USER MOD reduce.3.24.130724 H: found=0, std=0, add=1024, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1022 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 87 ASN :FLIP amide:sc= -0.0678 F(o=-1.6,f=-0.13) USER MOD Set 1.2: A 113 GLN : amide:sc= -0.0609 K(o=-0.13,f=-2.5!) USER MOD Set 2.1: A 45 THR OG1 : rot 164:sc= -0.706 USER MOD Set 2.2: A 60 GLN : amide:sc= 0.46 X(o=0.13,f=-0.33) USER MOD Set 2.3: A 78 THR OG1 : rot 180:sc= 0.378 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 MET CE :methyl -110:sc= -4.99! (180deg=-5.85!) USER MOD Single : A 16 ASN : amide:sc= -0.0399 X(o=-0.04,f=0) USER MOD Single : A 21 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.138) USER MOD Single : A 22 ASN : amide:sc= -1.46 K(o=-1.5,f=-5!) USER MOD Single : A 24 SER OG : rot 22:sc= 0.133! USER MOD Single : A 25 TYR OH : rot 165:sc= -0.365 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 35 HIS : no HE2:sc= -3.91 K(o=-3.9,f=-4.4!) USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 CYS SG : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot 82:sc= 0.253 USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 THR OG1 : rot 47:sc= 1.1 USER MOD Single : A 65 ASN : amide:sc= -0.232 K(o=-0.23,f=-2.2!) USER MOD Single : A 70 HIS : no HD1:sc= -0.822 X(o=-0.82,f=-0.55) USER MOD Single : A 73 CYS SG : rot 160:sc= -3.02! USER MOD Single : A 76 HIS : no HD1:sc= 0.249 K(o=0.25,f=-2!) USER MOD Single : A 77 THR OG1 : rot -160:sc= 0.455 USER MOD Single : A 82 GLN : amide:sc= -0.292 X(o=-0.29,f=0) USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 GLN : amide:sc= -0.82 X(o=-0.82,f=-0.84) USER MOD Single : A 94 CYS SG : rot 59:sc= -3.27! USER MOD Single : A 95 THR OG1 : rot -128:sc= -0.722 USER MOD Single : A 97 CYS SG : rot 12:sc= 0.503 USER MOD Single : A 99 THR OG1 : rot -61:sc= -1.97 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 106 CYS SG : rot 180:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ 169:sc= 0.122 (180deg=0.0909) USER MOD Single : A 111 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 129 SER OG : rot 31:sc= 1.27 USER MOD Single : A 132 SER OG : rot -58:sc=0.000679 USER MOD Single : A 133 SER OG : rot -63:sc= 0.15 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -18.858 15.684 -11.842 1.00 0.00 N ATOM 2 CA GLY A 1 -19.917 14.700 -11.712 1.00 0.00 C ATOM 3 C GLY A 1 -19.468 13.461 -10.963 1.00 0.00 C ATOM 4 O GLY A 1 -18.482 12.825 -11.336 1.00 0.00 O ATOM 0 H1 GLY A 1 -19.215 16.512 -12.361 1.00 0.00 H new ATOM 0 H2 GLY A 1 -18.540 15.979 -10.897 1.00 0.00 H new ATOM 0 H3 GLY A 1 -18.059 15.268 -12.362 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -20.764 15.148 -11.192 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -20.267 14.414 -12.704 1.00 0.00 H new ATOM 8 N SER A 2 -20.193 13.117 -9.903 1.00 0.00 N ATOM 9 CA SER A 2 -19.860 11.949 -9.096 1.00 0.00 C ATOM 10 C SER A 2 -20.971 10.906 -9.167 1.00 0.00 C ATOM 11 O SER A 2 -22.034 11.072 -8.570 1.00 0.00 O ATOM 12 CB SER A 2 -19.623 12.359 -7.641 1.00 0.00 C ATOM 13 OG SER A 2 -18.270 12.726 -7.429 1.00 0.00 O ATOM 0 H SER A 2 -21.014 13.630 -9.583 1.00 0.00 H new ATOM 0 HA SER A 2 -18.946 11.510 -9.496 1.00 0.00 H new ATOM 0 HB2 SER A 2 -20.274 13.195 -7.384 1.00 0.00 H new ATOM 0 HB3 SER A 2 -19.887 11.534 -6.980 1.00 0.00 H new ATOM 0 HG SER A 2 -18.144 12.986 -6.492 1.00 0.00 H new ATOM 19 N SER A 3 -20.716 9.829 -9.904 1.00 0.00 N ATOM 20 CA SER A 3 -21.694 8.759 -10.057 1.00 0.00 C ATOM 21 C SER A 3 -21.039 7.499 -10.615 1.00 0.00 C ATOM 22 O SER A 3 -20.171 7.569 -11.484 1.00 0.00 O ATOM 23 CB SER A 3 -22.830 9.206 -10.979 1.00 0.00 C ATOM 24 OG SER A 3 -22.353 9.466 -12.288 1.00 0.00 O ATOM 0 H SER A 3 -19.840 9.675 -10.404 1.00 0.00 H new ATOM 0 HA SER A 3 -22.102 8.530 -9.072 1.00 0.00 H new ATOM 0 HB2 SER A 3 -23.598 8.434 -11.015 1.00 0.00 H new ATOM 0 HB3 SER A 3 -23.299 10.103 -10.575 1.00 0.00 H new ATOM 0 HG SER A 3 -23.099 9.748 -12.858 1.00 0.00 H new ATOM 30 N GLY A 4 -21.461 6.345 -10.107 1.00 0.00 N ATOM 31 CA GLY A 4 -20.905 5.085 -10.564 1.00 0.00 C ATOM 32 C GLY A 4 -21.547 3.889 -9.889 1.00 0.00 C ATOM 33 O GLY A 4 -21.665 3.848 -8.665 1.00 0.00 O ATOM 0 H GLY A 4 -22.178 6.260 -9.387 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -21.037 5.003 -11.643 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -19.832 5.074 -10.372 1.00 0.00 H new ATOM 37 N SER A 5 -21.965 2.914 -10.690 1.00 0.00 N ATOM 38 CA SER A 5 -22.604 1.713 -10.163 1.00 0.00 C ATOM 39 C SER A 5 -21.575 0.614 -9.917 1.00 0.00 C ATOM 40 O SER A 5 -20.447 0.683 -10.406 1.00 0.00 O ATOM 41 CB SER A 5 -23.678 1.214 -11.132 1.00 0.00 C ATOM 42 OG SER A 5 -24.763 2.124 -11.203 1.00 0.00 O ATOM 0 H SER A 5 -21.873 2.932 -11.706 1.00 0.00 H new ATOM 0 HA SER A 5 -23.073 1.968 -9.212 1.00 0.00 H new ATOM 0 HB2 SER A 5 -23.245 1.082 -12.123 1.00 0.00 H new ATOM 0 HB3 SER A 5 -24.039 0.238 -10.809 1.00 0.00 H new ATOM 0 HG SER A 5 -25.435 1.784 -11.830 1.00 0.00 H new ATOM 48 N SER A 6 -21.973 -0.400 -9.155 1.00 0.00 N ATOM 49 CA SER A 6 -21.085 -1.513 -8.840 1.00 0.00 C ATOM 50 C SER A 6 -21.152 -2.585 -9.923 1.00 0.00 C ATOM 51 O SER A 6 -22.179 -2.759 -10.578 1.00 0.00 O ATOM 52 CB SER A 6 -21.454 -2.119 -7.484 1.00 0.00 C ATOM 53 OG SER A 6 -22.674 -2.835 -7.560 1.00 0.00 O ATOM 0 H SER A 6 -22.904 -0.474 -8.745 1.00 0.00 H new ATOM 0 HA SER A 6 -20.065 -1.130 -8.794 1.00 0.00 H new ATOM 0 HB2 SER A 6 -20.658 -2.785 -7.151 1.00 0.00 H new ATOM 0 HB3 SER A 6 -21.539 -1.327 -6.740 1.00 0.00 H new ATOM 0 HG SER A 6 -22.886 -3.214 -6.681 1.00 0.00 H new ATOM 59 N GLY A 7 -20.047 -3.302 -10.107 1.00 0.00 N ATOM 60 CA GLY A 7 -20.000 -4.348 -11.112 1.00 0.00 C ATOM 61 C GLY A 7 -18.594 -4.863 -11.347 1.00 0.00 C ATOM 62 O GLY A 7 -18.385 -6.064 -11.522 1.00 0.00 O ATOM 0 H GLY A 7 -19.184 -3.177 -9.578 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -20.639 -5.175 -10.802 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -20.405 -3.966 -12.049 1.00 0.00 H new ATOM 66 N VAL A 8 -17.625 -3.953 -11.354 1.00 0.00 N ATOM 67 CA VAL A 8 -16.231 -4.321 -11.570 1.00 0.00 C ATOM 68 C VAL A 8 -15.774 -5.364 -10.555 1.00 0.00 C ATOM 69 O VAL A 8 -16.567 -5.845 -9.745 1.00 0.00 O ATOM 70 CB VAL A 8 -15.305 -3.094 -11.480 1.00 0.00 C ATOM 71 CG1 VAL A 8 -15.620 -2.104 -12.591 1.00 0.00 C ATOM 72 CG2 VAL A 8 -15.429 -2.432 -10.115 1.00 0.00 C ATOM 0 H VAL A 8 -17.780 -2.955 -11.212 1.00 0.00 H new ATOM 0 HA VAL A 8 -16.167 -4.742 -12.574 1.00 0.00 H new ATOM 0 HB VAL A 8 -14.275 -3.428 -11.605 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -14.956 -1.244 -12.511 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -15.476 -2.585 -13.559 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -16.655 -1.773 -12.501 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -14.768 -1.567 -10.069 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -16.459 -2.111 -9.959 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -15.149 -3.144 -9.339 1.00 0.00 H new ATOM 82 N ASP A 9 -14.492 -5.708 -10.605 1.00 0.00 N ATOM 83 CA ASP A 9 -13.929 -6.693 -9.689 1.00 0.00 C ATOM 84 C ASP A 9 -13.696 -6.083 -8.311 1.00 0.00 C ATOM 85 O ASP A 9 -12.588 -6.133 -7.779 1.00 0.00 O ATOM 86 CB ASP A 9 -12.615 -7.245 -10.245 1.00 0.00 C ATOM 87 CG ASP A 9 -12.349 -8.668 -9.797 1.00 0.00 C ATOM 88 OD1 ASP A 9 -12.205 -8.888 -8.576 1.00 0.00 O ATOM 89 OD2 ASP A 9 -12.285 -9.562 -10.667 1.00 0.00 O ATOM 0 H ASP A 9 -13.823 -5.319 -11.270 1.00 0.00 H new ATOM 0 HA ASP A 9 -14.644 -7.510 -9.589 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -12.641 -7.209 -11.334 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -11.792 -6.607 -9.925 1.00 0.00 H new ATOM 94 N GLU A 10 -14.749 -5.505 -7.740 1.00 0.00 N ATOM 95 CA GLU A 10 -14.657 -4.883 -6.424 1.00 0.00 C ATOM 96 C GLU A 10 -13.692 -5.651 -5.525 1.00 0.00 C ATOM 97 O GLU A 10 -13.560 -6.872 -5.614 1.00 0.00 O ATOM 98 CB GLU A 10 -16.039 -4.817 -5.769 1.00 0.00 C ATOM 99 CG GLU A 10 -16.905 -3.683 -6.290 1.00 0.00 C ATOM 100 CD GLU A 10 -18.022 -3.315 -5.333 1.00 0.00 C ATOM 101 OE1 GLU A 10 -19.103 -3.935 -5.417 1.00 0.00 O ATOM 102 OE2 GLU A 10 -17.816 -2.407 -4.501 1.00 0.00 O ATOM 0 H GLU A 10 -15.674 -5.455 -8.167 1.00 0.00 H new ATOM 0 HA GLU A 10 -14.276 -3.870 -6.555 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -16.555 -5.763 -5.934 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -15.916 -4.704 -4.692 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -16.281 -2.807 -6.469 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -17.334 -3.970 -7.250 1.00 0.00 H new ATOM 109 N PRO A 11 -13.002 -4.920 -4.637 1.00 0.00 N ATOM 110 CA PRO A 11 -12.038 -5.511 -3.705 1.00 0.00 C ATOM 111 C PRO A 11 -12.713 -6.356 -2.630 1.00 0.00 C ATOM 112 O PRO A 11 -12.052 -6.882 -1.736 1.00 0.00 O ATOM 113 CB PRO A 11 -11.358 -4.291 -3.077 1.00 0.00 C ATOM 114 CG PRO A 11 -12.360 -3.195 -3.200 1.00 0.00 C ATOM 115 CD PRO A 11 -13.110 -3.460 -4.476 1.00 0.00 C ATOM 0 HA PRO A 11 -11.349 -6.189 -4.208 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -11.098 -4.475 -2.035 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -10.433 -4.042 -3.597 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -13.036 -3.187 -2.345 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -11.871 -2.221 -3.230 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -14.149 -3.139 -4.406 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -12.669 -2.929 -5.319 1.00 0.00 H new ATOM 123 N GLU A 12 -14.033 -6.482 -2.726 1.00 0.00 N ATOM 124 CA GLU A 12 -14.797 -7.264 -1.761 1.00 0.00 C ATOM 125 C GLU A 12 -14.275 -8.696 -1.686 1.00 0.00 C ATOM 126 O GLU A 12 -14.139 -9.262 -0.602 1.00 0.00 O ATOM 127 CB GLU A 12 -16.281 -7.268 -2.135 1.00 0.00 C ATOM 128 CG GLU A 12 -16.594 -8.096 -3.369 1.00 0.00 C ATOM 129 CD GLU A 12 -17.914 -7.712 -4.010 1.00 0.00 C ATOM 130 OE1 GLU A 12 -18.013 -6.582 -4.531 1.00 0.00 O ATOM 131 OE2 GLU A 12 -18.848 -8.541 -3.990 1.00 0.00 O ATOM 0 H GLU A 12 -14.595 -6.053 -3.461 1.00 0.00 H new ATOM 0 HA GLU A 12 -14.678 -6.801 -0.781 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -16.858 -7.652 -1.294 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -16.608 -6.242 -2.304 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -15.792 -7.974 -4.097 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -16.620 -9.151 -3.097 1.00 0.00 H new ATOM 138 N SER A 13 -13.986 -9.275 -2.847 1.00 0.00 N ATOM 139 CA SER A 13 -13.484 -10.643 -2.914 1.00 0.00 C ATOM 140 C SER A 13 -11.967 -10.673 -2.755 1.00 0.00 C ATOM 141 O SER A 13 -11.345 -11.732 -2.828 1.00 0.00 O ATOM 142 CB SER A 13 -13.882 -11.289 -4.242 1.00 0.00 C ATOM 143 OG SER A 13 -15.283 -11.485 -4.315 1.00 0.00 O ATOM 0 H SER A 13 -14.091 -8.819 -3.753 1.00 0.00 H new ATOM 0 HA SER A 13 -13.929 -11.208 -2.095 1.00 0.00 H new ATOM 0 HB2 SER A 13 -13.557 -10.658 -5.069 1.00 0.00 H new ATOM 0 HB3 SER A 13 -13.372 -12.246 -4.352 1.00 0.00 H new ATOM 0 HG SER A 13 -15.511 -11.898 -5.174 1.00 0.00 H new ATOM 149 N MET A 14 -11.378 -9.501 -2.537 1.00 0.00 N ATOM 150 CA MET A 14 -9.934 -9.393 -2.366 1.00 0.00 C ATOM 151 C MET A 14 -9.563 -9.349 -0.887 1.00 0.00 C ATOM 152 O MET A 14 -10.378 -8.976 -0.043 1.00 0.00 O ATOM 153 CB MET A 14 -9.408 -8.142 -3.073 1.00 0.00 C ATOM 154 CG MET A 14 -8.286 -7.445 -2.320 1.00 0.00 C ATOM 155 SD MET A 14 -7.898 -5.821 -2.999 1.00 0.00 S ATOM 156 CE MET A 14 -8.001 -6.155 -4.755 1.00 0.00 C ATOM 0 H MET A 14 -11.878 -8.614 -2.475 1.00 0.00 H new ATOM 0 HA MET A 14 -9.473 -10.275 -2.812 1.00 0.00 H new ATOM 0 HB2 MET A 14 -9.052 -8.418 -4.065 1.00 0.00 H new ATOM 0 HB3 MET A 14 -10.231 -7.441 -3.213 1.00 0.00 H new ATOM 0 HG2 MET A 14 -8.568 -7.339 -1.273 1.00 0.00 H new ATOM 0 HG3 MET A 14 -7.393 -8.069 -2.348 1.00 0.00 H new ATOM 0 HE1 MET A 14 -7.003 -6.117 -5.192 1.00 0.00 H new ATOM 0 HE2 MET A 14 -8.428 -7.145 -4.913 1.00 0.00 H new ATOM 0 HE3 MET A 14 -8.634 -5.407 -5.231 1.00 0.00 H new ATOM 166 N VAL A 15 -8.328 -9.735 -0.579 1.00 0.00 N ATOM 167 CA VAL A 15 -7.850 -9.739 0.798 1.00 0.00 C ATOM 168 C VAL A 15 -6.841 -8.621 1.032 1.00 0.00 C ATOM 169 O VAL A 15 -5.987 -8.354 0.188 1.00 0.00 O ATOM 170 CB VAL A 15 -7.200 -11.087 1.162 1.00 0.00 C ATOM 171 CG1 VAL A 15 -6.723 -11.077 2.606 1.00 0.00 C ATOM 172 CG2 VAL A 15 -8.174 -12.230 0.921 1.00 0.00 C ATOM 0 H VAL A 15 -7.641 -10.049 -1.265 1.00 0.00 H new ATOM 0 HA VAL A 15 -8.719 -9.579 1.436 1.00 0.00 H new ATOM 0 HB VAL A 15 -6.333 -11.238 0.519 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -6.267 -12.038 2.845 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -5.989 -10.283 2.741 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -7.571 -10.904 3.268 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -7.698 -13.175 1.183 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -9.062 -12.087 1.537 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -8.461 -12.248 -0.130 1.00 0.00 H new ATOM 182 N ASN A 16 -6.945 -7.970 2.187 1.00 0.00 N ATOM 183 CA ASN A 16 -6.041 -6.879 2.533 1.00 0.00 C ATOM 184 C ASN A 16 -5.002 -7.337 3.553 1.00 0.00 C ATOM 185 O ASN A 16 -5.346 -7.817 4.634 1.00 0.00 O ATOM 186 CB ASN A 16 -6.829 -5.692 3.090 1.00 0.00 C ATOM 187 CG ASN A 16 -7.557 -4.922 2.004 1.00 0.00 C ATOM 188 OD1 ASN A 16 -7.173 -3.806 1.656 1.00 0.00 O ATOM 189 ND2 ASN A 16 -8.615 -5.517 1.465 1.00 0.00 N ATOM 0 H ASN A 16 -7.646 -8.179 2.898 1.00 0.00 H new ATOM 0 HA ASN A 16 -5.523 -6.568 1.626 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -7.551 -6.050 3.824 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -6.148 -5.021 3.614 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -9.145 -5.047 0.731 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -8.897 -6.443 1.785 1.00 0.00 H new ATOM 196 N LEU A 17 -3.730 -7.185 3.202 1.00 0.00 N ATOM 197 CA LEU A 17 -2.640 -7.581 4.087 1.00 0.00 C ATOM 198 C LEU A 17 -2.457 -6.570 5.214 1.00 0.00 C ATOM 199 O LEU A 17 -2.959 -5.448 5.142 1.00 0.00 O ATOM 200 CB LEU A 17 -1.338 -7.719 3.295 1.00 0.00 C ATOM 201 CG LEU A 17 -1.330 -8.784 2.197 1.00 0.00 C ATOM 202 CD1 LEU A 17 -0.010 -8.764 1.443 1.00 0.00 C ATOM 203 CD2 LEU A 17 -1.587 -10.162 2.789 1.00 0.00 C ATOM 0 H LEU A 17 -3.428 -6.791 2.311 1.00 0.00 H new ATOM 0 HA LEU A 17 -2.895 -8.545 4.527 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -1.109 -6.755 2.840 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -0.532 -7.941 3.995 1.00 0.00 H new ATOM 0 HG LEU A 17 -2.130 -8.558 1.493 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -0.023 -9.528 0.666 1.00 0.00 H new ATOM 0 HD12 LEU A 17 0.133 -7.785 0.986 1.00 0.00 H new ATOM 0 HD13 LEU A 17 0.808 -8.965 2.135 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -1.578 -10.907 1.994 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -0.809 -10.397 3.515 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -2.559 -10.170 3.283 1.00 0.00 H new ATOM 215 N ALA A 18 -1.734 -6.973 6.253 1.00 0.00 N ATOM 216 CA ALA A 18 -1.482 -6.101 7.393 1.00 0.00 C ATOM 217 C ALA A 18 0.014 -5.914 7.621 1.00 0.00 C ATOM 218 O ALA A 18 0.458 -4.851 8.056 1.00 0.00 O ATOM 219 CB ALA A 18 -2.142 -6.663 8.644 1.00 0.00 C ATOM 0 H ALA A 18 -1.312 -7.899 6.329 1.00 0.00 H new ATOM 0 HA ALA A 18 -1.915 -5.125 7.174 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -1.945 -6.001 9.488 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -3.218 -6.739 8.485 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -1.736 -7.652 8.856 1.00 0.00 H new ATOM 225 N PHE A 19 0.788 -6.953 7.325 1.00 0.00 N ATOM 226 CA PHE A 19 2.235 -6.904 7.499 1.00 0.00 C ATOM 227 C PHE A 19 2.933 -7.843 6.520 1.00 0.00 C ATOM 228 O PHE A 19 2.769 -9.062 6.588 1.00 0.00 O ATOM 229 CB PHE A 19 2.610 -7.274 8.935 1.00 0.00 C ATOM 230 CG PHE A 19 3.994 -7.842 9.066 1.00 0.00 C ATOM 231 CD1 PHE A 19 5.080 -7.190 8.503 1.00 0.00 C ATOM 232 CD2 PHE A 19 4.210 -9.027 9.751 1.00 0.00 C ATOM 233 CE1 PHE A 19 6.355 -7.711 8.621 1.00 0.00 C ATOM 234 CE2 PHE A 19 5.483 -9.552 9.873 1.00 0.00 C ATOM 235 CZ PHE A 19 6.557 -8.893 9.308 1.00 0.00 C ATOM 0 H PHE A 19 0.437 -7.840 6.963 1.00 0.00 H new ATOM 0 HA PHE A 19 2.566 -5.886 7.296 1.00 0.00 H new ATOM 0 HB2 PHE A 19 2.529 -6.387 9.563 1.00 0.00 H new ATOM 0 HB3 PHE A 19 1.891 -8.000 9.314 1.00 0.00 H new ATOM 0 HD1 PHE A 19 4.928 -6.265 7.966 1.00 0.00 H new ATOM 0 HD2 PHE A 19 3.374 -9.547 10.195 1.00 0.00 H new ATOM 0 HE1 PHE A 19 7.193 -7.195 8.176 1.00 0.00 H new ATOM 0 HE2 PHE A 19 5.637 -10.476 10.410 1.00 0.00 H new ATOM 0 HZ PHE A 19 7.553 -9.300 9.403 1.00 0.00 H new ATOM 245 N VAL A 20 3.712 -7.268 5.610 1.00 0.00 N ATOM 246 CA VAL A 20 4.436 -8.053 4.617 1.00 0.00 C ATOM 247 C VAL A 20 5.942 -7.956 4.832 1.00 0.00 C ATOM 248 O VAL A 20 6.507 -6.863 4.866 1.00 0.00 O ATOM 249 CB VAL A 20 4.102 -7.592 3.185 1.00 0.00 C ATOM 250 CG1 VAL A 20 5.089 -8.183 2.191 1.00 0.00 C ATOM 251 CG2 VAL A 20 2.675 -7.973 2.823 1.00 0.00 C ATOM 0 H VAL A 20 3.858 -6.261 5.540 1.00 0.00 H new ATOM 0 HA VAL A 20 4.120 -9.089 4.740 1.00 0.00 H new ATOM 0 HB VAL A 20 4.186 -6.506 3.142 1.00 0.00 H new ATOM 0 HG11 VAL A 20 4.838 -7.847 1.185 1.00 0.00 H new ATOM 0 HG12 VAL A 20 6.098 -7.856 2.442 1.00 0.00 H new ATOM 0 HG13 VAL A 20 5.040 -9.271 2.233 1.00 0.00 H new ATOM 0 HG21 VAL A 20 2.456 -7.640 1.809 1.00 0.00 H new ATOM 0 HG22 VAL A 20 2.561 -9.055 2.882 1.00 0.00 H new ATOM 0 HG23 VAL A 20 1.984 -7.497 3.519 1.00 0.00 H new ATOM 261 N LYS A 21 6.588 -9.108 4.976 1.00 0.00 N ATOM 262 CA LYS A 21 8.030 -9.156 5.186 1.00 0.00 C ATOM 263 C LYS A 21 8.772 -8.524 4.012 1.00 0.00 C ATOM 264 O LYS A 21 8.827 -9.093 2.923 1.00 0.00 O ATOM 265 CB LYS A 21 8.491 -10.603 5.376 1.00 0.00 C ATOM 266 CG LYS A 21 9.710 -10.741 6.272 1.00 0.00 C ATOM 267 CD LYS A 21 10.831 -9.812 5.836 1.00 0.00 C ATOM 268 CE LYS A 21 11.914 -9.709 6.898 1.00 0.00 C ATOM 269 NZ LYS A 21 12.434 -11.048 7.292 1.00 0.00 N ATOM 0 H LYS A 21 6.135 -10.022 4.951 1.00 0.00 H new ATOM 0 HA LYS A 21 8.260 -8.587 6.087 1.00 0.00 H new ATOM 0 HB2 LYS A 21 7.672 -11.184 5.800 1.00 0.00 H new ATOM 0 HB3 LYS A 21 8.717 -11.035 4.401 1.00 0.00 H new ATOM 0 HG2 LYS A 21 9.432 -10.519 7.302 1.00 0.00 H new ATOM 0 HG3 LYS A 21 10.062 -11.772 6.252 1.00 0.00 H new ATOM 0 HD2 LYS A 21 11.266 -10.177 4.905 1.00 0.00 H new ATOM 0 HD3 LYS A 21 10.425 -8.821 5.631 1.00 0.00 H new ATOM 0 HE2 LYS A 21 12.734 -9.097 6.522 1.00 0.00 H new ATOM 0 HE3 LYS A 21 11.514 -9.202 7.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 13.289 -10.931 7.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 11.710 -11.554 7.841 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 12.667 -11.595 6.439 1.00 0.00 H new ATOM 283 N ASN A 22 9.343 -7.347 4.244 1.00 0.00 N ATOM 284 CA ASN A 22 10.083 -6.639 3.205 1.00 0.00 C ATOM 285 C ASN A 22 11.138 -5.722 3.818 1.00 0.00 C ATOM 286 O ASN A 22 11.082 -5.401 5.005 1.00 0.00 O ATOM 287 CB ASN A 22 9.126 -5.823 2.334 1.00 0.00 C ATOM 288 CG ASN A 22 8.669 -4.547 3.015 1.00 0.00 C ATOM 289 OD1 ASN A 22 8.897 -3.446 2.513 1.00 0.00 O ATOM 290 ND2 ASN A 22 8.020 -4.690 4.165 1.00 0.00 N ATOM 0 H ASN A 22 9.308 -6.863 5.141 1.00 0.00 H new ATOM 0 HA ASN A 22 10.587 -7.379 2.584 1.00 0.00 H new ATOM 0 HB2 ASN A 22 9.618 -5.574 1.394 1.00 0.00 H new ATOM 0 HB3 ASN A 22 8.256 -6.431 2.087 1.00 0.00 H new ATOM 0 HD21 ASN A 22 7.688 -3.868 4.669 1.00 0.00 H new ATOM 0 HD22 ASN A 22 7.853 -5.622 4.544 1.00 0.00 H new ATOM 297 N ASP A 23 12.097 -5.303 2.999 1.00 0.00 N ATOM 298 CA ASP A 23 13.163 -4.422 3.459 1.00 0.00 C ATOM 299 C ASP A 23 13.441 -3.325 2.436 1.00 0.00 C ATOM 300 O ASP A 23 13.725 -3.605 1.272 1.00 0.00 O ATOM 301 CB ASP A 23 14.439 -5.224 3.723 1.00 0.00 C ATOM 302 CG ASP A 23 15.304 -4.598 4.800 1.00 0.00 C ATOM 303 OD1 ASP A 23 14.902 -4.639 5.981 1.00 0.00 O ATOM 304 OD2 ASP A 23 16.382 -4.067 4.460 1.00 0.00 O ATOM 0 H ASP A 23 12.157 -5.560 2.014 1.00 0.00 H new ATOM 0 HA ASP A 23 12.838 -3.954 4.388 1.00 0.00 H new ATOM 0 HB2 ASP A 23 14.172 -6.238 4.019 1.00 0.00 H new ATOM 0 HB3 ASP A 23 15.013 -5.302 2.800 1.00 0.00 H new ATOM 309 N SER A 24 13.356 -2.074 2.879 1.00 0.00 N ATOM 310 CA SER A 24 13.592 -0.935 2.001 1.00 0.00 C ATOM 311 C SER A 24 14.787 -0.117 2.483 1.00 0.00 C ATOM 312 O SER A 24 14.879 0.234 3.659 1.00 0.00 O ATOM 313 CB SER A 24 12.347 -0.049 1.933 1.00 0.00 C ATOM 314 OG SER A 24 12.168 0.672 3.141 1.00 0.00 O ATOM 0 H SER A 24 13.125 -1.824 3.841 1.00 0.00 H new ATOM 0 HA SER A 24 13.812 -1.316 1.004 1.00 0.00 H new ATOM 0 HB2 SER A 24 12.438 0.648 1.100 1.00 0.00 H new ATOM 0 HB3 SER A 24 11.469 -0.665 1.740 1.00 0.00 H new ATOM 0 HG SER A 24 13.022 0.726 3.619 1.00 0.00 H new ATOM 320 N TYR A 25 15.699 0.183 1.565 1.00 0.00 N ATOM 321 CA TYR A 25 16.890 0.957 1.895 1.00 0.00 C ATOM 322 C TYR A 25 16.872 2.310 1.191 1.00 0.00 C ATOM 323 O TYR A 25 16.261 2.464 0.134 1.00 0.00 O ATOM 324 CB TYR A 25 18.151 0.184 1.506 1.00 0.00 C ATOM 325 CG TYR A 25 18.260 -0.089 0.023 1.00 0.00 C ATOM 326 CD1 TYR A 25 18.838 0.841 -0.834 1.00 0.00 C ATOM 327 CD2 TYR A 25 17.786 -1.275 -0.523 1.00 0.00 C ATOM 328 CE1 TYR A 25 18.940 0.597 -2.190 1.00 0.00 C ATOM 329 CE2 TYR A 25 17.885 -1.528 -1.877 1.00 0.00 C ATOM 330 CZ TYR A 25 18.462 -0.590 -2.706 1.00 0.00 C ATOM 331 OH TYR A 25 18.561 -0.838 -4.056 1.00 0.00 O ATOM 0 H TYR A 25 15.636 -0.098 0.586 1.00 0.00 H new ATOM 0 HA TYR A 25 16.895 1.127 2.972 1.00 0.00 H new ATOM 0 HB2 TYR A 25 19.027 0.748 1.829 1.00 0.00 H new ATOM 0 HB3 TYR A 25 18.166 -0.764 2.044 1.00 0.00 H new ATOM 0 HD1 TYR A 25 19.214 1.770 -0.433 1.00 0.00 H new ATOM 0 HD2 TYR A 25 17.332 -2.012 0.123 1.00 0.00 H new ATOM 0 HE1 TYR A 25 19.391 1.331 -2.842 1.00 0.00 H new ATOM 0 HE2 TYR A 25 17.512 -2.456 -2.284 1.00 0.00 H new ATOM 0 HH TYR A 25 18.406 -1.791 -4.226 1.00 0.00 H new ATOM 341 N GLU A 26 17.548 3.289 1.785 1.00 0.00 N ATOM 342 CA GLU A 26 17.610 4.629 1.216 1.00 0.00 C ATOM 343 C GLU A 26 18.532 4.662 0.000 1.00 0.00 C ATOM 344 O GLU A 26 19.755 4.628 0.133 1.00 0.00 O ATOM 345 CB GLU A 26 18.096 5.632 2.265 1.00 0.00 C ATOM 346 CG GLU A 26 17.032 6.012 3.281 1.00 0.00 C ATOM 347 CD GLU A 26 17.596 6.795 4.451 1.00 0.00 C ATOM 348 OE1 GLU A 26 18.710 6.462 4.906 1.00 0.00 O ATOM 349 OE2 GLU A 26 16.923 7.741 4.911 1.00 0.00 O ATOM 0 H GLU A 26 18.060 3.178 2.660 1.00 0.00 H new ATOM 0 HA GLU A 26 16.605 4.906 0.897 1.00 0.00 H new ATOM 0 HB2 GLU A 26 18.953 5.210 2.789 1.00 0.00 H new ATOM 0 HB3 GLU A 26 18.443 6.534 1.760 1.00 0.00 H new ATOM 0 HG2 GLU A 26 16.261 6.605 2.789 1.00 0.00 H new ATOM 0 HG3 GLU A 26 16.550 5.108 3.652 1.00 0.00 H new ATOM 356 N LYS A 27 17.936 4.728 -1.185 1.00 0.00 N ATOM 357 CA LYS A 27 18.701 4.766 -2.426 1.00 0.00 C ATOM 358 C LYS A 27 18.787 6.188 -2.969 1.00 0.00 C ATOM 359 O LYS A 27 17.896 7.006 -2.739 1.00 0.00 O ATOM 360 CB LYS A 27 18.064 3.847 -3.471 1.00 0.00 C ATOM 361 CG LYS A 27 18.952 3.587 -4.675 1.00 0.00 C ATOM 362 CD LYS A 27 18.141 3.145 -5.881 1.00 0.00 C ATOM 363 CE LYS A 27 18.924 2.177 -6.755 1.00 0.00 C ATOM 364 NZ LYS A 27 19.732 2.888 -7.785 1.00 0.00 N ATOM 0 H LYS A 27 16.924 4.756 -1.313 1.00 0.00 H new ATOM 0 HA LYS A 27 19.711 4.416 -2.211 1.00 0.00 H new ATOM 0 HB2 LYS A 27 17.815 2.895 -3.002 1.00 0.00 H new ATOM 0 HB3 LYS A 27 17.128 4.290 -3.810 1.00 0.00 H new ATOM 0 HG2 LYS A 27 19.507 4.492 -4.921 1.00 0.00 H new ATOM 0 HG3 LYS A 27 19.686 2.820 -4.428 1.00 0.00 H new ATOM 0 HD2 LYS A 27 17.219 2.670 -5.546 1.00 0.00 H new ATOM 0 HD3 LYS A 27 17.855 4.018 -6.468 1.00 0.00 H new ATOM 0 HE2 LYS A 27 19.582 1.574 -6.129 1.00 0.00 H new ATOM 0 HE3 LYS A 27 18.234 1.491 -7.245 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 20.251 2.193 -8.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 19.102 3.443 -8.398 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 20.409 3.524 -7.317 1.00 0.00 H new ATOM 378 N GLY A 28 19.865 6.477 -3.692 1.00 0.00 N ATOM 379 CA GLY A 28 20.045 7.802 -4.258 1.00 0.00 C ATOM 380 C GLY A 28 19.637 8.902 -3.299 1.00 0.00 C ATOM 381 O GLY A 28 19.474 8.681 -2.099 1.00 0.00 O ATOM 0 H GLY A 28 20.616 5.818 -3.896 1.00 0.00 H new ATOM 0 HA2 GLY A 28 21.090 7.936 -4.536 1.00 0.00 H new ATOM 0 HA3 GLY A 28 19.458 7.886 -5.173 1.00 0.00 H new ATOM 385 N PRO A 29 19.467 10.122 -3.830 1.00 0.00 N ATOM 386 CA PRO A 29 19.074 11.286 -3.030 1.00 0.00 C ATOM 387 C PRO A 29 17.634 11.192 -2.538 1.00 0.00 C ATOM 388 O PRO A 29 17.363 11.349 -1.348 1.00 0.00 O ATOM 389 CB PRO A 29 19.231 12.456 -4.005 1.00 0.00 C ATOM 390 CG PRO A 29 19.075 11.847 -5.356 1.00 0.00 C ATOM 391 CD PRO A 29 19.644 10.459 -5.253 1.00 0.00 C ATOM 0 HA PRO A 29 19.677 11.382 -2.127 1.00 0.00 H new ATOM 0 HB2 PRO A 29 18.477 13.223 -3.827 1.00 0.00 H new ATOM 0 HB3 PRO A 29 20.205 12.934 -3.896 1.00 0.00 H new ATOM 0 HG2 PRO A 29 18.026 11.818 -5.652 1.00 0.00 H new ATOM 0 HG3 PRO A 29 19.603 12.430 -6.110 1.00 0.00 H new ATOM 0 HD2 PRO A 29 19.116 9.759 -5.900 1.00 0.00 H new ATOM 0 HD3 PRO A 29 20.694 10.433 -5.545 1.00 0.00 H new ATOM 399 N ASP A 30 16.714 10.935 -3.462 1.00 0.00 N ATOM 400 CA ASP A 30 15.301 10.819 -3.121 1.00 0.00 C ATOM 401 C ASP A 30 14.744 9.470 -3.566 1.00 0.00 C ATOM 402 O ASP A 30 13.532 9.302 -3.701 1.00 0.00 O ATOM 403 CB ASP A 30 14.503 11.952 -3.768 1.00 0.00 C ATOM 404 CG ASP A 30 15.114 12.418 -5.075 1.00 0.00 C ATOM 405 OD1 ASP A 30 16.213 13.009 -5.038 1.00 0.00 O ATOM 406 OD2 ASP A 30 14.493 12.191 -6.135 1.00 0.00 O ATOM 0 H ASP A 30 16.921 10.803 -4.452 1.00 0.00 H new ATOM 0 HA ASP A 30 15.207 10.892 -2.037 1.00 0.00 H new ATOM 0 HB2 ASP A 30 13.481 11.617 -3.947 1.00 0.00 H new ATOM 0 HB3 ASP A 30 14.446 12.793 -3.077 1.00 0.00 H new ATOM 411 N SER A 31 15.637 8.513 -3.794 1.00 0.00 N ATOM 412 CA SER A 31 15.236 7.180 -4.229 1.00 0.00 C ATOM 413 C SER A 31 15.058 6.249 -3.033 1.00 0.00 C ATOM 414 O SER A 31 15.703 6.419 -1.998 1.00 0.00 O ATOM 415 CB SER A 31 16.274 6.600 -5.191 1.00 0.00 C ATOM 416 OG SER A 31 16.732 7.585 -6.102 1.00 0.00 O ATOM 0 H SER A 31 16.644 8.636 -3.685 1.00 0.00 H new ATOM 0 HA SER A 31 14.280 7.266 -4.746 1.00 0.00 H new ATOM 0 HB2 SER A 31 17.117 6.203 -4.625 1.00 0.00 H new ATOM 0 HB3 SER A 31 15.839 5.766 -5.741 1.00 0.00 H new ATOM 0 HG SER A 31 17.396 7.190 -6.705 1.00 0.00 H new ATOM 422 N VAL A 32 14.179 5.264 -3.184 1.00 0.00 N ATOM 423 CA VAL A 32 13.916 4.304 -2.118 1.00 0.00 C ATOM 424 C VAL A 32 13.495 2.953 -2.686 1.00 0.00 C ATOM 425 O VAL A 32 12.387 2.802 -3.200 1.00 0.00 O ATOM 426 CB VAL A 32 12.818 4.812 -1.164 1.00 0.00 C ATOM 427 CG1 VAL A 32 12.566 3.802 -0.055 1.00 0.00 C ATOM 428 CG2 VAL A 32 13.200 6.166 -0.587 1.00 0.00 C ATOM 0 H VAL A 32 13.637 5.109 -4.034 1.00 0.00 H new ATOM 0 HA VAL A 32 14.846 4.187 -1.561 1.00 0.00 H new ATOM 0 HB VAL A 32 11.894 4.932 -1.730 1.00 0.00 H new ATOM 0 HG11 VAL A 32 11.788 4.178 0.609 1.00 0.00 H new ATOM 0 HG12 VAL A 32 12.246 2.856 -0.491 1.00 0.00 H new ATOM 0 HG13 VAL A 32 13.484 3.648 0.512 1.00 0.00 H new ATOM 0 HG21 VAL A 32 12.414 6.510 0.085 1.00 0.00 H new ATOM 0 HG22 VAL A 32 14.135 6.075 -0.034 1.00 0.00 H new ATOM 0 HG23 VAL A 32 13.325 6.884 -1.397 1.00 0.00 H new ATOM 438 N VAL A 33 14.387 1.973 -2.590 1.00 0.00 N ATOM 439 CA VAL A 33 14.109 0.633 -3.093 1.00 0.00 C ATOM 440 C VAL A 33 13.476 -0.238 -2.014 1.00 0.00 C ATOM 441 O VAL A 33 13.863 -0.179 -0.847 1.00 0.00 O ATOM 442 CB VAL A 33 15.389 -0.052 -3.606 1.00 0.00 C ATOM 443 CG1 VAL A 33 15.171 -1.550 -3.755 1.00 0.00 C ATOM 444 CG2 VAL A 33 15.832 0.565 -4.924 1.00 0.00 C ATOM 0 H VAL A 33 15.309 2.082 -2.168 1.00 0.00 H new ATOM 0 HA VAL A 33 13.410 0.745 -3.922 1.00 0.00 H new ATOM 0 HB VAL A 33 16.182 0.104 -2.874 1.00 0.00 H new ATOM 0 HG11 VAL A 33 16.087 -2.017 -4.119 1.00 0.00 H new ATOM 0 HG12 VAL A 33 14.905 -1.977 -2.788 1.00 0.00 H new ATOM 0 HG13 VAL A 33 14.365 -1.731 -4.465 1.00 0.00 H new ATOM 0 HG21 VAL A 33 16.738 0.069 -5.272 1.00 0.00 H new ATOM 0 HG22 VAL A 33 15.043 0.442 -5.666 1.00 0.00 H new ATOM 0 HG23 VAL A 33 16.033 1.627 -4.780 1.00 0.00 H new ATOM 454 N VAL A 34 12.500 -1.049 -2.412 1.00 0.00 N ATOM 455 CA VAL A 34 11.814 -1.935 -1.479 1.00 0.00 C ATOM 456 C VAL A 34 11.945 -3.392 -1.908 1.00 0.00 C ATOM 457 O VAL A 34 11.709 -3.732 -3.068 1.00 0.00 O ATOM 458 CB VAL A 34 10.321 -1.577 -1.360 1.00 0.00 C ATOM 459 CG1 VAL A 34 9.657 -2.412 -0.276 1.00 0.00 C ATOM 460 CG2 VAL A 34 10.150 -0.092 -1.082 1.00 0.00 C ATOM 0 H VAL A 34 12.167 -1.110 -3.374 1.00 0.00 H new ATOM 0 HA VAL A 34 12.290 -1.802 -0.507 1.00 0.00 H new ATOM 0 HB VAL A 34 9.834 -1.803 -2.308 1.00 0.00 H new ATOM 0 HG11 VAL A 34 8.602 -2.145 -0.206 1.00 0.00 H new ATOM 0 HG12 VAL A 34 9.748 -3.469 -0.524 1.00 0.00 H new ATOM 0 HG13 VAL A 34 10.144 -2.220 0.680 1.00 0.00 H new ATOM 0 HG21 VAL A 34 9.089 0.143 -1.001 1.00 0.00 H new ATOM 0 HG22 VAL A 34 10.651 0.163 -0.148 1.00 0.00 H new ATOM 0 HG23 VAL A 34 10.588 0.484 -1.897 1.00 0.00 H new ATOM 470 N HIS A 35 12.321 -4.250 -0.965 1.00 0.00 N ATOM 471 CA HIS A 35 12.482 -5.672 -1.246 1.00 0.00 C ATOM 472 C HIS A 35 11.441 -6.495 -0.492 1.00 0.00 C ATOM 473 O HIS A 35 11.520 -6.649 0.727 1.00 0.00 O ATOM 474 CB HIS A 35 13.888 -6.133 -0.863 1.00 0.00 C ATOM 475 CG HIS A 35 14.966 -5.541 -1.718 1.00 0.00 C ATOM 476 ND1 HIS A 35 16.221 -6.099 -1.841 1.00 0.00 N ATOM 477 CD2 HIS A 35 14.970 -4.434 -2.496 1.00 0.00 C ATOM 478 CE1 HIS A 35 16.951 -5.360 -2.657 1.00 0.00 C ATOM 479 NE2 HIS A 35 16.215 -4.343 -3.069 1.00 0.00 N ATOM 0 H HIS A 35 12.520 -3.985 -0.000 1.00 0.00 H new ATOM 0 HA HIS A 35 12.337 -5.825 -2.315 1.00 0.00 H new ATOM 0 HB2 HIS A 35 14.076 -5.871 0.178 1.00 0.00 H new ATOM 0 HB3 HIS A 35 13.937 -7.220 -0.932 1.00 0.00 H new ATOM 0 HD1 HIS A 35 16.536 -6.950 -1.375 1.00 0.00 H new ATOM 0 HD2 HIS A 35 14.147 -3.749 -2.640 1.00 0.00 H new ATOM 0 HE1 HIS A 35 17.975 -5.554 -2.939 1.00 0.00 H new ATOM 488 N VAL A 36 10.465 -7.021 -1.226 1.00 0.00 N ATOM 489 CA VAL A 36 9.409 -7.829 -0.627 1.00 0.00 C ATOM 490 C VAL A 36 9.738 -9.315 -0.713 1.00 0.00 C ATOM 491 O VAL A 36 10.072 -9.827 -1.782 1.00 0.00 O ATOM 492 CB VAL A 36 8.053 -7.575 -1.310 1.00 0.00 C ATOM 493 CG1 VAL A 36 6.930 -8.249 -0.537 1.00 0.00 C ATOM 494 CG2 VAL A 36 7.796 -6.081 -1.445 1.00 0.00 C ATOM 0 H VAL A 36 10.384 -6.902 -2.236 1.00 0.00 H new ATOM 0 HA VAL A 36 9.341 -7.535 0.420 1.00 0.00 H new ATOM 0 HB VAL A 36 8.084 -8.008 -2.310 1.00 0.00 H new ATOM 0 HG11 VAL A 36 5.980 -8.058 -1.035 1.00 0.00 H new ATOM 0 HG12 VAL A 36 7.109 -9.323 -0.497 1.00 0.00 H new ATOM 0 HG13 VAL A 36 6.895 -7.849 0.476 1.00 0.00 H new ATOM 0 HG21 VAL A 36 6.833 -5.920 -1.930 1.00 0.00 H new ATOM 0 HG22 VAL A 36 7.785 -5.623 -0.456 1.00 0.00 H new ATOM 0 HG23 VAL A 36 8.585 -5.629 -2.046 1.00 0.00 H new ATOM 504 N TYR A 37 9.642 -10.003 0.419 1.00 0.00 N ATOM 505 CA TYR A 37 9.931 -11.431 0.473 1.00 0.00 C ATOM 506 C TYR A 37 8.704 -12.250 0.085 1.00 0.00 C ATOM 507 O TYR A 37 7.743 -12.351 0.849 1.00 0.00 O ATOM 508 CB TYR A 37 10.399 -11.825 1.875 1.00 0.00 C ATOM 509 CG TYR A 37 11.767 -11.289 2.230 1.00 0.00 C ATOM 510 CD1 TYR A 37 12.387 -10.333 1.435 1.00 0.00 C ATOM 511 CD2 TYR A 37 12.440 -11.739 3.359 1.00 0.00 C ATOM 512 CE1 TYR A 37 13.638 -9.840 1.755 1.00 0.00 C ATOM 513 CE2 TYR A 37 13.690 -11.251 3.687 1.00 0.00 C ATOM 514 CZ TYR A 37 14.285 -10.302 2.882 1.00 0.00 C ATOM 515 OH TYR A 37 15.531 -9.815 3.205 1.00 0.00 O ATOM 0 H TYR A 37 9.366 -9.595 1.312 1.00 0.00 H new ATOM 0 HA TYR A 37 10.727 -11.642 -0.241 1.00 0.00 H new ATOM 0 HB2 TYR A 37 9.675 -11.463 2.605 1.00 0.00 H new ATOM 0 HB3 TYR A 37 10.413 -12.912 1.952 1.00 0.00 H new ATOM 0 HD1 TYR A 37 11.883 -9.969 0.552 1.00 0.00 H new ATOM 0 HD2 TYR A 37 11.978 -12.483 3.991 1.00 0.00 H new ATOM 0 HE1 TYR A 37 14.106 -9.097 1.126 1.00 0.00 H new ATOM 0 HE2 TYR A 37 14.199 -11.611 4.569 1.00 0.00 H new ATOM 0 HH TYR A 37 15.846 -10.243 4.028 1.00 0.00 H new ATOM 525 N VAL A 38 8.744 -12.835 -1.108 1.00 0.00 N ATOM 526 CA VAL A 38 7.637 -13.648 -1.599 1.00 0.00 C ATOM 527 C VAL A 38 7.986 -14.304 -2.930 1.00 0.00 C ATOM 528 O VAL A 38 8.797 -13.785 -3.697 1.00 0.00 O ATOM 529 CB VAL A 38 6.358 -12.808 -1.772 1.00 0.00 C ATOM 530 CG1 VAL A 38 6.560 -11.740 -2.836 1.00 0.00 C ATOM 531 CG2 VAL A 38 5.177 -13.702 -2.119 1.00 0.00 C ATOM 0 H VAL A 38 9.531 -12.761 -1.753 1.00 0.00 H new ATOM 0 HA VAL A 38 7.456 -14.422 -0.853 1.00 0.00 H new ATOM 0 HB VAL A 38 6.141 -12.309 -0.828 1.00 0.00 H new ATOM 0 HG11 VAL A 38 5.646 -11.157 -2.944 1.00 0.00 H new ATOM 0 HG12 VAL A 38 7.377 -11.082 -2.541 1.00 0.00 H new ATOM 0 HG13 VAL A 38 6.802 -12.215 -3.787 1.00 0.00 H new ATOM 0 HG21 VAL A 38 4.281 -13.092 -2.238 1.00 0.00 H new ATOM 0 HG22 VAL A 38 5.382 -14.231 -3.050 1.00 0.00 H new ATOM 0 HG23 VAL A 38 5.020 -14.425 -1.318 1.00 0.00 H new ATOM 541 N LYS A 39 7.366 -15.448 -3.199 1.00 0.00 N ATOM 542 CA LYS A 39 7.608 -16.176 -4.439 1.00 0.00 C ATOM 543 C LYS A 39 6.301 -16.696 -5.028 1.00 0.00 C ATOM 544 O LYS A 39 5.226 -16.464 -4.477 1.00 0.00 O ATOM 545 CB LYS A 39 8.567 -17.343 -4.190 1.00 0.00 C ATOM 546 CG LYS A 39 9.618 -17.052 -3.133 1.00 0.00 C ATOM 547 CD LYS A 39 10.596 -18.206 -2.987 1.00 0.00 C ATOM 548 CE LYS A 39 11.039 -18.736 -4.342 1.00 0.00 C ATOM 549 NZ LYS A 39 12.382 -19.375 -4.276 1.00 0.00 N ATOM 0 H LYS A 39 6.692 -15.891 -2.575 1.00 0.00 H new ATOM 0 HA LYS A 39 8.060 -15.488 -5.153 1.00 0.00 H new ATOM 0 HB2 LYS A 39 7.991 -18.217 -3.886 1.00 0.00 H new ATOM 0 HB3 LYS A 39 9.065 -17.599 -5.125 1.00 0.00 H new ATOM 0 HG2 LYS A 39 10.161 -16.145 -3.399 1.00 0.00 H new ATOM 0 HG3 LYS A 39 9.131 -16.863 -2.176 1.00 0.00 H new ATOM 0 HD2 LYS A 39 11.468 -17.876 -2.421 1.00 0.00 H new ATOM 0 HD3 LYS A 39 10.130 -19.009 -2.416 1.00 0.00 H new ATOM 0 HE2 LYS A 39 10.310 -19.460 -4.705 1.00 0.00 H new ATOM 0 HE3 LYS A 39 11.061 -17.918 -5.062 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 12.648 -19.723 -5.219 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 13.083 -18.677 -3.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 12.355 -20.172 -3.608 1.00 0.00 H new ATOM 563 N GLU A 40 6.402 -17.400 -6.152 1.00 0.00 N ATOM 564 CA GLU A 40 5.226 -17.952 -6.815 1.00 0.00 C ATOM 565 C GLU A 40 4.165 -16.876 -7.025 1.00 0.00 C ATOM 566 O GLU A 40 2.976 -17.113 -6.810 1.00 0.00 O ATOM 567 CB GLU A 40 4.644 -19.104 -5.993 1.00 0.00 C ATOM 568 CG GLU A 40 5.700 -19.994 -5.359 1.00 0.00 C ATOM 569 CD GLU A 40 6.305 -20.975 -6.345 1.00 0.00 C ATOM 570 OE1 GLU A 40 5.547 -21.789 -6.913 1.00 0.00 O ATOM 571 OE2 GLU A 40 7.536 -20.929 -6.547 1.00 0.00 O ATOM 0 H GLU A 40 7.285 -17.601 -6.622 1.00 0.00 H new ATOM 0 HA GLU A 40 5.534 -18.330 -7.790 1.00 0.00 H new ATOM 0 HB2 GLU A 40 4.008 -18.694 -5.209 1.00 0.00 H new ATOM 0 HB3 GLU A 40 4.007 -19.712 -6.635 1.00 0.00 H new ATOM 0 HG2 GLU A 40 6.491 -19.371 -4.940 1.00 0.00 H new ATOM 0 HG3 GLU A 40 5.255 -20.545 -4.530 1.00 0.00 H new ATOM 578 N ILE A 41 4.604 -15.695 -7.447 1.00 0.00 N ATOM 579 CA ILE A 41 3.692 -14.583 -7.687 1.00 0.00 C ATOM 580 C ILE A 41 3.311 -14.494 -9.161 1.00 0.00 C ATOM 581 O ILE A 41 4.110 -14.817 -10.040 1.00 0.00 O ATOM 582 CB ILE A 41 4.310 -13.243 -7.246 1.00 0.00 C ATOM 583 CG1 ILE A 41 4.159 -13.061 -5.734 1.00 0.00 C ATOM 584 CG2 ILE A 41 3.658 -12.089 -7.992 1.00 0.00 C ATOM 585 CD1 ILE A 41 4.242 -11.617 -5.289 1.00 0.00 C ATOM 0 H ILE A 41 5.585 -15.483 -7.630 1.00 0.00 H new ATOM 0 HA ILE A 41 2.798 -14.774 -7.094 1.00 0.00 H new ATOM 0 HB ILE A 41 5.373 -13.252 -7.488 1.00 0.00 H new ATOM 0 HG12 ILE A 41 3.201 -13.475 -5.420 1.00 0.00 H new ATOM 0 HG13 ILE A 41 4.936 -13.634 -5.228 1.00 0.00 H new ATOM 0 HG21 ILE A 41 4.105 -11.149 -7.670 1.00 0.00 H new ATOM 0 HG22 ILE A 41 3.812 -12.215 -9.064 1.00 0.00 H new ATOM 0 HG23 ILE A 41 2.589 -12.075 -7.778 1.00 0.00 H new ATOM 0 HD11 ILE A 41 4.127 -11.563 -4.206 1.00 0.00 H new ATOM 0 HD12 ILE A 41 5.210 -11.204 -5.572 1.00 0.00 H new ATOM 0 HD13 ILE A 41 3.449 -11.043 -5.767 1.00 0.00 H new ATOM 597 N CYS A 42 2.086 -14.052 -9.423 1.00 0.00 N ATOM 598 CA CYS A 42 1.598 -13.918 -10.792 1.00 0.00 C ATOM 599 C CYS A 42 1.707 -12.473 -11.269 1.00 0.00 C ATOM 600 O CYS A 42 0.900 -11.623 -10.892 1.00 0.00 O ATOM 601 CB CYS A 42 0.147 -14.391 -10.886 1.00 0.00 C ATOM 602 SG CYS A 42 -0.293 -15.106 -12.488 1.00 0.00 S ATOM 0 H CYS A 42 1.413 -13.780 -8.707 1.00 0.00 H new ATOM 0 HA CYS A 42 2.218 -14.542 -11.436 1.00 0.00 H new ATOM 0 HB2 CYS A 42 -0.034 -15.132 -10.107 1.00 0.00 H new ATOM 0 HB3 CYS A 42 -0.513 -13.548 -10.683 1.00 0.00 H new ATOM 0 HG CYS A 42 -1.538 -15.479 -12.470 1.00 0.00 H new ATOM 608 N ARG A 43 2.709 -12.203 -12.098 1.00 0.00 N ATOM 609 CA ARG A 43 2.925 -10.861 -12.624 1.00 0.00 C ATOM 610 C ARG A 43 1.760 -10.430 -13.510 1.00 0.00 C ATOM 611 O ARG A 43 1.635 -9.258 -13.863 1.00 0.00 O ATOM 612 CB ARG A 43 4.231 -10.805 -13.419 1.00 0.00 C ATOM 613 CG ARG A 43 5.439 -11.300 -12.640 1.00 0.00 C ATOM 614 CD ARG A 43 6.741 -10.877 -13.302 1.00 0.00 C ATOM 615 NE ARG A 43 6.818 -11.321 -14.692 1.00 0.00 N ATOM 616 CZ ARG A 43 7.934 -11.291 -15.412 1.00 0.00 C ATOM 617 NH1 ARG A 43 9.060 -10.841 -14.877 1.00 0.00 N ATOM 618 NH2 ARG A 43 7.924 -11.713 -16.670 1.00 0.00 N ATOM 0 H ARG A 43 3.385 -12.896 -12.420 1.00 0.00 H new ATOM 0 HA ARG A 43 2.991 -10.174 -11.780 1.00 0.00 H new ATOM 0 HB2 ARG A 43 4.122 -11.404 -14.323 1.00 0.00 H new ATOM 0 HB3 ARG A 43 4.410 -9.778 -13.736 1.00 0.00 H new ATOM 0 HG2 ARG A 43 5.403 -10.909 -11.623 1.00 0.00 H new ATOM 0 HG3 ARG A 43 5.404 -12.387 -12.565 1.00 0.00 H new ATOM 0 HD2 ARG A 43 6.832 -9.791 -13.263 1.00 0.00 H new ATOM 0 HD3 ARG A 43 7.582 -11.288 -12.743 1.00 0.00 H new ATOM 0 HE ARG A 43 5.969 -11.673 -15.134 1.00 0.00 H new ATOM 0 HH11 ARG A 43 9.071 -10.517 -13.910 1.00 0.00 H new ATOM 0 HH12 ARG A 43 9.915 -10.819 -15.432 1.00 0.00 H new ATOM 0 HH21 ARG A 43 7.059 -12.061 -17.084 1.00 0.00 H new ATOM 0 HH22 ARG A 43 8.781 -11.690 -17.223 1.00 0.00 H new ATOM 632 N ASP A 44 0.910 -11.387 -13.867 1.00 0.00 N ATOM 633 CA ASP A 44 -0.246 -11.107 -14.711 1.00 0.00 C ATOM 634 C ASP A 44 -1.398 -10.542 -13.886 1.00 0.00 C ATOM 635 O ASP A 44 -2.113 -9.643 -14.331 1.00 0.00 O ATOM 636 CB ASP A 44 -0.695 -12.378 -15.434 1.00 0.00 C ATOM 637 CG ASP A 44 0.045 -12.594 -16.739 1.00 0.00 C ATOM 638 OD1 ASP A 44 -0.225 -11.850 -17.706 1.00 0.00 O ATOM 639 OD2 ASP A 44 0.896 -13.507 -16.794 1.00 0.00 O ATOM 0 H ASP A 44 1.000 -12.363 -13.585 1.00 0.00 H new ATOM 0 HA ASP A 44 0.047 -10.361 -15.450 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -0.536 -13.238 -14.783 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -1.765 -12.321 -15.632 1.00 0.00 H new ATOM 644 N THR A 45 -1.573 -11.075 -12.681 1.00 0.00 N ATOM 645 CA THR A 45 -2.639 -10.626 -11.794 1.00 0.00 C ATOM 646 C THR A 45 -2.080 -9.827 -10.623 1.00 0.00 C ATOM 647 O THR A 45 -2.766 -9.608 -9.624 1.00 0.00 O ATOM 648 CB THR A 45 -3.454 -11.814 -11.248 1.00 0.00 C ATOM 649 OG1 THR A 45 -2.606 -12.680 -10.485 1.00 0.00 O ATOM 650 CG2 THR A 45 -4.097 -12.596 -12.383 1.00 0.00 C ATOM 0 H THR A 45 -0.990 -11.818 -12.297 1.00 0.00 H new ATOM 0 HA THR A 45 -3.294 -9.987 -12.386 1.00 0.00 H new ATOM 0 HB THR A 45 -4.243 -11.421 -10.606 1.00 0.00 H new ATOM 0 HG1 THR A 45 -3.157 -13.275 -9.934 1.00 0.00 H new ATOM 0 HG21 THR A 45 -4.667 -13.430 -11.973 1.00 0.00 H new ATOM 0 HG22 THR A 45 -4.764 -11.941 -12.944 1.00 0.00 H new ATOM 0 HG23 THR A 45 -3.321 -12.978 -13.047 1.00 0.00 H new ATOM 658 N SER A 46 -0.830 -9.392 -10.752 1.00 0.00 N ATOM 659 CA SER A 46 -0.178 -8.619 -9.702 1.00 0.00 C ATOM 660 C SER A 46 0.216 -7.235 -10.211 1.00 0.00 C ATOM 661 O SER A 46 1.024 -7.107 -11.130 1.00 0.00 O ATOM 662 CB SER A 46 1.060 -9.358 -9.190 1.00 0.00 C ATOM 663 OG SER A 46 0.715 -10.627 -8.664 1.00 0.00 O ATOM 0 H SER A 46 -0.249 -9.562 -11.573 1.00 0.00 H new ATOM 0 HA SER A 46 -0.885 -8.497 -8.882 1.00 0.00 H new ATOM 0 HB2 SER A 46 1.776 -9.480 -10.002 1.00 0.00 H new ATOM 0 HB3 SER A 46 1.550 -8.763 -8.420 1.00 0.00 H new ATOM 0 HG SER A 46 0.627 -11.272 -9.397 1.00 0.00 H new ATOM 669 N ARG A 47 -0.362 -6.203 -9.605 1.00 0.00 N ATOM 670 CA ARG A 47 -0.073 -4.828 -9.997 1.00 0.00 C ATOM 671 C ARG A 47 0.334 -3.993 -8.787 1.00 0.00 C ATOM 672 O ARG A 47 0.271 -4.457 -7.649 1.00 0.00 O ATOM 673 CB ARG A 47 -1.293 -4.202 -10.675 1.00 0.00 C ATOM 674 CG ARG A 47 -2.514 -4.116 -9.774 1.00 0.00 C ATOM 675 CD ARG A 47 -2.562 -2.793 -9.026 1.00 0.00 C ATOM 676 NE ARG A 47 -3.238 -1.753 -9.795 1.00 0.00 N ATOM 677 CZ ARG A 47 -4.559 -1.661 -9.905 1.00 0.00 C ATOM 678 NH1 ARG A 47 -5.341 -2.543 -9.297 1.00 0.00 N ATOM 679 NH2 ARG A 47 -5.101 -0.686 -10.623 1.00 0.00 N ATOM 0 H ARG A 47 -1.032 -6.292 -8.842 1.00 0.00 H new ATOM 0 HA ARG A 47 0.758 -4.844 -10.702 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -1.034 -3.200 -11.017 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -1.546 -4.786 -11.560 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -3.418 -4.230 -10.372 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -2.499 -4.939 -9.059 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -3.076 -2.933 -8.075 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -1.547 -2.471 -8.795 1.00 0.00 H new ATOM 0 HE ARG A 47 -2.665 -1.059 -10.274 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -4.929 -3.294 -8.743 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -6.355 -2.470 -9.383 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -4.503 -0.005 -11.092 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -6.115 -0.617 -10.706 1.00 0.00 H new ATOM 693 N VAL A 48 0.752 -2.757 -9.042 1.00 0.00 N ATOM 694 CA VAL A 48 1.170 -1.856 -7.974 1.00 0.00 C ATOM 695 C VAL A 48 0.684 -0.434 -8.234 1.00 0.00 C ATOM 696 O VAL A 48 1.043 0.183 -9.238 1.00 0.00 O ATOM 697 CB VAL A 48 2.702 -1.842 -7.818 1.00 0.00 C ATOM 698 CG1 VAL A 48 3.112 -0.960 -6.648 1.00 0.00 C ATOM 699 CG2 VAL A 48 3.231 -3.257 -7.640 1.00 0.00 C ATOM 0 H VAL A 48 0.810 -2.357 -9.978 1.00 0.00 H new ATOM 0 HA VAL A 48 0.722 -2.228 -7.053 1.00 0.00 H new ATOM 0 HB VAL A 48 3.139 -1.426 -8.726 1.00 0.00 H new ATOM 0 HG11 VAL A 48 4.198 -0.963 -6.553 1.00 0.00 H new ATOM 0 HG12 VAL A 48 2.765 0.059 -6.821 1.00 0.00 H new ATOM 0 HG13 VAL A 48 2.667 -1.343 -5.730 1.00 0.00 H new ATOM 0 HG21 VAL A 48 4.315 -3.229 -7.531 1.00 0.00 H new ATOM 0 HG22 VAL A 48 2.788 -3.702 -6.749 1.00 0.00 H new ATOM 0 HG23 VAL A 48 2.969 -3.856 -8.512 1.00 0.00 H new ATOM 709 N LEU A 49 -0.134 0.081 -7.323 1.00 0.00 N ATOM 710 CA LEU A 49 -0.670 1.432 -7.452 1.00 0.00 C ATOM 711 C LEU A 49 0.157 2.425 -6.642 1.00 0.00 C ATOM 712 O LEU A 49 0.192 2.363 -5.413 1.00 0.00 O ATOM 713 CB LEU A 49 -2.128 1.470 -6.992 1.00 0.00 C ATOM 714 CG LEU A 49 -3.121 0.675 -7.841 1.00 0.00 C ATOM 715 CD1 LEU A 49 -4.480 0.620 -7.162 1.00 0.00 C ATOM 716 CD2 LEU A 49 -3.241 1.284 -9.231 1.00 0.00 C ATOM 0 H LEU A 49 -0.441 -0.416 -6.487 1.00 0.00 H new ATOM 0 HA LEU A 49 -0.620 1.717 -8.503 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -2.175 1.097 -5.969 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -2.453 2.510 -6.967 1.00 0.00 H new ATOM 0 HG LEU A 49 -2.748 -0.344 -7.943 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -5.173 0.050 -7.781 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -4.382 0.138 -6.189 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -4.861 1.632 -7.028 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -3.952 0.706 -9.821 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -3.591 2.313 -9.148 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -2.267 1.270 -9.720 1.00 0.00 H new ATOM 728 N PHE A 50 0.819 3.343 -7.338 1.00 0.00 N ATOM 729 CA PHE A 50 1.645 4.351 -6.684 1.00 0.00 C ATOM 730 C PHE A 50 0.851 5.633 -6.446 1.00 0.00 C ATOM 731 O PHE A 50 0.526 6.358 -7.386 1.00 0.00 O ATOM 732 CB PHE A 50 2.883 4.654 -7.529 1.00 0.00 C ATOM 733 CG PHE A 50 3.847 3.506 -7.613 1.00 0.00 C ATOM 734 CD1 PHE A 50 4.390 2.953 -6.464 1.00 0.00 C ATOM 735 CD2 PHE A 50 4.211 2.978 -8.842 1.00 0.00 C ATOM 736 CE1 PHE A 50 5.278 1.897 -6.539 1.00 0.00 C ATOM 737 CE2 PHE A 50 5.098 1.921 -8.923 1.00 0.00 C ATOM 738 CZ PHE A 50 5.632 1.379 -7.769 1.00 0.00 C ATOM 0 H PHE A 50 0.800 3.410 -8.356 1.00 0.00 H new ATOM 0 HA PHE A 50 1.961 3.955 -5.719 1.00 0.00 H new ATOM 0 HB2 PHE A 50 2.568 4.928 -8.536 1.00 0.00 H new ATOM 0 HB3 PHE A 50 3.396 5.519 -7.110 1.00 0.00 H new ATOM 0 HD1 PHE A 50 4.116 3.352 -5.499 1.00 0.00 H new ATOM 0 HD2 PHE A 50 3.797 3.397 -9.747 1.00 0.00 H new ATOM 0 HE1 PHE A 50 5.695 1.477 -5.636 1.00 0.00 H new ATOM 0 HE2 PHE A 50 5.373 1.519 -9.887 1.00 0.00 H new ATOM 0 HZ PHE A 50 6.324 0.552 -7.829 1.00 0.00 H new ATOM 748 N ARG A 51 0.543 5.904 -5.182 1.00 0.00 N ATOM 749 CA ARG A 51 -0.214 7.097 -4.820 1.00 0.00 C ATOM 750 C ARG A 51 0.723 8.260 -4.504 1.00 0.00 C ATOM 751 O ARG A 51 1.942 8.133 -4.609 1.00 0.00 O ATOM 752 CB ARG A 51 -1.112 6.810 -3.615 1.00 0.00 C ATOM 753 CG ARG A 51 -2.496 6.306 -3.994 1.00 0.00 C ATOM 754 CD ARG A 51 -3.339 7.408 -4.615 1.00 0.00 C ATOM 755 NE ARG A 51 -3.683 8.446 -3.647 1.00 0.00 N ATOM 756 CZ ARG A 51 -4.388 9.530 -3.951 1.00 0.00 C ATOM 757 NH1 ARG A 51 -4.822 9.717 -5.190 1.00 0.00 N ATOM 758 NH2 ARG A 51 -4.661 10.430 -3.015 1.00 0.00 N ATOM 0 H ARG A 51 0.805 5.315 -4.392 1.00 0.00 H new ATOM 0 HA ARG A 51 -0.836 7.375 -5.671 1.00 0.00 H new ATOM 0 HB2 ARG A 51 -0.627 6.070 -2.979 1.00 0.00 H new ATOM 0 HB3 ARG A 51 -1.215 7.720 -3.024 1.00 0.00 H new ATOM 0 HG2 ARG A 51 -2.403 5.478 -4.697 1.00 0.00 H new ATOM 0 HG3 ARG A 51 -2.998 5.918 -3.108 1.00 0.00 H new ATOM 0 HD2 ARG A 51 -2.795 7.855 -5.447 1.00 0.00 H new ATOM 0 HD3 ARG A 51 -4.253 6.978 -5.025 1.00 0.00 H new ATOM 0 HE ARG A 51 -3.364 8.332 -2.685 1.00 0.00 H new ATOM 0 HH11 ARG A 51 -4.615 9.027 -5.913 1.00 0.00 H new ATOM 0 HH12 ARG A 51 -5.363 10.550 -5.421 1.00 0.00 H new ATOM 0 HH21 ARG A 51 -4.329 10.290 -2.061 1.00 0.00 H new ATOM 0 HH22 ARG A 51 -5.202 11.262 -3.250 1.00 0.00 H new ATOM 772 N GLU A 52 0.143 9.392 -4.117 1.00 0.00 N ATOM 773 CA GLU A 52 0.926 10.577 -3.788 1.00 0.00 C ATOM 774 C GLU A 52 1.452 10.501 -2.357 1.00 0.00 C ATOM 775 O GLU A 52 2.603 10.845 -2.090 1.00 0.00 O ATOM 776 CB GLU A 52 0.081 11.840 -3.966 1.00 0.00 C ATOM 777 CG GLU A 52 -1.035 11.974 -2.943 1.00 0.00 C ATOM 778 CD GLU A 52 -1.931 13.168 -3.211 1.00 0.00 C ATOM 779 OE1 GLU A 52 -2.895 13.025 -3.992 1.00 0.00 O ATOM 780 OE2 GLU A 52 -1.668 14.247 -2.639 1.00 0.00 O ATOM 0 H GLU A 52 -0.865 9.513 -4.024 1.00 0.00 H new ATOM 0 HA GLU A 52 1.777 10.619 -4.468 1.00 0.00 H new ATOM 0 HB2 GLU A 52 0.730 12.713 -3.900 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -0.352 11.839 -4.966 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -1.637 11.065 -2.946 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -0.601 12.066 -1.947 1.00 0.00 H new ATOM 787 N GLN A 53 0.599 10.049 -1.443 1.00 0.00 N ATOM 788 CA GLN A 53 0.977 9.929 -0.040 1.00 0.00 C ATOM 789 C GLN A 53 0.920 8.476 0.417 1.00 0.00 C ATOM 790 O GLN A 53 0.810 8.194 1.611 1.00 0.00 O ATOM 791 CB GLN A 53 0.059 10.787 0.833 1.00 0.00 C ATOM 792 CG GLN A 53 0.613 11.050 2.224 1.00 0.00 C ATOM 793 CD GLN A 53 -0.477 11.261 3.256 1.00 0.00 C ATOM 794 OE1 GLN A 53 -1.120 12.311 3.290 1.00 0.00 O ATOM 795 NE2 GLN A 53 -0.691 10.263 4.104 1.00 0.00 N ATOM 0 H GLN A 53 -0.357 9.760 -1.649 1.00 0.00 H new ATOM 0 HA GLN A 53 2.002 10.284 0.065 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -0.116 11.740 0.334 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -0.908 10.293 0.924 1.00 0.00 H new ATOM 0 HG2 GLN A 53 1.237 10.209 2.527 1.00 0.00 H new ATOM 0 HG3 GLN A 53 1.256 11.930 2.195 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -0.134 9.411 4.039 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -1.412 10.348 4.820 1.00 0.00 H new ATOM 804 N ASP A 54 0.996 7.557 -0.539 1.00 0.00 N ATOM 805 CA ASP A 54 0.953 6.131 -0.234 1.00 0.00 C ATOM 806 C ASP A 54 1.256 5.301 -1.478 1.00 0.00 C ATOM 807 O ASP A 54 1.497 5.844 -2.556 1.00 0.00 O ATOM 808 CB ASP A 54 -0.417 5.749 0.328 1.00 0.00 C ATOM 809 CG ASP A 54 -1.548 6.504 -0.340 1.00 0.00 C ATOM 810 OD1 ASP A 54 -1.587 7.746 -0.215 1.00 0.00 O ATOM 811 OD2 ASP A 54 -2.396 5.854 -0.987 1.00 0.00 O ATOM 0 H ASP A 54 1.088 7.773 -1.532 1.00 0.00 H new ATOM 0 HA ASP A 54 1.716 5.921 0.516 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -0.573 4.678 0.199 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -0.435 5.947 1.400 1.00 0.00 H new ATOM 816 N PHE A 55 1.243 3.981 -1.319 1.00 0.00 N ATOM 817 CA PHE A 55 1.518 3.075 -2.429 1.00 0.00 C ATOM 818 C PHE A 55 0.969 1.681 -2.141 1.00 0.00 C ATOM 819 O PHE A 55 1.424 0.998 -1.223 1.00 0.00 O ATOM 820 CB PHE A 55 3.024 2.999 -2.690 1.00 0.00 C ATOM 821 CG PHE A 55 3.738 2.024 -1.799 1.00 0.00 C ATOM 822 CD1 PHE A 55 3.823 0.684 -2.142 1.00 0.00 C ATOM 823 CD2 PHE A 55 4.325 2.447 -0.617 1.00 0.00 C ATOM 824 CE1 PHE A 55 4.480 -0.216 -1.324 1.00 0.00 C ATOM 825 CE2 PHE A 55 4.984 1.552 0.204 1.00 0.00 C ATOM 826 CZ PHE A 55 5.060 0.219 -0.149 1.00 0.00 C ATOM 0 H PHE A 55 1.045 3.515 -0.433 1.00 0.00 H new ATOM 0 HA PHE A 55 1.021 3.465 -3.317 1.00 0.00 H new ATOM 0 HB2 PHE A 55 3.191 2.718 -3.730 1.00 0.00 H new ATOM 0 HB3 PHE A 55 3.459 3.989 -2.554 1.00 0.00 H new ATOM 0 HD1 PHE A 55 3.370 0.339 -3.060 1.00 0.00 H new ATOM 0 HD2 PHE A 55 4.267 3.488 -0.334 1.00 0.00 H new ATOM 0 HE1 PHE A 55 4.540 -1.258 -1.603 1.00 0.00 H new ATOM 0 HE2 PHE A 55 5.439 1.895 1.121 1.00 0.00 H new ATOM 0 HZ PHE A 55 5.572 -0.482 0.493 1.00 0.00 H new ATOM 836 N THR A 56 -0.014 1.264 -2.933 1.00 0.00 N ATOM 837 CA THR A 56 -0.628 -0.047 -2.764 1.00 0.00 C ATOM 838 C THR A 56 0.035 -1.084 -3.663 1.00 0.00 C ATOM 839 O THR A 56 0.434 -0.782 -4.788 1.00 0.00 O ATOM 840 CB THR A 56 -2.136 -0.005 -3.074 1.00 0.00 C ATOM 841 OG1 THR A 56 -2.664 1.290 -2.765 1.00 0.00 O ATOM 842 CG2 THR A 56 -2.882 -1.065 -2.277 1.00 0.00 C ATOM 0 H THR A 56 -0.402 1.816 -3.698 1.00 0.00 H new ATOM 0 HA THR A 56 -0.487 -0.330 -1.721 1.00 0.00 H new ATOM 0 HB THR A 56 -2.272 -0.209 -4.136 1.00 0.00 H new ATOM 0 HG1 THR A 56 -3.623 1.309 -2.967 1.00 0.00 H new ATOM 0 HG21 THR A 56 -3.945 -1.016 -2.512 1.00 0.00 H new ATOM 0 HG22 THR A 56 -2.498 -2.052 -2.535 1.00 0.00 H new ATOM 0 HG23 THR A 56 -2.738 -0.887 -1.211 1.00 0.00 H new ATOM 850 N LEU A 57 0.150 -2.308 -3.160 1.00 0.00 N ATOM 851 CA LEU A 57 0.764 -3.392 -3.919 1.00 0.00 C ATOM 852 C LEU A 57 -0.143 -4.618 -3.951 1.00 0.00 C ATOM 853 O LEU A 57 -0.290 -5.320 -2.950 1.00 0.00 O ATOM 854 CB LEU A 57 2.119 -3.762 -3.311 1.00 0.00 C ATOM 855 CG LEU A 57 2.617 -5.180 -3.596 1.00 0.00 C ATOM 856 CD1 LEU A 57 2.785 -5.396 -5.092 1.00 0.00 C ATOM 857 CD2 LEU A 57 3.927 -5.440 -2.867 1.00 0.00 C ATOM 0 H LEU A 57 -0.174 -2.575 -2.230 1.00 0.00 H new ATOM 0 HA LEU A 57 0.913 -3.047 -4.942 1.00 0.00 H new ATOM 0 HB2 LEU A 57 2.864 -3.056 -3.677 1.00 0.00 H new ATOM 0 HB3 LEU A 57 2.059 -3.630 -2.231 1.00 0.00 H new ATOM 0 HG LEU A 57 1.873 -5.887 -3.229 1.00 0.00 H new ATOM 0 HD11 LEU A 57 3.140 -6.410 -5.276 1.00 0.00 H new ATOM 0 HD12 LEU A 57 1.827 -5.251 -5.590 1.00 0.00 H new ATOM 0 HD13 LEU A 57 3.509 -4.682 -5.484 1.00 0.00 H new ATOM 0 HD21 LEU A 57 4.267 -6.453 -3.081 1.00 0.00 H new ATOM 0 HD22 LEU A 57 4.679 -4.726 -3.204 1.00 0.00 H new ATOM 0 HD23 LEU A 57 3.775 -5.327 -1.794 1.00 0.00 H new ATOM 869 N ILE A 58 -0.748 -4.870 -5.107 1.00 0.00 N ATOM 870 CA ILE A 58 -1.638 -6.012 -5.270 1.00 0.00 C ATOM 871 C ILE A 58 -0.966 -7.124 -6.069 1.00 0.00 C ATOM 872 O ILE A 58 -0.601 -6.935 -7.229 1.00 0.00 O ATOM 873 CB ILE A 58 -2.948 -5.610 -5.973 1.00 0.00 C ATOM 874 CG1 ILE A 58 -3.745 -4.639 -5.098 1.00 0.00 C ATOM 875 CG2 ILE A 58 -3.777 -6.844 -6.295 1.00 0.00 C ATOM 876 CD1 ILE A 58 -3.181 -3.236 -5.085 1.00 0.00 C ATOM 0 H ILE A 58 -0.638 -4.298 -5.944 1.00 0.00 H new ATOM 0 HA ILE A 58 -1.869 -6.376 -4.269 1.00 0.00 H new ATOM 0 HB ILE A 58 -2.702 -5.108 -6.909 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -4.775 -4.605 -5.453 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -3.772 -5.021 -4.077 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -4.700 -6.543 -6.792 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -3.209 -7.502 -6.952 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -4.017 -7.372 -5.372 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -3.796 -2.603 -4.445 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -2.161 -3.258 -4.702 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -3.180 -2.835 -6.099 1.00 0.00 H new ATOM 888 N PHE A 59 -0.808 -8.284 -5.440 1.00 0.00 N ATOM 889 CA PHE A 59 -0.180 -9.427 -6.093 1.00 0.00 C ATOM 890 C PHE A 59 -0.702 -10.738 -5.512 1.00 0.00 C ATOM 891 O PHE A 59 -0.987 -10.830 -4.319 1.00 0.00 O ATOM 892 CB PHE A 59 1.341 -9.357 -5.939 1.00 0.00 C ATOM 893 CG PHE A 59 1.815 -9.629 -4.540 1.00 0.00 C ATOM 894 CD1 PHE A 59 1.676 -10.889 -3.980 1.00 0.00 C ATOM 895 CD2 PHE A 59 2.400 -8.625 -3.786 1.00 0.00 C ATOM 896 CE1 PHE A 59 2.111 -11.142 -2.693 1.00 0.00 C ATOM 897 CE2 PHE A 59 2.837 -8.872 -2.498 1.00 0.00 C ATOM 898 CZ PHE A 59 2.694 -10.132 -1.951 1.00 0.00 C ATOM 0 H PHE A 59 -1.106 -8.457 -4.480 1.00 0.00 H new ATOM 0 HA PHE A 59 -0.432 -9.393 -7.153 1.00 0.00 H new ATOM 0 HB2 PHE A 59 1.800 -10.077 -6.616 1.00 0.00 H new ATOM 0 HB3 PHE A 59 1.684 -8.369 -6.245 1.00 0.00 H new ATOM 0 HD1 PHE A 59 1.223 -11.682 -4.556 1.00 0.00 H new ATOM 0 HD2 PHE A 59 2.516 -7.638 -4.209 1.00 0.00 H new ATOM 0 HE1 PHE A 59 1.996 -12.128 -2.267 1.00 0.00 H new ATOM 0 HE2 PHE A 59 3.290 -8.080 -1.920 1.00 0.00 H new ATOM 0 HZ PHE A 59 3.037 -10.328 -0.946 1.00 0.00 H new ATOM 908 N GLN A 60 -0.824 -11.749 -6.366 1.00 0.00 N ATOM 909 CA GLN A 60 -1.312 -13.055 -5.938 1.00 0.00 C ATOM 910 C GLN A 60 -0.165 -14.054 -5.823 1.00 0.00 C ATOM 911 O GLN A 60 0.383 -14.505 -6.829 1.00 0.00 O ATOM 912 CB GLN A 60 -2.362 -13.577 -6.921 1.00 0.00 C ATOM 913 CG GLN A 60 -3.764 -13.058 -6.646 1.00 0.00 C ATOM 914 CD GLN A 60 -4.736 -13.381 -7.763 1.00 0.00 C ATOM 915 OE1 GLN A 60 -4.545 -14.343 -8.509 1.00 0.00 O ATOM 916 NE2 GLN A 60 -5.786 -12.578 -7.886 1.00 0.00 N ATOM 0 H GLN A 60 -0.592 -11.689 -7.357 1.00 0.00 H new ATOM 0 HA GLN A 60 -1.769 -12.940 -4.955 1.00 0.00 H new ATOM 0 HB2 GLN A 60 -2.072 -13.296 -7.933 1.00 0.00 H new ATOM 0 HB3 GLN A 60 -2.373 -14.666 -6.884 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -4.131 -13.489 -5.715 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -3.726 -11.978 -6.504 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -5.905 -11.793 -7.246 1.00 0.00 H new ATOM 0 HE22 GLN A 60 -6.474 -12.746 -8.620 1.00 0.00 H new ATOM 925 N THR A 61 0.193 -14.396 -4.589 1.00 0.00 N ATOM 926 CA THR A 61 1.275 -15.340 -4.342 1.00 0.00 C ATOM 927 C THR A 61 0.735 -16.745 -4.098 1.00 0.00 C ATOM 928 O THR A 61 -0.315 -16.917 -3.479 1.00 0.00 O ATOM 929 CB THR A 61 2.128 -14.913 -3.132 1.00 0.00 C ATOM 930 OG1 THR A 61 3.217 -15.825 -2.954 1.00 0.00 O ATOM 931 CG2 THR A 61 1.286 -14.869 -1.866 1.00 0.00 C ATOM 0 H THR A 61 -0.251 -14.033 -3.745 1.00 0.00 H new ATOM 0 HA THR A 61 1.900 -15.344 -5.235 1.00 0.00 H new ATOM 0 HB THR A 61 2.519 -13.914 -3.325 1.00 0.00 H new ATOM 0 HG1 THR A 61 3.650 -15.990 -3.818 1.00 0.00 H new ATOM 0 HG21 THR A 61 1.909 -14.565 -1.025 1.00 0.00 H new ATOM 0 HG22 THR A 61 0.474 -14.153 -1.994 1.00 0.00 H new ATOM 0 HG23 THR A 61 0.870 -15.858 -1.671 1.00 0.00 H new ATOM 939 N ARG A 62 1.459 -17.746 -4.588 1.00 0.00 N ATOM 940 CA ARG A 62 1.051 -19.136 -4.423 1.00 0.00 C ATOM 941 C ARG A 62 2.086 -19.914 -3.615 1.00 0.00 C ATOM 942 O ARG A 62 2.037 -21.142 -3.545 1.00 0.00 O ATOM 943 CB ARG A 62 0.852 -19.796 -5.789 1.00 0.00 C ATOM 944 CG ARG A 62 0.079 -18.936 -6.774 1.00 0.00 C ATOM 945 CD ARG A 62 0.122 -19.521 -8.178 1.00 0.00 C ATOM 946 NE ARG A 62 1.452 -19.417 -8.772 1.00 0.00 N ATOM 947 CZ ARG A 62 1.674 -19.422 -10.082 1.00 0.00 C ATOM 948 NH1 ARG A 62 0.659 -19.525 -10.929 1.00 0.00 N ATOM 949 NH2 ARG A 62 2.913 -19.324 -10.547 1.00 0.00 N ATOM 0 H ARG A 62 2.331 -17.620 -5.102 1.00 0.00 H new ATOM 0 HA ARG A 62 0.106 -19.150 -3.879 1.00 0.00 H new ATOM 0 HB2 ARG A 62 1.827 -20.033 -6.214 1.00 0.00 H new ATOM 0 HB3 ARG A 62 0.325 -20.741 -5.653 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -0.957 -18.848 -6.447 1.00 0.00 H new ATOM 0 HG3 ARG A 62 0.496 -17.929 -6.785 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -0.179 -20.568 -8.144 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -0.599 -19.002 -8.810 1.00 0.00 H new ATOM 0 HE ARG A 62 2.254 -19.336 -8.147 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -0.295 -19.601 -10.575 1.00 0.00 H new ATOM 0 HH12 ARG A 62 0.832 -19.529 -11.934 1.00 0.00 H new ATOM 0 HH21 ARG A 62 3.696 -19.245 -9.899 1.00 0.00 H new ATOM 0 HH22 ARG A 62 3.082 -19.328 -11.553 1.00 0.00 H new ATOM 963 N ASP A 63 3.021 -19.191 -3.009 1.00 0.00 N ATOM 964 CA ASP A 63 4.067 -19.813 -2.206 1.00 0.00 C ATOM 965 C ASP A 63 3.523 -20.253 -0.851 1.00 0.00 C ATOM 966 O ASP A 63 2.994 -19.443 -0.090 1.00 0.00 O ATOM 967 CB ASP A 63 5.234 -18.843 -2.011 1.00 0.00 C ATOM 968 CG ASP A 63 6.547 -19.560 -1.763 1.00 0.00 C ATOM 969 OD1 ASP A 63 6.870 -20.488 -2.534 1.00 0.00 O ATOM 970 OD2 ASP A 63 7.251 -19.194 -0.799 1.00 0.00 O ATOM 0 H ASP A 63 3.076 -18.174 -3.059 1.00 0.00 H new ATOM 0 HA ASP A 63 4.423 -20.695 -2.738 1.00 0.00 H new ATOM 0 HB2 ASP A 63 5.329 -18.211 -2.894 1.00 0.00 H new ATOM 0 HB3 ASP A 63 5.018 -18.184 -1.170 1.00 0.00 H new ATOM 975 N GLY A 64 3.655 -21.543 -0.556 1.00 0.00 N ATOM 976 CA GLY A 64 3.171 -22.068 0.707 1.00 0.00 C ATOM 977 C GLY A 64 3.772 -21.354 1.901 1.00 0.00 C ATOM 978 O GLY A 64 3.162 -21.293 2.968 1.00 0.00 O ATOM 0 H GLY A 64 4.088 -22.233 -1.169 1.00 0.00 H new ATOM 0 HA2 GLY A 64 2.085 -21.977 0.742 1.00 0.00 H new ATOM 0 HA3 GLY A 64 3.404 -23.131 0.768 1.00 0.00 H new ATOM 982 N ASN A 65 4.973 -20.814 1.723 1.00 0.00 N ATOM 983 CA ASN A 65 5.658 -20.102 2.796 1.00 0.00 C ATOM 984 C ASN A 65 4.956 -18.784 3.110 1.00 0.00 C ATOM 985 O ASN A 65 4.915 -18.349 4.261 1.00 0.00 O ATOM 986 CB ASN A 65 7.115 -19.837 2.411 1.00 0.00 C ATOM 987 CG ASN A 65 7.847 -21.104 2.012 1.00 0.00 C ATOM 988 OD1 ASN A 65 7.298 -22.203 2.091 1.00 0.00 O ATOM 989 ND2 ASN A 65 9.095 -20.956 1.582 1.00 0.00 N ATOM 0 H ASN A 65 5.492 -20.856 0.846 1.00 0.00 H new ATOM 0 HA ASN A 65 5.632 -20.728 3.688 1.00 0.00 H new ATOM 0 HB2 ASN A 65 7.146 -19.127 1.585 1.00 0.00 H new ATOM 0 HB3 ASN A 65 7.631 -19.372 3.251 1.00 0.00 H new ATOM 0 HD21 ASN A 65 9.638 -21.773 1.301 1.00 0.00 H new ATOM 0 HD22 ASN A 65 9.510 -20.026 1.533 1.00 0.00 H new ATOM 996 N PHE A 66 4.404 -18.154 2.078 1.00 0.00 N ATOM 997 CA PHE A 66 3.703 -16.886 2.243 1.00 0.00 C ATOM 998 C PHE A 66 2.218 -17.115 2.510 1.00 0.00 C ATOM 999 O PHE A 66 1.572 -16.329 3.203 1.00 0.00 O ATOM 1000 CB PHE A 66 3.881 -16.015 0.998 1.00 0.00 C ATOM 1001 CG PHE A 66 3.325 -14.628 1.152 1.00 0.00 C ATOM 1002 CD1 PHE A 66 1.957 -14.421 1.235 1.00 0.00 C ATOM 1003 CD2 PHE A 66 4.169 -13.532 1.214 1.00 0.00 C ATOM 1004 CE1 PHE A 66 1.443 -13.146 1.376 1.00 0.00 C ATOM 1005 CE2 PHE A 66 3.661 -12.254 1.356 1.00 0.00 C ATOM 1006 CZ PHE A 66 2.296 -12.062 1.438 1.00 0.00 C ATOM 0 H PHE A 66 4.429 -18.501 1.119 1.00 0.00 H new ATOM 0 HA PHE A 66 4.133 -16.371 3.102 1.00 0.00 H new ATOM 0 HB2 PHE A 66 4.943 -15.948 0.760 1.00 0.00 H new ATOM 0 HB3 PHE A 66 3.395 -16.501 0.152 1.00 0.00 H new ATOM 0 HD1 PHE A 66 1.285 -15.265 1.189 1.00 0.00 H new ATOM 0 HD2 PHE A 66 5.237 -13.677 1.151 1.00 0.00 H new ATOM 0 HE1 PHE A 66 0.375 -12.998 1.438 1.00 0.00 H new ATOM 0 HE2 PHE A 66 4.330 -11.408 1.403 1.00 0.00 H new ATOM 0 HZ PHE A 66 1.896 -11.065 1.550 1.00 0.00 H new ATOM 1016 N LEU A 67 1.684 -18.197 1.954 1.00 0.00 N ATOM 1017 CA LEU A 67 0.275 -18.532 2.130 1.00 0.00 C ATOM 1018 C LEU A 67 0.014 -19.064 3.536 1.00 0.00 C ATOM 1019 O LEU A 67 -0.879 -18.585 4.235 1.00 0.00 O ATOM 1020 CB LEU A 67 -0.157 -19.568 1.091 1.00 0.00 C ATOM 1021 CG LEU A 67 -0.405 -19.039 -0.322 1.00 0.00 C ATOM 1022 CD1 LEU A 67 -0.938 -20.144 -1.220 1.00 0.00 C ATOM 1023 CD2 LEU A 67 -1.371 -17.863 -0.289 1.00 0.00 C ATOM 0 H LEU A 67 2.205 -18.857 1.377 1.00 0.00 H new ATOM 0 HA LEU A 67 -0.310 -17.623 1.991 1.00 0.00 H new ATOM 0 HB2 LEU A 67 0.609 -20.342 1.038 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -1.070 -20.047 1.443 1.00 0.00 H new ATOM 0 HG LEU A 67 0.544 -18.693 -0.732 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -1.108 -19.749 -2.221 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -0.212 -20.955 -1.269 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -1.877 -20.521 -0.814 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -1.536 -17.499 -1.303 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -2.320 -18.184 0.140 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -0.949 -17.063 0.319 1.00 0.00 H new ATOM 1035 N ARG A 68 0.799 -20.055 3.943 1.00 0.00 N ATOM 1036 CA ARG A 68 0.653 -20.652 5.265 1.00 0.00 C ATOM 1037 C ARG A 68 0.451 -19.576 6.328 1.00 0.00 C ATOM 1038 O ARG A 68 -0.310 -19.761 7.278 1.00 0.00 O ATOM 1039 CB ARG A 68 1.883 -21.496 5.606 1.00 0.00 C ATOM 1040 CG ARG A 68 3.099 -20.671 5.996 1.00 0.00 C ATOM 1041 CD ARG A 68 4.374 -21.497 5.940 1.00 0.00 C ATOM 1042 NE ARG A 68 5.548 -20.718 6.323 1.00 0.00 N ATOM 1043 CZ ARG A 68 5.909 -20.503 7.584 1.00 0.00 C ATOM 1044 NH1 ARG A 68 5.189 -21.007 8.577 1.00 0.00 N ATOM 1045 NH2 ARG A 68 6.990 -19.784 7.852 1.00 0.00 N ATOM 0 H ARG A 68 1.543 -20.462 3.376 1.00 0.00 H new ATOM 0 HA ARG A 68 -0.227 -21.294 5.251 1.00 0.00 H new ATOM 0 HB2 ARG A 68 1.634 -22.171 6.425 1.00 0.00 H new ATOM 0 HB3 ARG A 68 2.136 -22.117 4.747 1.00 0.00 H new ATOM 0 HG2 ARG A 68 3.189 -19.815 5.327 1.00 0.00 H new ATOM 0 HG3 ARG A 68 2.964 -20.276 7.003 1.00 0.00 H new ATOM 0 HD2 ARG A 68 4.278 -22.357 6.602 1.00 0.00 H new ATOM 0 HD3 ARG A 68 4.510 -21.885 4.931 1.00 0.00 H new ATOM 0 HE ARG A 68 6.123 -20.317 5.582 1.00 0.00 H new ATOM 0 HH11 ARG A 68 4.357 -21.561 8.374 1.00 0.00 H new ATOM 0 HH12 ARG A 68 5.467 -20.841 9.544 1.00 0.00 H new ATOM 0 HH21 ARG A 68 7.546 -19.395 7.090 1.00 0.00 H new ATOM 0 HH22 ARG A 68 7.266 -19.620 8.820 1.00 0.00 H new ATOM 1059 N LEU A 69 1.138 -18.451 6.161 1.00 0.00 N ATOM 1060 CA LEU A 69 1.035 -17.344 7.106 1.00 0.00 C ATOM 1061 C LEU A 69 -0.393 -16.810 7.165 1.00 0.00 C ATOM 1062 O LEU A 69 -0.902 -16.486 8.239 1.00 0.00 O ATOM 1063 CB LEU A 69 1.996 -16.221 6.713 1.00 0.00 C ATOM 1064 CG LEU A 69 3.375 -16.660 6.219 1.00 0.00 C ATOM 1065 CD1 LEU A 69 4.235 -15.449 5.892 1.00 0.00 C ATOM 1066 CD2 LEU A 69 4.059 -17.537 7.257 1.00 0.00 C ATOM 0 H LEU A 69 1.772 -18.281 5.380 1.00 0.00 H new ATOM 0 HA LEU A 69 1.306 -17.716 8.094 1.00 0.00 H new ATOM 0 HB2 LEU A 69 1.525 -15.624 5.932 1.00 0.00 H new ATOM 0 HB3 LEU A 69 2.132 -15.568 7.575 1.00 0.00 H new ATOM 0 HG LEU A 69 3.244 -17.244 5.308 1.00 0.00 H new ATOM 0 HD11 LEU A 69 5.213 -15.781 5.542 1.00 0.00 H new ATOM 0 HD12 LEU A 69 3.752 -14.859 5.113 1.00 0.00 H new ATOM 0 HD13 LEU A 69 4.358 -14.838 6.786 1.00 0.00 H new ATOM 0 HD21 LEU A 69 5.039 -17.840 6.888 1.00 0.00 H new ATOM 0 HD22 LEU A 69 4.177 -16.978 8.185 1.00 0.00 H new ATOM 0 HD23 LEU A 69 3.451 -18.423 7.442 1.00 0.00 H new ATOM 1078 N HIS A 70 -1.035 -16.723 6.005 1.00 0.00 N ATOM 1079 CA HIS A 70 -2.406 -16.231 5.925 1.00 0.00 C ATOM 1080 C HIS A 70 -3.385 -17.382 5.715 1.00 0.00 C ATOM 1081 O HIS A 70 -3.637 -17.818 4.591 1.00 0.00 O ATOM 1082 CB HIS A 70 -2.541 -15.218 4.788 1.00 0.00 C ATOM 1083 CG HIS A 70 -1.806 -13.936 5.037 1.00 0.00 C ATOM 1084 ND1 HIS A 70 -2.431 -12.778 5.447 1.00 0.00 N ATOM 1085 CD2 HIS A 70 -0.490 -13.636 4.933 1.00 0.00 C ATOM 1086 CE1 HIS A 70 -1.532 -11.820 5.583 1.00 0.00 C ATOM 1087 NE2 HIS A 70 -0.346 -12.314 5.278 1.00 0.00 N ATOM 0 H HIS A 70 -0.628 -16.987 5.107 1.00 0.00 H new ATOM 0 HA HIS A 70 -2.646 -15.741 6.869 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -2.170 -15.667 3.867 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -3.597 -14.997 4.632 1.00 0.00 H new ATOM 0 HD2 HIS A 70 0.299 -14.310 4.635 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -1.733 -10.805 5.891 1.00 0.00 H new ATOM 0 HE2 HIS A 70 0.534 -11.798 5.296 1.00 0.00 H new ATOM 1096 N PRO A 71 -3.950 -17.888 6.821 1.00 0.00 N ATOM 1097 CA PRO A 71 -4.910 -18.995 6.784 1.00 0.00 C ATOM 1098 C PRO A 71 -6.245 -18.585 6.171 1.00 0.00 C ATOM 1099 O PRO A 71 -6.640 -17.422 6.241 1.00 0.00 O ATOM 1100 CB PRO A 71 -5.089 -19.359 8.260 1.00 0.00 C ATOM 1101 CG PRO A 71 -4.759 -18.110 9.001 1.00 0.00 C ATOM 1102 CD PRO A 71 -3.696 -17.418 8.193 1.00 0.00 C ATOM 0 HA PRO A 71 -4.556 -19.821 6.167 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -6.109 -19.684 8.467 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -4.429 -20.177 8.549 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -5.640 -17.477 9.111 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -4.401 -18.335 10.006 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -3.777 -16.334 8.268 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -2.695 -17.687 8.531 1.00 0.00 H new ATOM 1110 N GLY A 72 -6.937 -19.549 5.571 1.00 0.00 N ATOM 1111 CA GLY A 72 -8.220 -19.267 4.955 1.00 0.00 C ATOM 1112 C GLY A 72 -8.084 -18.800 3.519 1.00 0.00 C ATOM 1113 O GLY A 72 -9.046 -18.845 2.752 1.00 0.00 O ATOM 0 H GLY A 72 -6.632 -20.520 5.501 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -8.839 -20.164 4.985 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -8.738 -18.503 5.535 1.00 0.00 H new ATOM 1117 N CYS A 73 -6.888 -18.351 3.156 1.00 0.00 N ATOM 1118 CA CYS A 73 -6.631 -17.871 1.803 1.00 0.00 C ATOM 1119 C CYS A 73 -5.836 -18.898 1.004 1.00 0.00 C ATOM 1120 O CYS A 73 -5.458 -19.947 1.524 1.00 0.00 O ATOM 1121 CB CYS A 73 -5.873 -16.543 1.846 1.00 0.00 C ATOM 1122 SG CYS A 73 -6.809 -15.183 2.584 1.00 0.00 S ATOM 0 H CYS A 73 -6.081 -18.309 3.779 1.00 0.00 H new ATOM 0 HA CYS A 73 -7.591 -17.717 1.310 1.00 0.00 H new ATOM 0 HB2 CYS A 73 -4.950 -16.682 2.408 1.00 0.00 H new ATOM 0 HB3 CYS A 73 -5.589 -16.266 0.831 1.00 0.00 H new ATOM 0 HG CYS A 73 -5.989 -14.249 2.966 1.00 0.00 H new ATOM 1128 N GLY A 74 -5.586 -18.590 -0.265 1.00 0.00 N ATOM 1129 CA GLY A 74 -4.839 -19.497 -1.116 1.00 0.00 C ATOM 1130 C GLY A 74 -4.140 -18.781 -2.255 1.00 0.00 C ATOM 1131 O GLY A 74 -3.957 -17.564 -2.232 1.00 0.00 O ATOM 0 H GLY A 74 -5.888 -17.728 -0.719 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -4.099 -20.027 -0.516 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -5.516 -20.248 -1.524 1.00 0.00 H new ATOM 1135 N PRO A 75 -3.735 -19.545 -3.280 1.00 0.00 N ATOM 1136 CA PRO A 75 -3.045 -18.998 -4.452 1.00 0.00 C ATOM 1137 C PRO A 75 -3.965 -18.148 -5.322 1.00 0.00 C ATOM 1138 O PRO A 75 -3.507 -17.275 -6.059 1.00 0.00 O ATOM 1139 CB PRO A 75 -2.593 -20.246 -5.213 1.00 0.00 C ATOM 1140 CG PRO A 75 -3.551 -21.310 -4.799 1.00 0.00 C ATOM 1141 CD PRO A 75 -3.920 -21.003 -3.374 1.00 0.00 C ATOM 0 HA PRO A 75 -2.227 -18.335 -4.170 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -2.622 -20.085 -6.291 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -1.568 -20.515 -4.958 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -4.433 -21.311 -5.439 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -3.097 -22.297 -4.880 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -4.947 -21.293 -3.154 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -3.281 -21.535 -2.670 1.00 0.00 H new ATOM 1149 N HIS A 76 -5.266 -18.408 -5.230 1.00 0.00 N ATOM 1150 CA HIS A 76 -6.251 -17.666 -6.009 1.00 0.00 C ATOM 1151 C HIS A 76 -6.855 -16.534 -5.183 1.00 0.00 C ATOM 1152 O HIS A 76 -7.960 -16.068 -5.462 1.00 0.00 O ATOM 1153 CB HIS A 76 -7.356 -18.602 -6.498 1.00 0.00 C ATOM 1154 CG HIS A 76 -7.620 -19.751 -5.574 1.00 0.00 C ATOM 1155 ND1 HIS A 76 -7.704 -19.613 -4.205 1.00 0.00 N ATOM 1156 CD2 HIS A 76 -7.820 -21.065 -5.831 1.00 0.00 C ATOM 1157 CE1 HIS A 76 -7.943 -20.792 -3.659 1.00 0.00 C ATOM 1158 NE2 HIS A 76 -8.018 -21.690 -4.624 1.00 0.00 N ATOM 0 H HIS A 76 -5.662 -19.127 -4.624 1.00 0.00 H new ATOM 0 HA HIS A 76 -5.745 -17.233 -6.872 1.00 0.00 H new ATOM 0 HB2 HIS A 76 -8.275 -18.030 -6.625 1.00 0.00 H new ATOM 0 HB3 HIS A 76 -7.084 -18.991 -7.479 1.00 0.00 H new ATOM 0 HD2 HIS A 76 -7.823 -21.534 -6.804 1.00 0.00 H new ATOM 0 HE1 HIS A 76 -8.058 -20.988 -2.603 1.00 0.00 H new ATOM 0 HE2 HIS A 76 -8.194 -22.686 -4.494 1.00 0.00 H new ATOM 1167 N THR A 77 -6.122 -16.096 -4.163 1.00 0.00 N ATOM 1168 CA THR A 77 -6.586 -15.020 -3.296 1.00 0.00 C ATOM 1169 C THR A 77 -5.800 -13.738 -3.541 1.00 0.00 C ATOM 1170 O THR A 77 -4.569 -13.733 -3.495 1.00 0.00 O ATOM 1171 CB THR A 77 -6.466 -15.406 -1.809 1.00 0.00 C ATOM 1172 OG1 THR A 77 -7.296 -16.539 -1.529 1.00 0.00 O ATOM 1173 CG2 THR A 77 -6.867 -14.243 -0.914 1.00 0.00 C ATOM 0 H THR A 77 -5.205 -16.470 -3.918 1.00 0.00 H new ATOM 0 HA THR A 77 -7.635 -14.851 -3.537 1.00 0.00 H new ATOM 0 HB THR A 77 -5.426 -15.659 -1.604 1.00 0.00 H new ATOM 0 HG1 THR A 77 -7.469 -16.587 -0.566 1.00 0.00 H new ATOM 0 HG21 THR A 77 -6.774 -14.539 0.131 1.00 0.00 H new ATOM 0 HG22 THR A 77 -6.215 -13.392 -1.109 1.00 0.00 H new ATOM 0 HG23 THR A 77 -7.900 -13.963 -1.122 1.00 0.00 H new ATOM 1181 N THR A 78 -6.517 -12.650 -3.802 1.00 0.00 N ATOM 1182 CA THR A 78 -5.886 -11.360 -4.056 1.00 0.00 C ATOM 1183 C THR A 78 -5.384 -10.731 -2.762 1.00 0.00 C ATOM 1184 O THR A 78 -6.118 -10.641 -1.777 1.00 0.00 O ATOM 1185 CB THR A 78 -6.859 -10.385 -4.745 1.00 0.00 C ATOM 1186 OG1 THR A 78 -7.283 -10.922 -6.002 1.00 0.00 O ATOM 1187 CG2 THR A 78 -6.203 -9.030 -4.962 1.00 0.00 C ATOM 0 H THR A 78 -7.536 -12.636 -3.843 1.00 0.00 H new ATOM 0 HA THR A 78 -5.041 -11.545 -4.719 1.00 0.00 H new ATOM 0 HB THR A 78 -7.725 -10.252 -4.097 1.00 0.00 H new ATOM 0 HG1 THR A 78 -7.903 -10.297 -6.433 1.00 0.00 H new ATOM 0 HG21 THR A 78 -6.909 -8.358 -5.450 1.00 0.00 H new ATOM 0 HG22 THR A 78 -5.908 -8.610 -4.000 1.00 0.00 H new ATOM 0 HG23 THR A 78 -5.321 -9.149 -5.592 1.00 0.00 H new ATOM 1195 N PHE A 79 -4.129 -10.294 -2.770 1.00 0.00 N ATOM 1196 CA PHE A 79 -3.528 -9.672 -1.596 1.00 0.00 C ATOM 1197 C PHE A 79 -3.183 -8.212 -1.871 1.00 0.00 C ATOM 1198 O PHE A 79 -2.428 -7.904 -2.793 1.00 0.00 O ATOM 1199 CB PHE A 79 -2.270 -10.435 -1.176 1.00 0.00 C ATOM 1200 CG PHE A 79 -2.542 -11.844 -0.733 1.00 0.00 C ATOM 1201 CD1 PHE A 79 -3.529 -12.112 0.202 1.00 0.00 C ATOM 1202 CD2 PHE A 79 -1.813 -12.901 -1.253 1.00 0.00 C ATOM 1203 CE1 PHE A 79 -3.781 -13.407 0.612 1.00 0.00 C ATOM 1204 CE2 PHE A 79 -2.061 -14.199 -0.848 1.00 0.00 C ATOM 1205 CZ PHE A 79 -3.047 -14.452 0.085 1.00 0.00 C ATOM 0 H PHE A 79 -3.508 -10.359 -3.577 1.00 0.00 H new ATOM 0 HA PHE A 79 -4.254 -9.709 -0.784 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -1.571 -10.454 -2.012 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -1.782 -9.896 -0.364 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -4.108 -11.299 0.615 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -1.041 -12.708 -1.984 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -4.551 -13.602 1.344 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -1.485 -15.014 -1.261 1.00 0.00 H new ATOM 0 HZ PHE A 79 -3.244 -15.465 0.402 1.00 0.00 H new ATOM 1215 N ARG A 80 -3.743 -7.316 -1.064 1.00 0.00 N ATOM 1216 CA ARG A 80 -3.496 -5.888 -1.221 1.00 0.00 C ATOM 1217 C ARG A 80 -2.696 -5.341 -0.042 1.00 0.00 C ATOM 1218 O ARG A 80 -3.130 -5.422 1.107 1.00 0.00 O ATOM 1219 CB ARG A 80 -4.820 -5.131 -1.346 1.00 0.00 C ATOM 1220 CG ARG A 80 -4.653 -3.672 -1.736 1.00 0.00 C ATOM 1221 CD ARG A 80 -5.995 -2.963 -1.830 1.00 0.00 C ATOM 1222 NE ARG A 80 -5.963 -1.854 -2.781 1.00 0.00 N ATOM 1223 CZ ARG A 80 -6.824 -0.842 -2.759 1.00 0.00 C ATOM 1224 NH1 ARG A 80 -7.778 -0.800 -1.840 1.00 0.00 N ATOM 1225 NH2 ARG A 80 -6.730 0.130 -3.657 1.00 0.00 N ATOM 0 H ARG A 80 -4.370 -7.554 -0.296 1.00 0.00 H new ATOM 0 HA ARG A 80 -2.914 -5.744 -2.131 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -5.444 -5.628 -2.089 1.00 0.00 H new ATOM 0 HB3 ARG A 80 -5.351 -5.186 -0.396 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -4.025 -3.168 -1.002 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -4.138 -3.607 -2.695 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -6.762 -3.677 -2.131 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -6.277 -2.589 -0.846 1.00 0.00 H new ATOM 0 HE ARG A 80 -5.240 -1.857 -3.501 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -7.852 -1.545 -1.148 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -8.438 -0.022 -1.825 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -5.996 0.101 -4.365 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -7.391 0.906 -3.639 1.00 0.00 H new ATOM 1239 N TRP A 81 -1.525 -4.787 -0.335 1.00 0.00 N ATOM 1240 CA TRP A 81 -0.664 -4.228 0.700 1.00 0.00 C ATOM 1241 C TRP A 81 -0.591 -2.709 0.587 1.00 0.00 C ATOM 1242 O TRP A 81 0.124 -2.175 -0.260 1.00 0.00 O ATOM 1243 CB TRP A 81 0.740 -4.827 0.602 1.00 0.00 C ATOM 1244 CG TRP A 81 1.590 -4.550 1.806 1.00 0.00 C ATOM 1245 CD1 TRP A 81 1.182 -4.529 3.109 1.00 0.00 C ATOM 1246 CD2 TRP A 81 2.990 -4.253 1.817 1.00 0.00 C ATOM 1247 NE1 TRP A 81 2.245 -4.237 3.929 1.00 0.00 N ATOM 1248 CE2 TRP A 81 3.366 -4.064 3.161 1.00 0.00 C ATOM 1249 CE3 TRP A 81 3.964 -4.130 0.822 1.00 0.00 C ATOM 1250 CZ2 TRP A 81 4.672 -3.758 3.533 1.00 0.00 C ATOM 1251 CZ3 TRP A 81 5.260 -3.825 1.192 1.00 0.00 C ATOM 1252 CH2 TRP A 81 5.605 -3.643 2.538 1.00 0.00 C ATOM 0 H TRP A 81 -1.150 -4.713 -1.281 1.00 0.00 H new ATOM 0 HA TRP A 81 -1.093 -4.481 1.670 1.00 0.00 H new ATOM 0 HB2 TRP A 81 0.658 -5.905 0.464 1.00 0.00 H new ATOM 0 HB3 TRP A 81 1.236 -4.429 -0.283 1.00 0.00 H new ATOM 0 HD1 TRP A 81 0.173 -4.715 3.445 1.00 0.00 H new ATOM 0 HE1 TRP A 81 2.206 -4.161 4.945 1.00 0.00 H new ATOM 0 HE3 TRP A 81 3.708 -4.271 -0.218 1.00 0.00 H new ATOM 0 HZ2 TRP A 81 4.940 -3.616 4.570 1.00 0.00 H new ATOM 0 HZ3 TRP A 81 6.020 -3.725 0.431 1.00 0.00 H new ATOM 0 HH2 TRP A 81 6.627 -3.407 2.795 1.00 0.00 H new ATOM 1263 N GLN A 82 -1.335 -2.020 1.446 1.00 0.00 N ATOM 1264 CA GLN A 82 -1.354 -0.562 1.441 1.00 0.00 C ATOM 1265 C GLN A 82 -0.392 -0.001 2.482 1.00 0.00 C ATOM 1266 O GLN A 82 -0.406 -0.413 3.642 1.00 0.00 O ATOM 1267 CB GLN A 82 -2.770 -0.048 1.708 1.00 0.00 C ATOM 1268 CG GLN A 82 -2.946 1.433 1.414 1.00 0.00 C ATOM 1269 CD GLN A 82 -4.403 1.837 1.306 1.00 0.00 C ATOM 1270 OE1 GLN A 82 -4.767 2.675 0.480 1.00 0.00 O ATOM 1271 NE2 GLN A 82 -5.247 1.241 2.140 1.00 0.00 N ATOM 0 H GLN A 82 -1.932 -2.448 2.154 1.00 0.00 H new ATOM 0 HA GLN A 82 -1.032 -0.223 0.456 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -3.474 -0.617 1.101 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -3.025 -0.235 2.751 1.00 0.00 H new ATOM 0 HG2 GLN A 82 -2.469 2.015 2.202 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -2.435 1.678 0.483 1.00 0.00 H new ATOM 0 HE21 GLN A 82 -4.902 0.552 2.809 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -6.240 1.472 2.112 1.00 0.00 H new ATOM 1280 N VAL A 83 0.445 0.942 2.060 1.00 0.00 N ATOM 1281 CA VAL A 83 1.414 1.560 2.957 1.00 0.00 C ATOM 1282 C VAL A 83 1.201 3.067 3.042 1.00 0.00 C ATOM 1283 O VAL A 83 1.079 3.747 2.023 1.00 0.00 O ATOM 1284 CB VAL A 83 2.859 1.283 2.499 1.00 0.00 C ATOM 1285 CG1 VAL A 83 3.845 2.101 3.318 1.00 0.00 C ATOM 1286 CG2 VAL A 83 3.173 -0.202 2.598 1.00 0.00 C ATOM 0 H VAL A 83 0.471 1.294 1.103 1.00 0.00 H new ATOM 0 HA VAL A 83 1.261 1.118 3.941 1.00 0.00 H new ATOM 0 HB VAL A 83 2.955 1.583 1.455 1.00 0.00 H new ATOM 0 HG11 VAL A 83 4.860 1.892 2.980 1.00 0.00 H new ATOM 0 HG12 VAL A 83 3.631 3.162 3.191 1.00 0.00 H new ATOM 0 HG13 VAL A 83 3.751 1.836 4.371 1.00 0.00 H new ATOM 0 HG21 VAL A 83 4.197 -0.380 2.271 1.00 0.00 H new ATOM 0 HG22 VAL A 83 3.060 -0.530 3.631 1.00 0.00 H new ATOM 0 HG23 VAL A 83 2.487 -0.762 1.963 1.00 0.00 H new ATOM 1296 N LYS A 84 1.156 3.585 4.265 1.00 0.00 N ATOM 1297 CA LYS A 84 0.959 5.012 4.486 1.00 0.00 C ATOM 1298 C LYS A 84 2.297 5.736 4.596 1.00 0.00 C ATOM 1299 O LYS A 84 3.003 5.608 5.597 1.00 0.00 O ATOM 1300 CB LYS A 84 0.136 5.244 5.755 1.00 0.00 C ATOM 1301 CG LYS A 84 -0.589 6.579 5.774 1.00 0.00 C ATOM 1302 CD LYS A 84 -1.778 6.554 6.721 1.00 0.00 C ATOM 1303 CE LYS A 84 -2.759 7.674 6.413 1.00 0.00 C ATOM 1304 NZ LYS A 84 -4.156 7.302 6.772 1.00 0.00 N ATOM 0 H LYS A 84 1.254 3.036 5.119 1.00 0.00 H new ATOM 0 HA LYS A 84 0.417 5.415 3.630 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -0.595 4.442 5.856 1.00 0.00 H new ATOM 0 HB3 LYS A 84 0.795 5.186 6.621 1.00 0.00 H new ATOM 0 HG2 LYS A 84 0.102 7.365 6.077 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -0.929 6.824 4.768 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -2.286 5.593 6.644 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -1.428 6.648 7.749 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -2.470 8.571 6.961 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -2.710 7.919 5.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -4.794 8.092 6.547 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -4.441 6.461 6.231 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -4.209 7.093 7.789 1.00 0.00 H new ATOM 1318 N LEU A 85 2.640 6.496 3.562 1.00 0.00 N ATOM 1319 CA LEU A 85 3.894 7.242 3.544 1.00 0.00 C ATOM 1320 C LEU A 85 3.737 8.587 4.246 1.00 0.00 C ATOM 1321 O LEU A 85 2.937 9.426 3.830 1.00 0.00 O ATOM 1322 CB LEU A 85 4.361 7.457 2.103 1.00 0.00 C ATOM 1323 CG LEU A 85 4.277 6.240 1.182 1.00 0.00 C ATOM 1324 CD1 LEU A 85 4.066 6.675 -0.260 1.00 0.00 C ATOM 1325 CD2 LEU A 85 5.533 5.390 1.306 1.00 0.00 C ATOM 0 H LEU A 85 2.068 6.612 2.725 1.00 0.00 H new ATOM 0 HA LEU A 85 4.643 6.659 4.079 1.00 0.00 H new ATOM 0 HB2 LEU A 85 3.768 8.260 1.666 1.00 0.00 H new ATOM 0 HB3 LEU A 85 5.395 7.800 2.125 1.00 0.00 H new ATOM 0 HG LEU A 85 3.422 5.636 1.486 1.00 0.00 H new ATOM 0 HD11 LEU A 85 4.009 5.795 -0.901 1.00 0.00 H new ATOM 0 HD12 LEU A 85 3.138 7.241 -0.337 1.00 0.00 H new ATOM 0 HD13 LEU A 85 4.900 7.301 -0.577 1.00 0.00 H new ATOM 0 HD21 LEU A 85 5.456 4.528 0.643 1.00 0.00 H new ATOM 0 HD22 LEU A 85 6.403 5.984 1.028 1.00 0.00 H new ATOM 0 HD23 LEU A 85 5.641 5.048 2.335 1.00 0.00 H new ATOM 1337 N ARG A 86 4.508 8.787 5.310 1.00 0.00 N ATOM 1338 CA ARG A 86 4.456 10.030 6.069 1.00 0.00 C ATOM 1339 C ARG A 86 4.552 11.238 5.141 1.00 0.00 C ATOM 1340 O ARG A 86 3.658 12.082 5.110 1.00 0.00 O ATOM 1341 CB ARG A 86 5.587 10.073 7.098 1.00 0.00 C ATOM 1342 CG ARG A 86 5.317 9.232 8.334 1.00 0.00 C ATOM 1343 CD ARG A 86 4.554 10.019 9.388 1.00 0.00 C ATOM 1344 NE ARG A 86 3.170 10.263 8.993 1.00 0.00 N ATOM 1345 CZ ARG A 86 2.418 11.229 9.509 1.00 0.00 C ATOM 1346 NH1 ARG A 86 2.915 12.037 10.435 1.00 0.00 N ATOM 1347 NH2 ARG A 86 1.167 11.389 9.098 1.00 0.00 N ATOM 0 H ARG A 86 5.176 8.103 5.666 1.00 0.00 H new ATOM 0 HA ARG A 86 3.499 10.068 6.590 1.00 0.00 H new ATOM 0 HB2 ARG A 86 6.508 9.728 6.628 1.00 0.00 H new ATOM 0 HB3 ARG A 86 5.752 11.107 7.401 1.00 0.00 H new ATOM 0 HG2 ARG A 86 4.746 8.347 8.055 1.00 0.00 H new ATOM 0 HG3 ARG A 86 6.262 8.883 8.752 1.00 0.00 H new ATOM 0 HD2 ARG A 86 4.571 9.473 10.331 1.00 0.00 H new ATOM 0 HD3 ARG A 86 5.055 10.971 9.562 1.00 0.00 H new ATOM 0 HE ARG A 86 2.758 9.659 8.282 1.00 0.00 H new ATOM 0 HH11 ARG A 86 3.877 11.918 10.753 1.00 0.00 H new ATOM 0 HH12 ARG A 86 2.336 12.778 10.830 1.00 0.00 H new ATOM 0 HH21 ARG A 86 0.781 10.770 8.385 1.00 0.00 H new ATOM 0 HH22 ARG A 86 0.591 12.131 9.495 1.00 0.00 H new ATOM 1361 N ASN A 87 5.644 11.312 4.386 1.00 0.00 N ATOM 1362 CA ASN A 87 5.858 12.417 3.458 1.00 0.00 C ATOM 1363 C ASN A 87 5.378 12.051 2.057 1.00 0.00 C ATOM 1364 O ASN A 87 5.399 10.883 1.667 1.00 0.00 O ATOM 1365 CB ASN A 87 7.339 12.798 3.419 1.00 0.00 C ATOM 1366 CG ASN A 87 7.562 14.197 2.877 1.00 0.00 C ATOM 1367 OD1 ASN A 87 7.383 15.197 3.732 1.00 0.00 O flip ATOM 1368 ND2 ASN A 87 7.892 14.375 1.705 1.00 0.00 N flip ATOM 0 H ASN A 87 6.394 10.620 4.399 1.00 0.00 H new ATOM 0 HA ASN A 87 5.279 13.271 3.809 1.00 0.00 H new ATOM 0 HB2 ASN A 87 7.755 12.730 4.424 1.00 0.00 H new ATOM 0 HB3 ASN A 87 7.880 12.081 2.801 1.00 0.00 H new ATOM 0 HD21 ASN A 87 8.018 13.576 1.084 1.00 0.00 H new ATOM 0 HD22 ASN A 87 8.039 15.322 1.355 1.00 0.00 H new ATOM 1375 N LEU A 88 4.946 13.057 1.304 1.00 0.00 N ATOM 1376 CA LEU A 88 4.461 12.842 -0.055 1.00 0.00 C ATOM 1377 C LEU A 88 5.542 12.208 -0.925 1.00 0.00 C ATOM 1378 O LEU A 88 6.720 12.204 -0.564 1.00 0.00 O ATOM 1379 CB LEU A 88 4.007 14.166 -0.671 1.00 0.00 C ATOM 1380 CG LEU A 88 2.594 14.625 -0.308 1.00 0.00 C ATOM 1381 CD1 LEU A 88 2.310 15.996 -0.901 1.00 0.00 C ATOM 1382 CD2 LEU A 88 1.565 13.611 -0.785 1.00 0.00 C ATOM 0 H LEU A 88 4.922 14.029 1.611 1.00 0.00 H new ATOM 0 HA LEU A 88 3.612 12.160 -0.008 1.00 0.00 H new ATOM 0 HB2 LEU A 88 4.709 14.944 -0.370 1.00 0.00 H new ATOM 0 HB3 LEU A 88 4.072 14.081 -1.756 1.00 0.00 H new ATOM 0 HG LEU A 88 2.524 14.700 0.777 1.00 0.00 H new ATOM 0 HD11 LEU A 88 1.300 16.306 -0.633 1.00 0.00 H new ATOM 0 HD12 LEU A 88 3.028 16.717 -0.510 1.00 0.00 H new ATOM 0 HD13 LEU A 88 2.398 15.948 -1.986 1.00 0.00 H new ATOM 0 HD21 LEU A 88 0.565 13.954 -0.518 1.00 0.00 H new ATOM 0 HD22 LEU A 88 1.635 13.503 -1.867 1.00 0.00 H new ATOM 0 HD23 LEU A 88 1.757 12.648 -0.312 1.00 0.00 H new ATOM 1394 N ILE A 89 5.135 11.676 -2.072 1.00 0.00 N ATOM 1395 CA ILE A 89 6.069 11.042 -2.994 1.00 0.00 C ATOM 1396 C ILE A 89 5.681 11.315 -4.443 1.00 0.00 C ATOM 1397 O ILE A 89 4.721 12.037 -4.713 1.00 0.00 O ATOM 1398 CB ILE A 89 6.136 9.520 -2.770 1.00 0.00 C ATOM 1399 CG1 ILE A 89 4.741 8.904 -2.883 1.00 0.00 C ATOM 1400 CG2 ILE A 89 6.749 9.211 -1.413 1.00 0.00 C ATOM 1401 CD1 ILE A 89 4.748 7.480 -3.394 1.00 0.00 C ATOM 0 H ILE A 89 4.164 11.671 -2.385 1.00 0.00 H new ATOM 0 HA ILE A 89 7.050 11.473 -2.796 1.00 0.00 H new ATOM 0 HB ILE A 89 6.769 9.082 -3.541 1.00 0.00 H new ATOM 0 HG12 ILE A 89 4.262 8.928 -1.904 1.00 0.00 H new ATOM 0 HG13 ILE A 89 4.135 9.518 -3.549 1.00 0.00 H new ATOM 0 HG21 ILE A 89 6.789 8.131 -1.269 1.00 0.00 H new ATOM 0 HG22 ILE A 89 7.758 9.621 -1.368 1.00 0.00 H new ATOM 0 HG23 ILE A 89 6.140 9.659 -0.628 1.00 0.00 H new ATOM 0 HD11 ILE A 89 3.725 7.108 -3.448 1.00 0.00 H new ATOM 0 HD12 ILE A 89 5.198 7.452 -4.387 1.00 0.00 H new ATOM 0 HD13 ILE A 89 5.327 6.853 -2.716 1.00 0.00 H new ATOM 1413 N GLU A 90 6.432 10.731 -5.372 1.00 0.00 N ATOM 1414 CA GLU A 90 6.165 10.911 -6.794 1.00 0.00 C ATOM 1415 C GLU A 90 5.851 9.575 -7.461 1.00 0.00 C ATOM 1416 O GLU A 90 6.739 8.861 -7.927 1.00 0.00 O ATOM 1417 CB GLU A 90 7.364 11.568 -7.481 1.00 0.00 C ATOM 1418 CG GLU A 90 7.311 13.086 -7.479 1.00 0.00 C ATOM 1419 CD GLU A 90 8.687 13.718 -7.551 1.00 0.00 C ATOM 1420 OE1 GLU A 90 9.540 13.200 -8.300 1.00 0.00 O ATOM 1421 OE2 GLU A 90 8.910 14.733 -6.857 1.00 0.00 O ATOM 0 H GLU A 90 7.230 10.130 -5.165 1.00 0.00 H new ATOM 0 HA GLU A 90 5.296 11.561 -6.896 1.00 0.00 H new ATOM 0 HB2 GLU A 90 8.279 11.244 -6.984 1.00 0.00 H new ATOM 0 HB3 GLU A 90 7.419 11.216 -8.511 1.00 0.00 H new ATOM 0 HG2 GLU A 90 6.714 13.426 -8.326 1.00 0.00 H new ATOM 0 HG3 GLU A 90 6.806 13.427 -6.575 1.00 0.00 H new ATOM 1428 N PRO A 91 4.556 9.229 -7.510 1.00 0.00 N ATOM 1429 CA PRO A 91 4.093 7.978 -8.118 1.00 0.00 C ATOM 1430 C PRO A 91 4.251 7.977 -9.635 1.00 0.00 C ATOM 1431 O PRO A 91 4.311 6.920 -10.261 1.00 0.00 O ATOM 1432 CB PRO A 91 2.613 7.923 -7.734 1.00 0.00 C ATOM 1433 CG PRO A 91 2.223 9.346 -7.523 1.00 0.00 C ATOM 1434 CD PRO A 91 3.444 10.032 -6.975 1.00 0.00 C ATOM 0 HA PRO A 91 4.669 7.120 -7.772 1.00 0.00 H new ATOM 0 HB2 PRO A 91 2.017 7.462 -8.521 1.00 0.00 H new ATOM 0 HB3 PRO A 91 2.460 7.332 -6.831 1.00 0.00 H new ATOM 0 HG2 PRO A 91 1.903 9.806 -8.458 1.00 0.00 H new ATOM 0 HG3 PRO A 91 1.387 9.423 -6.828 1.00 0.00 H new ATOM 0 HD2 PRO A 91 3.503 11.070 -7.304 1.00 0.00 H new ATOM 0 HD3 PRO A 91 3.444 10.042 -5.885 1.00 0.00 H new ATOM 1442 N GLU A 92 4.319 9.170 -10.218 1.00 0.00 N ATOM 1443 CA GLU A 92 4.469 9.305 -11.662 1.00 0.00 C ATOM 1444 C GLU A 92 5.841 8.813 -12.115 1.00 0.00 C ATOM 1445 O GLU A 92 6.072 8.597 -13.304 1.00 0.00 O ATOM 1446 CB GLU A 92 4.274 10.763 -12.083 1.00 0.00 C ATOM 1447 CG GLU A 92 2.861 11.277 -11.863 1.00 0.00 C ATOM 1448 CD GLU A 92 2.624 12.627 -12.510 1.00 0.00 C ATOM 1449 OE1 GLU A 92 3.031 12.805 -13.678 1.00 0.00 O ATOM 1450 OE2 GLU A 92 2.032 13.506 -11.850 1.00 0.00 O ATOM 0 H GLU A 92 4.273 10.055 -9.713 1.00 0.00 H new ATOM 0 HA GLU A 92 3.706 8.691 -12.140 1.00 0.00 H new ATOM 0 HB2 GLU A 92 4.970 11.389 -11.525 1.00 0.00 H new ATOM 0 HB3 GLU A 92 4.528 10.865 -13.138 1.00 0.00 H new ATOM 0 HG2 GLU A 92 2.149 10.556 -12.265 1.00 0.00 H new ATOM 0 HG3 GLU A 92 2.668 11.352 -10.793 1.00 0.00 H new ATOM 1457 N GLN A 93 6.746 8.638 -11.157 1.00 0.00 N ATOM 1458 CA GLN A 93 8.095 8.173 -11.457 1.00 0.00 C ATOM 1459 C GLN A 93 8.354 6.811 -10.822 1.00 0.00 C ATOM 1460 O GLN A 93 9.261 6.086 -11.233 1.00 0.00 O ATOM 1461 CB GLN A 93 9.129 9.185 -10.962 1.00 0.00 C ATOM 1462 CG GLN A 93 8.765 10.628 -11.274 1.00 0.00 C ATOM 1463 CD GLN A 93 9.984 11.516 -11.431 1.00 0.00 C ATOM 1464 OE1 GLN A 93 10.965 11.136 -12.070 1.00 0.00 O ATOM 1465 NE2 GLN A 93 9.928 12.707 -10.846 1.00 0.00 N ATOM 0 H GLN A 93 6.570 8.811 -10.167 1.00 0.00 H new ATOM 0 HA GLN A 93 8.186 8.073 -12.539 1.00 0.00 H new ATOM 0 HB2 GLN A 93 9.247 9.074 -9.884 1.00 0.00 H new ATOM 0 HB3 GLN A 93 10.094 8.957 -11.414 1.00 0.00 H new ATOM 0 HG2 GLN A 93 8.176 10.660 -12.191 1.00 0.00 H new ATOM 0 HG3 GLN A 93 8.135 11.020 -10.476 1.00 0.00 H new ATOM 0 HE21 GLN A 93 9.094 12.981 -10.326 1.00 0.00 H new ATOM 0 HE22 GLN A 93 10.719 13.348 -10.917 1.00 0.00 H new ATOM 1474 N CYS A 94 7.554 6.469 -9.819 1.00 0.00 N ATOM 1475 CA CYS A 94 7.698 5.194 -9.125 1.00 0.00 C ATOM 1476 C CYS A 94 7.689 4.033 -10.115 1.00 0.00 C ATOM 1477 O CYS A 94 7.210 4.167 -11.242 1.00 0.00 O ATOM 1478 CB CYS A 94 6.576 5.017 -8.102 1.00 0.00 C ATOM 1479 SG CYS A 94 6.752 6.047 -6.627 1.00 0.00 S ATOM 0 H CYS A 94 6.798 7.057 -9.468 1.00 0.00 H new ATOM 0 HA CYS A 94 8.656 5.197 -8.605 1.00 0.00 H new ATOM 0 HB2 CYS A 94 5.624 5.246 -8.580 1.00 0.00 H new ATOM 0 HB3 CYS A 94 6.537 3.971 -7.799 1.00 0.00 H new ATOM 0 HG CYS A 94 6.791 7.299 -6.974 1.00 0.00 H new ATOM 1485 N THR A 95 8.223 2.893 -9.687 1.00 0.00 N ATOM 1486 CA THR A 95 8.279 1.710 -10.535 1.00 0.00 C ATOM 1487 C THR A 95 8.075 0.438 -9.719 1.00 0.00 C ATOM 1488 O THR A 95 8.520 0.345 -8.575 1.00 0.00 O ATOM 1489 CB THR A 95 9.623 1.617 -11.282 1.00 0.00 C ATOM 1490 OG1 THR A 95 10.706 1.631 -10.346 1.00 0.00 O ATOM 1491 CG2 THR A 95 9.778 2.771 -12.262 1.00 0.00 C ATOM 0 H THR A 95 8.623 2.765 -8.757 1.00 0.00 H new ATOM 0 HA THR A 95 7.473 1.805 -11.263 1.00 0.00 H new ATOM 0 HB THR A 95 9.639 0.681 -11.841 1.00 0.00 H new ATOM 0 HG1 THR A 95 11.353 2.321 -10.604 1.00 0.00 H new ATOM 0 HG21 THR A 95 10.734 2.684 -12.778 1.00 0.00 H new ATOM 0 HG22 THR A 95 8.968 2.740 -12.991 1.00 0.00 H new ATOM 0 HG23 THR A 95 9.742 3.716 -11.720 1.00 0.00 H new ATOM 1499 N PHE A 96 7.401 -0.540 -10.315 1.00 0.00 N ATOM 1500 CA PHE A 96 7.139 -1.807 -9.642 1.00 0.00 C ATOM 1501 C PHE A 96 7.464 -2.985 -10.556 1.00 0.00 C ATOM 1502 O PHE A 96 6.924 -3.098 -11.657 1.00 0.00 O ATOM 1503 CB PHE A 96 5.676 -1.880 -9.199 1.00 0.00 C ATOM 1504 CG PHE A 96 4.731 -2.246 -10.307 1.00 0.00 C ATOM 1505 CD1 PHE A 96 4.603 -3.562 -10.721 1.00 0.00 C ATOM 1506 CD2 PHE A 96 3.970 -1.273 -10.936 1.00 0.00 C ATOM 1507 CE1 PHE A 96 3.734 -3.902 -11.740 1.00 0.00 C ATOM 1508 CE2 PHE A 96 3.099 -1.607 -11.956 1.00 0.00 C ATOM 1509 CZ PHE A 96 2.982 -2.923 -12.359 1.00 0.00 C ATOM 0 H PHE A 96 7.027 -0.480 -11.262 1.00 0.00 H new ATOM 0 HA PHE A 96 7.781 -1.863 -8.763 1.00 0.00 H new ATOM 0 HB2 PHE A 96 5.584 -2.612 -8.397 1.00 0.00 H new ATOM 0 HB3 PHE A 96 5.382 -0.916 -8.785 1.00 0.00 H new ATOM 0 HD1 PHE A 96 5.190 -4.332 -10.241 1.00 0.00 H new ATOM 0 HD2 PHE A 96 4.059 -0.242 -10.626 1.00 0.00 H new ATOM 0 HE1 PHE A 96 3.643 -4.932 -12.052 1.00 0.00 H new ATOM 0 HE2 PHE A 96 2.511 -0.840 -12.437 1.00 0.00 H new ATOM 0 HZ PHE A 96 2.303 -3.186 -13.157 1.00 0.00 H new ATOM 1519 N CYS A 97 8.350 -3.859 -10.091 1.00 0.00 N ATOM 1520 CA CYS A 97 8.750 -5.028 -10.866 1.00 0.00 C ATOM 1521 C CYS A 97 9.140 -6.182 -9.948 1.00 0.00 C ATOM 1522 O CYS A 97 9.837 -5.987 -8.952 1.00 0.00 O ATOM 1523 CB CYS A 97 9.917 -4.679 -11.791 1.00 0.00 C ATOM 1524 SG CYS A 97 9.494 -3.512 -13.106 1.00 0.00 S ATOM 0 H CYS A 97 8.805 -3.780 -9.181 1.00 0.00 H new ATOM 0 HA CYS A 97 7.898 -5.340 -11.470 1.00 0.00 H new ATOM 0 HB2 CYS A 97 10.727 -4.259 -11.194 1.00 0.00 H new ATOM 0 HB3 CYS A 97 10.296 -5.596 -12.242 1.00 0.00 H new ATOM 0 HG CYS A 97 8.324 -2.998 -12.870 1.00 0.00 H new ATOM 1530 N PHE A 98 8.685 -7.383 -10.289 1.00 0.00 N ATOM 1531 CA PHE A 98 8.984 -8.568 -9.494 1.00 0.00 C ATOM 1532 C PHE A 98 10.372 -9.108 -9.823 1.00 0.00 C ATOM 1533 O PHE A 98 10.902 -8.871 -10.910 1.00 0.00 O ATOM 1534 CB PHE A 98 7.932 -9.651 -9.738 1.00 0.00 C ATOM 1535 CG PHE A 98 6.520 -9.141 -9.677 1.00 0.00 C ATOM 1536 CD1 PHE A 98 5.958 -8.488 -10.762 1.00 0.00 C ATOM 1537 CD2 PHE A 98 5.756 -9.314 -8.535 1.00 0.00 C ATOM 1538 CE1 PHE A 98 4.659 -8.017 -10.710 1.00 0.00 C ATOM 1539 CE2 PHE A 98 4.457 -8.846 -8.476 1.00 0.00 C ATOM 1540 CZ PHE A 98 3.908 -8.196 -9.565 1.00 0.00 C ATOM 0 H PHE A 98 8.108 -7.561 -11.111 1.00 0.00 H new ATOM 0 HA PHE A 98 8.964 -8.283 -8.442 1.00 0.00 H new ATOM 0 HB2 PHE A 98 8.105 -10.101 -10.716 1.00 0.00 H new ATOM 0 HB3 PHE A 98 8.057 -10.441 -8.997 1.00 0.00 H new ATOM 0 HD1 PHE A 98 6.542 -8.345 -11.659 1.00 0.00 H new ATOM 0 HD2 PHE A 98 6.180 -9.820 -7.681 1.00 0.00 H new ATOM 0 HE1 PHE A 98 4.233 -7.510 -11.563 1.00 0.00 H new ATOM 0 HE2 PHE A 98 3.871 -8.988 -7.580 1.00 0.00 H new ATOM 0 HZ PHE A 98 2.893 -7.829 -9.521 1.00 0.00 H new ATOM 1550 N THR A 99 10.958 -9.834 -8.877 1.00 0.00 N ATOM 1551 CA THR A 99 12.285 -10.407 -9.064 1.00 0.00 C ATOM 1552 C THR A 99 12.277 -11.909 -8.807 1.00 0.00 C ATOM 1553 O THR A 99 11.219 -12.513 -8.632 1.00 0.00 O ATOM 1554 CB THR A 99 13.320 -9.744 -8.135 1.00 0.00 C ATOM 1555 OG1 THR A 99 13.489 -10.531 -6.951 1.00 0.00 O ATOM 1556 CG2 THR A 99 12.884 -8.337 -7.756 1.00 0.00 C ATOM 0 H THR A 99 10.534 -10.039 -7.972 1.00 0.00 H new ATOM 0 HA THR A 99 12.566 -10.220 -10.100 1.00 0.00 H new ATOM 0 HB THR A 99 14.268 -9.682 -8.669 1.00 0.00 H new ATOM 0 HG1 THR A 99 12.638 -10.583 -6.468 1.00 0.00 H new ATOM 0 HG21 THR A 99 13.630 -7.889 -7.100 1.00 0.00 H new ATOM 0 HG22 THR A 99 12.783 -7.732 -8.657 1.00 0.00 H new ATOM 0 HG23 THR A 99 11.925 -8.380 -7.239 1.00 0.00 H new ATOM 1564 N ALA A 100 13.464 -12.508 -8.785 1.00 0.00 N ATOM 1565 CA ALA A 100 13.593 -13.940 -8.546 1.00 0.00 C ATOM 1566 C ALA A 100 12.571 -14.420 -7.522 1.00 0.00 C ATOM 1567 O ALA A 100 11.559 -15.025 -7.878 1.00 0.00 O ATOM 1568 CB ALA A 100 15.004 -14.272 -8.083 1.00 0.00 C ATOM 0 H ALA A 100 14.350 -12.023 -8.930 1.00 0.00 H new ATOM 0 HA ALA A 100 13.399 -14.459 -9.484 1.00 0.00 H new ATOM 0 HB1 ALA A 100 15.087 -15.345 -7.908 1.00 0.00 H new ATOM 0 HB2 ALA A 100 15.718 -13.973 -8.850 1.00 0.00 H new ATOM 0 HB3 ALA A 100 15.219 -13.736 -7.159 1.00 0.00 H new ATOM 1574 N SER A 101 12.841 -14.147 -6.250 1.00 0.00 N ATOM 1575 CA SER A 101 11.947 -14.556 -5.173 1.00 0.00 C ATOM 1576 C SER A 101 11.553 -13.361 -4.311 1.00 0.00 C ATOM 1577 O SER A 101 11.164 -13.518 -3.153 1.00 0.00 O ATOM 1578 CB SER A 101 12.612 -15.627 -4.307 1.00 0.00 C ATOM 1579 OG SER A 101 13.976 -15.320 -4.076 1.00 0.00 O ATOM 0 H SER A 101 13.672 -13.644 -5.940 1.00 0.00 H new ATOM 0 HA SER A 101 11.045 -14.972 -5.622 1.00 0.00 H new ATOM 0 HB2 SER A 101 12.087 -15.707 -3.355 1.00 0.00 H new ATOM 0 HB3 SER A 101 12.532 -16.597 -4.797 1.00 0.00 H new ATOM 0 HG SER A 101 14.379 -16.018 -3.519 1.00 0.00 H new ATOM 1585 N ARG A 102 11.656 -12.166 -4.884 1.00 0.00 N ATOM 1586 CA ARG A 102 11.312 -10.943 -4.169 1.00 0.00 C ATOM 1587 C ARG A 102 10.789 -9.880 -5.130 1.00 0.00 C ATOM 1588 O ARG A 102 10.999 -9.966 -6.340 1.00 0.00 O ATOM 1589 CB ARG A 102 12.530 -10.409 -3.414 1.00 0.00 C ATOM 1590 CG ARG A 102 13.520 -9.670 -4.300 1.00 0.00 C ATOM 1591 CD ARG A 102 14.428 -8.763 -3.484 1.00 0.00 C ATOM 1592 NE ARG A 102 15.509 -8.202 -4.291 1.00 0.00 N ATOM 1593 CZ ARG A 102 16.556 -8.905 -4.707 1.00 0.00 C ATOM 1594 NH1 ARG A 102 16.664 -10.189 -4.395 1.00 0.00 N ATOM 1595 NH2 ARG A 102 17.499 -8.323 -5.438 1.00 0.00 N ATOM 0 H ARG A 102 11.975 -12.019 -5.842 1.00 0.00 H new ATOM 0 HA ARG A 102 10.525 -11.179 -3.453 1.00 0.00 H new ATOM 0 HB2 ARG A 102 12.192 -9.739 -2.624 1.00 0.00 H new ATOM 0 HB3 ARG A 102 13.040 -11.241 -2.929 1.00 0.00 H new ATOM 0 HG2 ARG A 102 14.124 -10.390 -4.852 1.00 0.00 H new ATOM 0 HG3 ARG A 102 12.978 -9.077 -5.037 1.00 0.00 H new ATOM 0 HD2 ARG A 102 13.839 -7.953 -3.053 1.00 0.00 H new ATOM 0 HD3 ARG A 102 14.851 -9.327 -2.653 1.00 0.00 H new ATOM 0 HE ARG A 102 15.457 -7.217 -4.549 1.00 0.00 H new ATOM 0 HH11 ARG A 102 15.942 -10.640 -3.834 1.00 0.00 H new ATOM 0 HH12 ARG A 102 17.470 -10.726 -4.716 1.00 0.00 H new ATOM 0 HH21 ARG A 102 17.420 -7.335 -5.680 1.00 0.00 H new ATOM 0 HH22 ARG A 102 18.303 -8.863 -5.757 1.00 0.00 H new ATOM 1609 N ILE A 103 10.108 -8.879 -4.583 1.00 0.00 N ATOM 1610 CA ILE A 103 9.556 -7.799 -5.392 1.00 0.00 C ATOM 1611 C ILE A 103 10.340 -6.507 -5.193 1.00 0.00 C ATOM 1612 O ILE A 103 10.701 -6.155 -4.069 1.00 0.00 O ATOM 1613 CB ILE A 103 8.074 -7.545 -5.056 1.00 0.00 C ATOM 1614 CG1 ILE A 103 7.320 -8.871 -4.943 1.00 0.00 C ATOM 1615 CG2 ILE A 103 7.437 -6.655 -6.113 1.00 0.00 C ATOM 1616 CD1 ILE A 103 6.085 -8.790 -4.073 1.00 0.00 C ATOM 0 H ILE A 103 9.925 -8.793 -3.583 1.00 0.00 H new ATOM 0 HA ILE A 103 9.635 -8.112 -6.433 1.00 0.00 H new ATOM 0 HB ILE A 103 8.016 -7.033 -4.095 1.00 0.00 H new ATOM 0 HG12 ILE A 103 7.031 -9.202 -5.941 1.00 0.00 H new ATOM 0 HG13 ILE A 103 7.991 -9.628 -4.538 1.00 0.00 H new ATOM 0 HG21 ILE A 103 6.390 -6.484 -5.862 1.00 0.00 H new ATOM 0 HG22 ILE A 103 7.962 -5.700 -6.149 1.00 0.00 H new ATOM 0 HG23 ILE A 103 7.502 -7.142 -7.086 1.00 0.00 H new ATOM 0 HD11 ILE A 103 5.600 -9.766 -4.038 1.00 0.00 H new ATOM 0 HD12 ILE A 103 6.369 -8.489 -3.065 1.00 0.00 H new ATOM 0 HD13 ILE A 103 5.394 -8.056 -4.489 1.00 0.00 H new ATOM 1628 N ASP A 104 10.599 -5.803 -6.289 1.00 0.00 N ATOM 1629 CA ASP A 104 11.338 -4.547 -6.235 1.00 0.00 C ATOM 1630 C ASP A 104 10.424 -3.365 -6.543 1.00 0.00 C ATOM 1631 O ASP A 104 9.729 -3.354 -7.559 1.00 0.00 O ATOM 1632 CB ASP A 104 12.506 -4.575 -7.222 1.00 0.00 C ATOM 1633 CG ASP A 104 13.676 -3.729 -6.759 1.00 0.00 C ATOM 1634 OD1 ASP A 104 13.560 -2.486 -6.793 1.00 0.00 O ATOM 1635 OD2 ASP A 104 14.707 -4.310 -6.362 1.00 0.00 O ATOM 0 H ASP A 104 10.308 -6.081 -7.226 1.00 0.00 H new ATOM 0 HA ASP A 104 11.729 -4.427 -5.225 1.00 0.00 H new ATOM 0 HB2 ASP A 104 12.837 -5.604 -7.359 1.00 0.00 H new ATOM 0 HB3 ASP A 104 12.165 -4.218 -8.194 1.00 0.00 H new ATOM 1640 N ILE A 105 10.430 -2.374 -5.658 1.00 0.00 N ATOM 1641 CA ILE A 105 9.602 -1.187 -5.836 1.00 0.00 C ATOM 1642 C ILE A 105 10.404 0.086 -5.589 1.00 0.00 C ATOM 1643 O ILE A 105 10.770 0.390 -4.453 1.00 0.00 O ATOM 1644 CB ILE A 105 8.384 -1.205 -4.893 1.00 0.00 C ATOM 1645 CG1 ILE A 105 7.512 -2.430 -5.173 1.00 0.00 C ATOM 1646 CG2 ILE A 105 7.576 0.074 -5.048 1.00 0.00 C ATOM 1647 CD1 ILE A 105 6.768 -2.933 -3.955 1.00 0.00 C ATOM 0 H ILE A 105 10.998 -2.369 -4.811 1.00 0.00 H new ATOM 0 HA ILE A 105 9.253 -1.198 -6.868 1.00 0.00 H new ATOM 0 HB ILE A 105 8.740 -1.264 -3.865 1.00 0.00 H new ATOM 0 HG12 ILE A 105 6.791 -2.183 -5.952 1.00 0.00 H new ATOM 0 HG13 ILE A 105 8.140 -3.232 -5.562 1.00 0.00 H new ATOM 0 HG21 ILE A 105 6.719 0.047 -4.375 1.00 0.00 H new ATOM 0 HG22 ILE A 105 8.202 0.932 -4.803 1.00 0.00 H new ATOM 0 HG23 ILE A 105 7.227 0.162 -6.077 1.00 0.00 H new ATOM 0 HD11 ILE A 105 6.170 -3.803 -4.227 1.00 0.00 H new ATOM 0 HD12 ILE A 105 7.483 -3.212 -3.181 1.00 0.00 H new ATOM 0 HD13 ILE A 105 6.114 -2.147 -3.578 1.00 0.00 H new ATOM 1659 N CYS A 106 10.673 0.826 -6.658 1.00 0.00 N ATOM 1660 CA CYS A 106 11.432 2.067 -6.558 1.00 0.00 C ATOM 1661 C CYS A 106 10.504 3.253 -6.315 1.00 0.00 C ATOM 1662 O CYS A 106 9.670 3.587 -7.158 1.00 0.00 O ATOM 1663 CB CYS A 106 12.247 2.295 -7.831 1.00 0.00 C ATOM 1664 SG CYS A 106 13.717 3.321 -7.593 1.00 0.00 S ATOM 0 H CYS A 106 10.377 0.588 -7.605 1.00 0.00 H new ATOM 0 HA CYS A 106 12.112 1.981 -5.711 1.00 0.00 H new ATOM 0 HB2 CYS A 106 12.553 1.329 -8.232 1.00 0.00 H new ATOM 0 HB3 CYS A 106 11.608 2.763 -8.580 1.00 0.00 H new ATOM 0 HG CYS A 106 14.341 3.454 -8.726 1.00 0.00 H new ATOM 1670 N LEU A 107 10.652 3.886 -5.156 1.00 0.00 N ATOM 1671 CA LEU A 107 9.826 5.034 -4.800 1.00 0.00 C ATOM 1672 C LEU A 107 10.615 6.333 -4.929 1.00 0.00 C ATOM 1673 O LEU A 107 11.705 6.467 -4.372 1.00 0.00 O ATOM 1674 CB LEU A 107 9.298 4.885 -3.372 1.00 0.00 C ATOM 1675 CG LEU A 107 8.188 3.852 -3.172 1.00 0.00 C ATOM 1676 CD1 LEU A 107 8.236 3.284 -1.762 1.00 0.00 C ATOM 1677 CD2 LEU A 107 6.827 4.471 -3.453 1.00 0.00 C ATOM 0 H LEU A 107 11.337 3.623 -4.447 1.00 0.00 H new ATOM 0 HA LEU A 107 8.983 5.072 -5.490 1.00 0.00 H new ATOM 0 HB2 LEU A 107 10.133 4.622 -2.723 1.00 0.00 H new ATOM 0 HB3 LEU A 107 8.929 5.855 -3.039 1.00 0.00 H new ATOM 0 HG LEU A 107 8.346 3.035 -3.877 1.00 0.00 H new ATOM 0 HD11 LEU A 107 7.439 2.551 -1.638 1.00 0.00 H new ATOM 0 HD12 LEU A 107 9.200 2.804 -1.596 1.00 0.00 H new ATOM 0 HD13 LEU A 107 8.103 4.090 -1.040 1.00 0.00 H new ATOM 0 HD21 LEU A 107 6.049 3.722 -3.306 1.00 0.00 H new ATOM 0 HD22 LEU A 107 6.660 5.306 -2.773 1.00 0.00 H new ATOM 0 HD23 LEU A 107 6.796 4.829 -4.482 1.00 0.00 H new ATOM 1689 N ARG A 108 10.056 7.288 -5.666 1.00 0.00 N ATOM 1690 CA ARG A 108 10.707 8.577 -5.867 1.00 0.00 C ATOM 1691 C ARG A 108 10.110 9.637 -4.946 1.00 0.00 C ATOM 1692 O ARG A 108 8.979 10.081 -5.143 1.00 0.00 O ATOM 1693 CB ARG A 108 10.572 9.019 -7.325 1.00 0.00 C ATOM 1694 CG ARG A 108 10.955 10.471 -7.560 1.00 0.00 C ATOM 1695 CD ARG A 108 12.424 10.715 -7.255 1.00 0.00 C ATOM 1696 NE ARG A 108 13.293 10.234 -8.326 1.00 0.00 N ATOM 1697 CZ ARG A 108 13.511 10.903 -9.453 1.00 0.00 C ATOM 1698 NH1 ARG A 108 12.926 12.076 -9.654 1.00 0.00 N ATOM 1699 NH2 ARG A 108 14.315 10.399 -10.380 1.00 0.00 N ATOM 0 H ARG A 108 9.154 7.193 -6.133 1.00 0.00 H new ATOM 0 HA ARG A 108 11.764 8.463 -5.625 1.00 0.00 H new ATOM 0 HB2 ARG A 108 11.199 8.381 -7.948 1.00 0.00 H new ATOM 0 HB3 ARG A 108 9.542 8.867 -7.648 1.00 0.00 H new ATOM 0 HG2 ARG A 108 10.748 10.740 -8.596 1.00 0.00 H new ATOM 0 HG3 ARG A 108 10.340 11.117 -6.933 1.00 0.00 H new ATOM 0 HD2 ARG A 108 12.591 11.782 -7.105 1.00 0.00 H new ATOM 0 HD3 ARG A 108 12.688 10.216 -6.322 1.00 0.00 H new ATOM 0 HE ARG A 108 13.758 9.335 -8.202 1.00 0.00 H new ATOM 0 HH11 ARG A 108 12.308 12.466 -8.943 1.00 0.00 H new ATOM 0 HH12 ARG A 108 13.095 12.588 -10.520 1.00 0.00 H new ATOM 0 HH21 ARG A 108 14.766 9.497 -10.228 1.00 0.00 H new ATOM 0 HH22 ARG A 108 14.482 10.913 -11.245 1.00 0.00 H new ATOM 1713 N LYS A 109 10.879 10.040 -3.939 1.00 0.00 N ATOM 1714 CA LYS A 109 10.428 11.048 -2.987 1.00 0.00 C ATOM 1715 C LYS A 109 10.405 12.431 -3.630 1.00 0.00 C ATOM 1716 O LYS A 109 11.123 12.688 -4.597 1.00 0.00 O ATOM 1717 CB LYS A 109 11.337 11.060 -1.757 1.00 0.00 C ATOM 1718 CG LYS A 109 11.381 9.733 -1.019 1.00 0.00 C ATOM 1719 CD LYS A 109 12.708 9.535 -0.305 1.00 0.00 C ATOM 1720 CE LYS A 109 12.776 10.346 0.979 1.00 0.00 C ATOM 1721 NZ LYS A 109 13.784 9.799 1.928 1.00 0.00 N ATOM 0 H LYS A 109 11.818 9.683 -3.762 1.00 0.00 H new ATOM 0 HA LYS A 109 9.414 10.793 -2.679 1.00 0.00 H new ATOM 0 HB2 LYS A 109 12.348 11.328 -2.065 1.00 0.00 H new ATOM 0 HB3 LYS A 109 10.996 11.836 -1.072 1.00 0.00 H new ATOM 0 HG2 LYS A 109 10.567 9.691 -0.295 1.00 0.00 H new ATOM 0 HG3 LYS A 109 11.221 8.918 -1.725 1.00 0.00 H new ATOM 0 HD2 LYS A 109 12.845 8.478 -0.077 1.00 0.00 H new ATOM 0 HD3 LYS A 109 13.525 9.827 -0.965 1.00 0.00 H new ATOM 0 HE2 LYS A 109 13.024 11.381 0.742 1.00 0.00 H new ATOM 0 HE3 LYS A 109 11.796 10.354 1.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 13.935 10.476 2.703 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 13.441 8.898 2.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 14.682 9.640 1.427 1.00 0.00 H new ATOM 1735 N ARG A 110 9.579 13.318 -3.085 1.00 0.00 N ATOM 1736 CA ARG A 110 9.464 14.675 -3.606 1.00 0.00 C ATOM 1737 C ARG A 110 10.566 15.568 -3.042 1.00 0.00 C ATOM 1738 O ARG A 110 11.146 16.381 -3.761 1.00 0.00 O ATOM 1739 CB ARG A 110 8.093 15.261 -3.264 1.00 0.00 C ATOM 1740 CG ARG A 110 7.015 14.920 -4.279 1.00 0.00 C ATOM 1741 CD ARG A 110 5.761 15.753 -4.062 1.00 0.00 C ATOM 1742 NE ARG A 110 5.041 15.995 -5.309 1.00 0.00 N ATOM 1743 CZ ARG A 110 3.742 16.265 -5.367 1.00 0.00 C ATOM 1744 NH1 ARG A 110 3.024 16.327 -4.255 1.00 0.00 N ATOM 1745 NH2 ARG A 110 3.158 16.474 -6.541 1.00 0.00 N ATOM 0 H ARG A 110 8.980 13.122 -2.283 1.00 0.00 H new ATOM 0 HA ARG A 110 9.573 14.632 -4.690 1.00 0.00 H new ATOM 0 HB2 ARG A 110 7.786 14.896 -2.284 1.00 0.00 H new ATOM 0 HB3 ARG A 110 8.179 16.345 -3.188 1.00 0.00 H new ATOM 0 HG2 ARG A 110 7.396 15.089 -5.286 1.00 0.00 H new ATOM 0 HG3 ARG A 110 6.767 13.861 -4.206 1.00 0.00 H new ATOM 0 HD2 ARG A 110 5.104 15.242 -3.358 1.00 0.00 H new ATOM 0 HD3 ARG A 110 6.033 16.707 -3.610 1.00 0.00 H new ATOM 0 HE ARG A 110 5.564 15.954 -6.184 1.00 0.00 H new ATOM 0 HH11 ARG A 110 3.469 16.167 -3.351 1.00 0.00 H new ATOM 0 HH12 ARG A 110 2.027 16.535 -4.303 1.00 0.00 H new ATOM 0 HH21 ARG A 110 3.707 16.427 -7.399 1.00 0.00 H new ATOM 0 HH22 ARG A 110 2.160 16.681 -6.585 1.00 0.00 H new ATOM 1759 N GLN A 111 10.846 15.412 -1.752 1.00 0.00 N ATOM 1760 CA GLN A 111 11.876 16.205 -1.093 1.00 0.00 C ATOM 1761 C GLN A 111 12.847 15.310 -0.330 1.00 0.00 C ATOM 1762 O GLN A 111 12.435 14.383 0.367 1.00 0.00 O ATOM 1763 CB GLN A 111 11.238 17.216 -0.138 1.00 0.00 C ATOM 1764 CG GLN A 111 10.371 18.250 -0.838 1.00 0.00 C ATOM 1765 CD GLN A 111 9.909 19.352 0.095 1.00 0.00 C ATOM 1766 OE1 GLN A 111 8.805 19.300 0.637 1.00 0.00 O ATOM 1767 NE2 GLN A 111 10.755 20.358 0.288 1.00 0.00 N ATOM 0 H GLN A 111 10.374 14.744 -1.143 1.00 0.00 H new ATOM 0 HA GLN A 111 12.432 16.742 -1.861 1.00 0.00 H new ATOM 0 HB2 GLN A 111 10.632 16.681 0.593 1.00 0.00 H new ATOM 0 HB3 GLN A 111 12.025 17.728 0.415 1.00 0.00 H new ATOM 0 HG2 GLN A 111 10.931 18.689 -1.664 1.00 0.00 H new ATOM 0 HG3 GLN A 111 9.501 17.756 -1.270 1.00 0.00 H new ATOM 0 HE21 GLN A 111 11.660 20.360 -0.182 1.00 0.00 H new ATOM 0 HE22 GLN A 111 10.499 21.128 0.906 1.00 0.00 H new ATOM 1776 N SER A 112 14.139 15.594 -0.468 1.00 0.00 N ATOM 1777 CA SER A 112 15.169 14.812 0.205 1.00 0.00 C ATOM 1778 C SER A 112 15.169 15.089 1.705 1.00 0.00 C ATOM 1779 O SER A 112 16.017 15.825 2.210 1.00 0.00 O ATOM 1780 CB SER A 112 16.545 15.128 -0.384 1.00 0.00 C ATOM 1781 OG SER A 112 17.563 14.393 0.273 1.00 0.00 O ATOM 0 H SER A 112 14.496 16.359 -1.040 1.00 0.00 H new ATOM 0 HA SER A 112 14.949 13.756 0.049 1.00 0.00 H new ATOM 0 HB2 SER A 112 16.551 14.892 -1.448 1.00 0.00 H new ATOM 0 HB3 SER A 112 16.746 16.195 -0.293 1.00 0.00 H new ATOM 0 HG SER A 112 18.432 14.612 -0.123 1.00 0.00 H new ATOM 1787 N GLN A 113 14.212 14.495 2.410 1.00 0.00 N ATOM 1788 CA GLN A 113 14.100 14.679 3.852 1.00 0.00 C ATOM 1789 C GLN A 113 14.030 13.335 4.568 1.00 0.00 C ATOM 1790 O GLN A 113 13.801 12.299 3.943 1.00 0.00 O ATOM 1791 CB GLN A 113 12.863 15.514 4.187 1.00 0.00 C ATOM 1792 CG GLN A 113 11.561 14.892 3.709 1.00 0.00 C ATOM 1793 CD GLN A 113 10.351 15.741 4.043 1.00 0.00 C ATOM 1794 OE1 GLN A 113 9.795 16.418 3.178 1.00 0.00 O ATOM 1795 NE2 GLN A 113 9.935 15.710 5.304 1.00 0.00 N ATOM 0 H GLN A 113 13.503 13.882 2.006 1.00 0.00 H new ATOM 0 HA GLN A 113 14.989 15.207 4.195 1.00 0.00 H new ATOM 0 HB2 GLN A 113 12.813 15.657 5.266 1.00 0.00 H new ATOM 0 HB3 GLN A 113 12.970 16.502 3.739 1.00 0.00 H new ATOM 0 HG2 GLN A 113 11.609 14.743 2.630 1.00 0.00 H new ATOM 0 HG3 GLN A 113 11.445 13.907 4.162 1.00 0.00 H new ATOM 0 HE21 GLN A 113 10.425 15.135 5.989 1.00 0.00 H new ATOM 0 HE22 GLN A 113 9.125 16.261 5.588 1.00 0.00 H new ATOM 1804 N ARG A 114 14.227 13.359 5.882 1.00 0.00 N ATOM 1805 CA ARG A 114 14.188 12.141 6.683 1.00 0.00 C ATOM 1806 C ARG A 114 12.754 11.646 6.849 1.00 0.00 C ATOM 1807 O ARG A 114 11.849 12.424 7.150 1.00 0.00 O ATOM 1808 CB ARG A 114 14.816 12.388 8.056 1.00 0.00 C ATOM 1809 CG ARG A 114 15.086 11.114 8.840 1.00 0.00 C ATOM 1810 CD ARG A 114 15.143 11.382 10.336 1.00 0.00 C ATOM 1811 NE ARG A 114 14.992 10.157 11.117 1.00 0.00 N ATOM 1812 CZ ARG A 114 15.935 9.227 11.216 1.00 0.00 C ATOM 1813 NH1 ARG A 114 17.092 9.382 10.587 1.00 0.00 N ATOM 1814 NH2 ARG A 114 15.723 8.140 11.947 1.00 0.00 N ATOM 0 H ARG A 114 14.415 14.208 6.415 1.00 0.00 H new ATOM 0 HA ARG A 114 14.761 11.374 6.162 1.00 0.00 H new ATOM 0 HB2 ARG A 114 15.753 12.930 7.926 1.00 0.00 H new ATOM 0 HB3 ARG A 114 14.155 13.030 8.638 1.00 0.00 H new ATOM 0 HG2 ARG A 114 14.305 10.384 8.630 1.00 0.00 H new ATOM 0 HG3 ARG A 114 16.029 10.676 8.511 1.00 0.00 H new ATOM 0 HD2 ARG A 114 16.093 11.855 10.584 1.00 0.00 H new ATOM 0 HD3 ARG A 114 14.356 12.085 10.609 1.00 0.00 H new ATOM 0 HE ARG A 114 14.114 10.008 11.614 1.00 0.00 H new ATOM 0 HH11 ARG A 114 17.259 10.217 10.026 1.00 0.00 H new ATOM 0 HH12 ARG A 114 17.815 8.666 10.665 1.00 0.00 H new ATOM 0 HH21 ARG A 114 14.835 8.018 12.434 1.00 0.00 H new ATOM 0 HH22 ARG A 114 16.448 7.427 12.022 1.00 0.00 H new ATOM 1828 N TRP A 115 12.556 10.348 6.651 1.00 0.00 N ATOM 1829 CA TRP A 115 11.232 9.749 6.778 1.00 0.00 C ATOM 1830 C TRP A 115 11.037 9.149 8.166 1.00 0.00 C ATOM 1831 O TRP A 115 9.923 9.114 8.687 1.00 0.00 O ATOM 1832 CB TRP A 115 11.032 8.672 5.711 1.00 0.00 C ATOM 1833 CG TRP A 115 10.441 9.199 4.438 1.00 0.00 C ATOM 1834 CD1 TRP A 115 10.484 10.487 3.987 1.00 0.00 C ATOM 1835 CD2 TRP A 115 9.718 8.451 3.455 1.00 0.00 C ATOM 1836 NE1 TRP A 115 9.831 10.585 2.782 1.00 0.00 N ATOM 1837 CE2 TRP A 115 9.353 9.349 2.433 1.00 0.00 C ATOM 1838 CE3 TRP A 115 9.346 7.109 3.336 1.00 0.00 C ATOM 1839 CZ2 TRP A 115 8.633 8.948 1.311 1.00 0.00 C ATOM 1840 CZ3 TRP A 115 8.631 6.712 2.222 1.00 0.00 C ATOM 1841 CH2 TRP A 115 8.281 7.628 1.221 1.00 0.00 C ATOM 0 H TRP A 115 13.295 9.690 6.402 1.00 0.00 H new ATOM 0 HA TRP A 115 10.490 10.535 6.634 1.00 0.00 H new ATOM 0 HB2 TRP A 115 11.992 8.206 5.491 1.00 0.00 H new ATOM 0 HB3 TRP A 115 10.383 7.892 6.109 1.00 0.00 H new ATOM 0 HD1 TRP A 115 10.961 11.308 4.502 1.00 0.00 H new ATOM 0 HE1 TRP A 115 9.720 11.439 2.236 1.00 0.00 H new ATOM 0 HE3 TRP A 115 9.613 6.395 4.101 1.00 0.00 H new ATOM 0 HZ2 TRP A 115 8.362 9.653 0.539 1.00 0.00 H new ATOM 0 HZ3 TRP A 115 8.337 5.678 2.121 1.00 0.00 H new ATOM 0 HH2 TRP A 115 7.723 7.286 0.362 1.00 0.00 H new ATOM 1852 N GLY A 116 12.128 8.678 8.762 1.00 0.00 N ATOM 1853 CA GLY A 116 12.055 8.086 10.085 1.00 0.00 C ATOM 1854 C GLY A 116 11.385 6.726 10.075 1.00 0.00 C ATOM 1855 O GLY A 116 11.282 6.070 11.110 1.00 0.00 O ATOM 0 H GLY A 116 13.062 8.696 8.352 1.00 0.00 H new ATOM 0 HA2 GLY A 116 13.061 7.989 10.492 1.00 0.00 H new ATOM 0 HA3 GLY A 116 11.505 8.754 10.749 1.00 0.00 H new ATOM 1859 N GLY A 117 10.927 6.302 8.901 1.00 0.00 N ATOM 1860 CA GLY A 117 10.267 5.014 8.783 1.00 0.00 C ATOM 1861 C GLY A 117 9.365 4.934 7.568 1.00 0.00 C ATOM 1862 O GLY A 117 8.525 5.808 7.351 1.00 0.00 O ATOM 0 H GLY A 117 11.001 6.827 8.030 1.00 0.00 H new ATOM 0 HA2 GLY A 117 11.020 4.228 8.725 1.00 0.00 H new ATOM 0 HA3 GLY A 117 9.679 4.827 9.681 1.00 0.00 H new ATOM 1866 N LEU A 118 9.538 3.885 6.773 1.00 0.00 N ATOM 1867 CA LEU A 118 8.733 3.694 5.571 1.00 0.00 C ATOM 1868 C LEU A 118 7.255 3.934 5.862 1.00 0.00 C ATOM 1869 O LEU A 118 6.641 4.840 5.299 1.00 0.00 O ATOM 1870 CB LEU A 118 8.933 2.282 5.018 1.00 0.00 C ATOM 1871 CG LEU A 118 8.184 1.955 3.726 1.00 0.00 C ATOM 1872 CD1 LEU A 118 8.808 2.687 2.547 1.00 0.00 C ATOM 1873 CD2 LEU A 118 8.176 0.453 3.479 1.00 0.00 C ATOM 0 H LEU A 118 10.229 3.153 6.938 1.00 0.00 H new ATOM 0 HA LEU A 118 9.060 4.419 4.826 1.00 0.00 H new ATOM 0 HB2 LEU A 118 9.998 2.128 4.846 1.00 0.00 H new ATOM 0 HB3 LEU A 118 8.628 1.567 5.782 1.00 0.00 H new ATOM 0 HG LEU A 118 7.153 2.291 3.832 1.00 0.00 H new ATOM 0 HD11 LEU A 118 8.262 2.442 1.636 1.00 0.00 H new ATOM 0 HD12 LEU A 118 8.761 3.762 2.720 1.00 0.00 H new ATOM 0 HD13 LEU A 118 9.849 2.382 2.439 1.00 0.00 H new ATOM 0 HD21 LEU A 118 7.639 0.239 2.555 1.00 0.00 H new ATOM 0 HD22 LEU A 118 9.201 0.093 3.394 1.00 0.00 H new ATOM 0 HD23 LEU A 118 7.682 -0.050 4.311 1.00 0.00 H new ATOM 1885 N GLU A 119 6.691 3.118 6.746 1.00 0.00 N ATOM 1886 CA GLU A 119 5.285 3.243 7.113 1.00 0.00 C ATOM 1887 C GLU A 119 5.107 4.241 8.253 1.00 0.00 C ATOM 1888 O GLU A 119 5.988 4.399 9.097 1.00 0.00 O ATOM 1889 CB GLU A 119 4.717 1.881 7.519 1.00 0.00 C ATOM 1890 CG GLU A 119 5.079 0.760 6.559 1.00 0.00 C ATOM 1891 CD GLU A 119 4.993 -0.610 7.203 1.00 0.00 C ATOM 1892 OE1 GLU A 119 3.863 -1.075 7.458 1.00 0.00 O ATOM 1893 OE2 GLU A 119 6.056 -1.217 7.451 1.00 0.00 O ATOM 0 H GLU A 119 7.186 2.363 7.222 1.00 0.00 H new ATOM 0 HA GLU A 119 4.741 3.610 6.243 1.00 0.00 H new ATOM 0 HB2 GLU A 119 5.081 1.627 8.515 1.00 0.00 H new ATOM 0 HB3 GLU A 119 3.632 1.955 7.586 1.00 0.00 H new ATOM 0 HG2 GLU A 119 4.412 0.795 5.698 1.00 0.00 H new ATOM 0 HG3 GLU A 119 6.091 0.919 6.186 1.00 0.00 H new ATOM 1900 N ALA A 120 3.960 4.912 8.270 1.00 0.00 N ATOM 1901 CA ALA A 120 3.665 5.894 9.307 1.00 0.00 C ATOM 1902 C ALA A 120 3.494 5.223 10.665 1.00 0.00 C ATOM 1903 O ALA A 120 3.171 4.039 10.764 1.00 0.00 O ATOM 1904 CB ALA A 120 2.416 6.684 8.945 1.00 0.00 C ATOM 0 H ALA A 120 3.220 4.794 7.578 1.00 0.00 H new ATOM 0 HA ALA A 120 4.509 6.580 9.374 1.00 0.00 H new ATOM 0 HB1 ALA A 120 2.207 7.413 9.728 1.00 0.00 H new ATOM 0 HB2 ALA A 120 2.575 7.202 7.999 1.00 0.00 H new ATOM 0 HB3 ALA A 120 1.570 6.003 8.849 1.00 0.00 H new ATOM 1910 N PRO A 121 3.714 5.995 11.740 1.00 0.00 N ATOM 1911 CA PRO A 121 3.590 5.496 13.112 1.00 0.00 C ATOM 1912 C PRO A 121 2.143 5.207 13.495 1.00 0.00 C ATOM 1913 O PRO A 121 1.238 5.321 12.670 1.00 0.00 O ATOM 1914 CB PRO A 121 4.149 6.642 13.959 1.00 0.00 C ATOM 1915 CG PRO A 121 3.949 7.861 13.125 1.00 0.00 C ATOM 1916 CD PRO A 121 4.102 7.415 11.697 1.00 0.00 C ATOM 0 HA PRO A 121 4.115 4.551 13.251 1.00 0.00 H new ATOM 0 HB2 PRO A 121 3.625 6.723 14.911 1.00 0.00 H new ATOM 0 HB3 PRO A 121 5.203 6.487 14.188 1.00 0.00 H new ATOM 0 HG2 PRO A 121 2.963 8.293 13.295 1.00 0.00 H new ATOM 0 HG3 PRO A 121 4.681 8.629 13.375 1.00 0.00 H new ATOM 0 HD2 PRO A 121 3.460 7.987 11.026 1.00 0.00 H new ATOM 0 HD3 PRO A 121 5.125 7.541 11.344 1.00 0.00 H new ATOM 1924 N ALA A 122 1.932 4.833 14.753 1.00 0.00 N ATOM 1925 CA ALA A 122 0.594 4.530 15.246 1.00 0.00 C ATOM 1926 C ALA A 122 -0.016 3.354 14.491 1.00 0.00 C ATOM 1927 O ALA A 122 -1.168 3.410 14.062 1.00 0.00 O ATOM 1928 CB ALA A 122 -0.301 5.755 15.130 1.00 0.00 C ATOM 0 H ALA A 122 2.671 4.733 15.449 1.00 0.00 H new ATOM 0 HA ALA A 122 0.675 4.251 16.296 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -1.297 5.514 15.502 1.00 0.00 H new ATOM 0 HB2 ALA A 122 0.119 6.570 15.720 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -0.367 6.060 14.086 1.00 0.00 H new ATOM 1934 N ALA A 123 0.764 2.290 14.333 1.00 0.00 N ATOM 1935 CA ALA A 123 0.300 1.100 13.631 1.00 0.00 C ATOM 1936 C ALA A 123 -0.579 0.238 14.533 1.00 0.00 C ATOM 1937 O ALA A 123 -0.183 -0.120 15.642 1.00 0.00 O ATOM 1938 CB ALA A 123 1.484 0.293 13.119 1.00 0.00 C ATOM 0 H ALA A 123 1.720 2.228 14.682 1.00 0.00 H new ATOM 0 HA ALA A 123 -0.301 1.422 12.781 1.00 0.00 H new ATOM 0 HB1 ALA A 123 1.122 -0.593 12.597 1.00 0.00 H new ATOM 0 HB2 ALA A 123 2.071 0.904 12.433 1.00 0.00 H new ATOM 0 HB3 ALA A 123 2.108 -0.011 13.960 1.00 0.00 H new ATOM 1944 N ARG A 124 -1.772 -0.090 14.049 1.00 0.00 N ATOM 1945 CA ARG A 124 -2.707 -0.907 14.813 1.00 0.00 C ATOM 1946 C ARG A 124 -2.015 -2.147 15.371 1.00 0.00 C ATOM 1947 O ARG A 124 -1.329 -2.867 14.646 1.00 0.00 O ATOM 1948 CB ARG A 124 -3.890 -1.322 13.935 1.00 0.00 C ATOM 1949 CG ARG A 124 -4.993 -2.037 14.698 1.00 0.00 C ATOM 1950 CD ARG A 124 -4.766 -3.541 14.724 1.00 0.00 C ATOM 1951 NE ARG A 124 -5.493 -4.185 15.815 1.00 0.00 N ATOM 1952 CZ ARG A 124 -5.490 -5.496 16.028 1.00 0.00 C ATOM 1953 NH1 ARG A 124 -4.800 -6.298 15.229 1.00 0.00 N ATOM 1954 NH2 ARG A 124 -6.176 -6.007 17.042 1.00 0.00 N ATOM 0 H ARG A 124 -2.114 0.197 13.132 1.00 0.00 H new ATOM 0 HA ARG A 124 -3.074 -0.310 15.648 1.00 0.00 H new ATOM 0 HB2 ARG A 124 -4.306 -0.435 13.458 1.00 0.00 H new ATOM 0 HB3 ARG A 124 -3.530 -1.973 13.139 1.00 0.00 H new ATOM 0 HG2 ARG A 124 -5.037 -1.657 15.719 1.00 0.00 H new ATOM 0 HG3 ARG A 124 -5.956 -1.821 14.236 1.00 0.00 H new ATOM 0 HD2 ARG A 124 -5.082 -3.972 13.774 1.00 0.00 H new ATOM 0 HD3 ARG A 124 -3.700 -3.745 14.828 1.00 0.00 H new ATOM 0 HE ARG A 124 -6.033 -3.595 16.448 1.00 0.00 H new ATOM 0 HH11 ARG A 124 -4.270 -5.908 14.449 1.00 0.00 H new ATOM 0 HH12 ARG A 124 -4.799 -7.305 15.394 1.00 0.00 H new ATOM 0 HH21 ARG A 124 -6.707 -5.393 17.660 1.00 0.00 H new ATOM 0 HH22 ARG A 124 -6.173 -7.014 17.204 1.00 0.00 H new ATOM 1968 N VAL A 125 -2.200 -2.390 16.665 1.00 0.00 N ATOM 1969 CA VAL A 125 -1.594 -3.542 17.321 1.00 0.00 C ATOM 1970 C VAL A 125 -2.642 -4.368 18.060 1.00 0.00 C ATOM 1971 O VAL A 125 -3.772 -3.924 18.255 1.00 0.00 O ATOM 1972 CB VAL A 125 -0.501 -3.111 18.316 1.00 0.00 C ATOM 1973 CG1 VAL A 125 0.621 -2.381 17.594 1.00 0.00 C ATOM 1974 CG2 VAL A 125 -1.094 -2.242 19.415 1.00 0.00 C ATOM 0 H VAL A 125 -2.765 -1.804 17.280 1.00 0.00 H new ATOM 0 HA VAL A 125 -1.142 -4.150 16.538 1.00 0.00 H new ATOM 0 HB VAL A 125 -0.082 -4.005 18.778 1.00 0.00 H new ATOM 0 HG11 VAL A 125 1.384 -2.084 18.314 1.00 0.00 H new ATOM 0 HG12 VAL A 125 1.063 -3.041 16.848 1.00 0.00 H new ATOM 0 HG13 VAL A 125 0.221 -1.494 17.103 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -0.307 -1.946 20.109 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -1.541 -1.352 18.973 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -1.859 -2.804 19.951 1.00 0.00 H new ATOM 1984 N GLY A 126 -2.257 -5.573 18.469 1.00 0.00 N ATOM 1985 CA GLY A 126 -3.174 -6.442 19.183 1.00 0.00 C ATOM 1986 C GLY A 126 -2.458 -7.530 19.958 1.00 0.00 C ATOM 1987 O GLY A 126 -1.235 -7.509 20.084 1.00 0.00 O ATOM 0 H GLY A 126 -1.327 -5.963 18.319 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -3.774 -5.846 19.870 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -3.863 -6.899 18.473 1.00 0.00 H new ATOM 1991 N GLY A 127 -3.223 -8.484 20.481 1.00 0.00 N ATOM 1992 CA GLY A 127 -2.637 -9.571 21.242 1.00 0.00 C ATOM 1993 C GLY A 127 -3.402 -9.864 22.518 1.00 0.00 C ATOM 1994 O GLY A 127 -4.269 -10.737 22.542 1.00 0.00 O ATOM 0 H GLY A 127 -4.238 -8.523 20.391 1.00 0.00 H new ATOM 0 HA2 GLY A 127 -2.609 -10.469 20.625 1.00 0.00 H new ATOM 0 HA3 GLY A 127 -1.605 -9.322 21.490 1.00 0.00 H new ATOM 1998 N ALA A 128 -3.080 -9.134 23.580 1.00 0.00 N ATOM 1999 CA ALA A 128 -3.744 -9.320 24.865 1.00 0.00 C ATOM 2000 C ALA A 128 -5.041 -8.520 24.933 1.00 0.00 C ATOM 2001 O ALA A 128 -5.306 -7.675 24.079 1.00 0.00 O ATOM 2002 CB ALA A 128 -2.815 -8.920 26.002 1.00 0.00 C ATOM 0 H ALA A 128 -2.363 -8.408 23.577 1.00 0.00 H new ATOM 0 HA ALA A 128 -3.993 -10.376 24.968 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -3.324 -9.064 26.955 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -1.917 -9.538 25.973 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -2.538 -7.871 25.893 1.00 0.00 H new ATOM 2008 N SER A 129 -5.846 -8.794 25.955 1.00 0.00 N ATOM 2009 CA SER A 129 -7.118 -8.104 26.132 1.00 0.00 C ATOM 2010 C SER A 129 -7.709 -8.398 27.507 1.00 0.00 C ATOM 2011 O SER A 129 -7.872 -9.556 27.890 1.00 0.00 O ATOM 2012 CB SER A 129 -8.105 -8.520 25.040 1.00 0.00 C ATOM 2013 OG SER A 129 -7.971 -7.701 23.892 1.00 0.00 O ATOM 0 H SER A 129 -5.640 -9.489 26.673 1.00 0.00 H new ATOM 0 HA SER A 129 -6.935 -7.032 26.056 1.00 0.00 H new ATOM 0 HB2 SER A 129 -7.934 -9.562 24.769 1.00 0.00 H new ATOM 0 HB3 SER A 129 -9.124 -8.453 25.422 1.00 0.00 H new ATOM 0 HG SER A 129 -7.040 -7.407 23.807 1.00 0.00 H new ATOM 2019 N GLY A 130 -8.028 -7.341 28.247 1.00 0.00 N ATOM 2020 CA GLY A 130 -8.598 -7.506 29.571 1.00 0.00 C ATOM 2021 C GLY A 130 -10.042 -7.964 29.528 1.00 0.00 C ATOM 2022 O GLY A 130 -10.533 -8.447 28.508 1.00 0.00 O ATOM 0 H GLY A 130 -7.902 -6.373 27.953 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -8.007 -8.231 30.130 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -8.536 -6.561 30.110 1.00 0.00 H new ATOM 2026 N PRO A 131 -10.748 -7.814 30.659 1.00 0.00 N ATOM 2027 CA PRO A 131 -12.155 -8.211 30.772 1.00 0.00 C ATOM 2028 C PRO A 131 -13.079 -7.310 29.961 1.00 0.00 C ATOM 2029 O PRO A 131 -13.989 -7.787 29.284 1.00 0.00 O ATOM 2030 CB PRO A 131 -12.445 -8.066 32.268 1.00 0.00 C ATOM 2031 CG PRO A 131 -11.464 -7.053 32.748 1.00 0.00 C ATOM 2032 CD PRO A 131 -10.228 -7.246 31.914 1.00 0.00 C ATOM 0 HA PRO A 131 -12.327 -9.215 30.385 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -13.470 -7.738 32.443 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -12.321 -9.015 32.789 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -11.858 -6.043 32.634 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -11.246 -7.192 33.807 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -9.707 -6.304 31.743 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -9.519 -7.919 32.396 1.00 0.00 H new ATOM 2040 N SER A 132 -12.838 -6.005 30.034 1.00 0.00 N ATOM 2041 CA SER A 132 -13.651 -5.036 29.308 1.00 0.00 C ATOM 2042 C SER A 132 -15.119 -5.150 29.709 1.00 0.00 C ATOM 2043 O SER A 132 -16.010 -5.114 28.860 1.00 0.00 O ATOM 2044 CB SER A 132 -13.505 -5.244 27.799 1.00 0.00 C ATOM 2045 OG SER A 132 -13.844 -4.067 27.087 1.00 0.00 O ATOM 0 H SER A 132 -12.087 -5.594 30.588 1.00 0.00 H new ATOM 0 HA SER A 132 -13.298 -4.037 29.565 1.00 0.00 H new ATOM 0 HB2 SER A 132 -12.480 -5.531 27.566 1.00 0.00 H new ATOM 0 HB3 SER A 132 -14.147 -6.065 27.478 1.00 0.00 H new ATOM 0 HG SER A 132 -14.766 -3.810 27.300 1.00 0.00 H new ATOM 2051 N SER A 133 -15.362 -5.288 31.008 1.00 0.00 N ATOM 2052 CA SER A 133 -16.721 -5.411 31.523 1.00 0.00 C ATOM 2053 C SER A 133 -17.596 -6.209 30.560 1.00 0.00 C ATOM 2054 O SER A 133 -18.676 -5.765 30.173 1.00 0.00 O ATOM 2055 CB SER A 133 -17.328 -4.026 31.754 1.00 0.00 C ATOM 2056 OG SER A 133 -18.540 -4.117 32.484 1.00 0.00 O ATOM 0 H SER A 133 -14.636 -5.317 31.724 1.00 0.00 H new ATOM 0 HA SER A 133 -16.677 -5.944 32.473 1.00 0.00 H new ATOM 0 HB2 SER A 133 -16.619 -3.400 32.296 1.00 0.00 H new ATOM 0 HB3 SER A 133 -17.512 -3.541 30.795 1.00 0.00 H new ATOM 0 HG SER A 133 -19.198 -4.624 31.964 1.00 0.00 H new ATOM 2062 N GLY A 134 -17.120 -7.390 30.178 1.00 0.00 N ATOM 2063 CA GLY A 134 -17.870 -8.232 29.264 1.00 0.00 C ATOM 2064 C GLY A 134 -18.489 -7.444 28.126 1.00 0.00 C ATOM 2065 O GLY A 134 -18.078 -7.579 26.974 1.00 0.00 O ATOM 0 H GLY A 134 -16.228 -7.779 30.485 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -17.210 -8.997 28.855 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -18.656 -8.749 29.814 1.00 0.00 H new TER 2069 GLY A 134