 H new ATOM 0 HD3 ARG A 135 -7.014 -2.466 1.349 1.00 61.52 H new ATOM 0 HE ARG A 135 -9.058 -2.697 -0.677 1.00 65.45 H new ATOM 0 HH11 ARG A 135 -5.585 -2.268 -0.207 1.00 2.13 H new ATOM 0 HH12 ARG A 135 -5.167 -3.019 -1.751 1.00 2.13 H new ATOM 0 HH21 ARG A 135 -8.513 -3.657 -2.658 1.00 1.42 H new ATOM 0 HH22 ARG A 135 -6.817 -3.802 -3.133 1.00 1.42 H new ATOM 2085 N LYS A 136 -8.729 -4.275 4.455 1.00 75.34 N ATOM 2086 CA LYS A 136 -7.735 -4.446 5.508 1.00 14.01 C ATOM 2087 C LYS A 136 -6.324 -4.269 4.957 1.00 71.32 C ATOM 2088 O LYS A 136 -6.046 -4.620 3.809 1.00 71.05 O ATOM 2089 CB LYS A 136 -7.873 -5.829 6.149 1.00 52.34 C ATOM 2090 CG LYS A 136 -7.971 -6.961 5.142 1.00 44.13 C ATOM 2091 CD LYS A 136 -7.954 -8.318 5.823 1.00 43.40 C ATOM 2092 CE LYS A 136 -6.582 -8.637 6.393 1.00 63.11 C ATOM 2093 NZ LYS A 136 -5.549 -8.751 5.326 1.00 55.42 N1+ ATOM 0 H LYS A 136 -8.800 -5.063 3.811 1.00 75.34 H new ATOM 0 HA LYS A 136 -7.910 -3.682 6.266 1.00 14.01 H new ATOM 0 HB2 LYS A 136 -7.016 -6.006 6.799 1.00 52.34 H new ATOM 0 HB3 LYS A 136 -8.760 -5.840 6.782 1.00 52.34 H new ATOM 0 HG2 LYS A 136 -8.888 -6.855 4.563 1.00 44.13 H new ATOM 0 HG3 LYS A 136 -7.141 -6.896 4.439 1.00 44.13 H new ATOM 0 HD2 LYS A 136 -8.694 -8.334 6.623 1.00 43.40 H new ATOM 0 HD3 LYS A 136 -8.240 -9.089 5.108 1.00 43.40 H new ATOM 0 HE2 LYS A 136 -6.292 -7.858 7.097 1.00 63.11 H new ATOM 0 HE3 LYS A 136 -6.630 -9.571 6.953 1.00 63.11 H new ATOM 0 HZ1 LYS A 136 -4.850 -9.473 5.595 1.00 55.42 H new ATOM 0 HZ2 LYS A 136 -6.003 -9.025 4.431 1.00 55.42 H new ATOM 0 HZ3 LYS A 136 -5.072 -7.835 5.205 1.00 55.42 H new ATOM 2107 N ILE A 137 -5.436 -3.725 5.781 1.00 30.52 N ATOM 2108 CA ILE A 137 -4.052 -3.505 5.377 1.00 4.50 C ATOM 2109 C ILE A 137 -3.438 -4.777 4.804 1.00 42.20 C ATOM 2110 O ILE A 137 -4.018 -5.858 4.902 1.00 34.34 O ATOM 2111 CB ILE A 137 -3.191 -3.019 6.558 1.00 24.31 C ATOM 2112 CG1 ILE A 137 -3.272 -4.011 7.718 1.00 34.43 C ATOM 2113 CG2 ILE A 137 -3.638 -1.634 7.005 1.00 52.43 C ATOM 2114 CD1 ILE A 137 -2.265 -5.137 7.622 1.00 4.14 C ATOM 0 H ILE A 137 -5.650 -3.428 6.733 1.00 30.52 H new ATOM 0 HA ILE A 137 -4.067 -2.733 4.607 1.00 4.50 H new ATOM 0 HB ILE A 137 -2.153 -2.956 6.231 1.00 24.31 H new ATOM 0 HG12 ILE A 137 -3.118 -3.476 8.655 1.00 34.43 H new ATOM 0 HG13 ILE A 137 -4.276 -4.434 7.754 1.00 34.43 H new ATOM 0 HG21 ILE A 137 -3.020 -1.304 7.840 1.00 52.43 H new ATOM 0 HG22 ILE A 137 -3.533 -0.933 6.177 1.00 52.43 H new ATOM 0 HG23 ILE A 137 -4.681 -1.672 7.318 1.00 52.43 H new ATOM 0 HD11 ILE A 137 -2.380 -5.802 8.478 1.00 4.14 H new ATOM 0 HD12 ILE A 137 -2.432 -5.697 6.702 1.00 4.14 H new ATOM 0 HD13 ILE A 137 -1.256 -4.724 7.617 1.00 4.14 H new ATOM 2126 N SER A 138 -2.259 -4.640 4.206 1.00 33.30 N ATOM 2127 CA SER A 138 -1.565 -5.779 3.615 1.00 12.12 C ATOM 2128 C SER A 138 -0.577 -6.387 4.606 1.00 23.35 C ATOM 2129 O SER A 138 0.379 -5.735 5.025 1.00 14.03 O ATOM 2130 CB SER A 138 -0.831 -5.351 2.343 1.00 33.30 C ATOM 2131 OG SER A 138 0.023 -6.381 1.876 1.00 33.15 O ATOM 0 H SER A 138 -1.764 -3.752 4.118 1.00 33.30 H new ATOM 0 HA SER A 138 -2.308 -6.534 3.360 1.00 12.12 H new ATOM 0 HB2 SER A 138 -1.556 -5.096 1.569 1.00 33.30 H new ATOM 0 HB3 SER A 138 -0.247 -4.452 2.541 1.00 33.30 H new ATOM 0 HG SER A 138 0.479 -6.083 1.061 1.00 33.15 H new ATOM 2137 N GLU A 139 -0.816 -7.642 4.976 1.00 73.41 N ATOM 2138 CA GLU A 139 0.052 -8.338 5.918 1.00 32.15 C ATOM 2139 C GLU A 139 1.300 -8.866 5.219 1.00 5.54 C ATOM 2140 O GLU A 139 1.376 -8.886 3.991 1.00 63.51 O ATOM 2141 CB GLU A 139 -0.701 -9.493 6.581 1.00 31.35 C ATOM 2142 CG GLU A 139 -1.577 -9.059 7.746 1.00 73.33 C ATOM 2143 CD GLU A 139 -1.967 -10.216 8.644 1.00 40.35 C ATOM 2144 OE1 GLU A 139 -1.983 -11.367 8.159 1.00 55.44 O ATOM 2145 OE2 GLU A 139 -2.256 -9.972 9.835 1.00 25.42 O1- ATOM 0 H GLU A 139 -1.603 -8.196 4.638 1.00 73.41 H new ATOM 0 HA GLU A 139 0.359 -7.626 6.684 1.00 32.15 H new ATOM 0 HB2 GLU A 139 -1.323 -9.987 5.834 1.00 31.35 H new ATOM 0 HB3 GLU A 139 0.020 -10.231 6.934 1.00 31.35 H new ATOM 0 HG2 GLU A 139 -1.048 -8.310 8.334 1.00 73.33 H new ATOM 0 HG3 GLU A 139 -2.479 -8.583 7.360 1.00 73.33 H new ATOM 2152 N GLY A 140 2.280 -9.293 6.011 1.00 65.11 N ATOM 2153 CA GLY A 140 3.512 -9.815 5.451 1.00 41.24 C ATOM 2154 C GLY A 140 4.691 -8.890 5.680 1.00 43.02 C ATOM 2155 O GLY A 140 5.759 -9.079 5.099 1.00 23.34 O ATOM 0 H GLY A 140 2.242 -9.286 7.030 1.00 65.11 H new ATOM 0 HA2 GLY A 140 3.726 -10.787 5.895 1.00 41.24 H new ATOM 0 HA3 GLY A 140 3.382 -9.975 4.381 1.00 41.24 H new ATOM 2159 N ASP A 141 4.496 -7.885 6.527 1.00 63.32 N ATOM 2160 CA ASP A 141 5.551 -6.926 6.831 1.00 33.42 C ATOM 2161 C ASP A 141 5.682 -6.721 8.337 1.00 14.14 C ATOM 2162 O ASP A 141 4.792 -6.158 8.976 1.00 20.30 O ATOM 2163 CB ASP A 141 5.267 -5.589 6.144 1.00 74.13 C ATOM 2164 CG ASP A 141 6.534 -4.819 5.829 1.00 34.21 C ATOM 2165 OD1 ASP A 141 7.492 -5.436 5.318 1.00 41.30 O ATOM 2166 OD2 ASP A 141 6.569 -3.600 6.094 1.00 23.22 O1- ATOM 0 H ASP A 141 3.617 -7.714 7.015 1.00 63.32 H new ATOM 0 HA ASP A 141 6.492 -7.327 6.454 1.00 33.42 H new ATOM 0 HB2 ASP A 141 4.715 -5.768 5.221 1.00 74.13 H new ATOM 0 HB3 ASP A 141 4.627 -4.983 6.785 1.00 74.13 H new TER 2171 ASP A 141