USER MOD reduce.3.24.130724 H: found=0, std=0, add=757, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 759 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 53 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 107 HIS : no HD1:sc= -0.0365 X(o=-0.036,f=0) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 ASN : amide:sc= 0.016 K(o=0.016,f=-3.3!) USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -0.991 K(o=-0.99,f=-4.4!) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 71 SER OG : rot 170:sc= 0.33 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 75 GLN : amide:sc= -0.0391 X(o=-0.039,f=-0.039) USER MOD Single : A 76 THR OG1 : rot 43:sc= 0.0214 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 GLN : amide:sc= 0.941 K(o=0.94,f=-4.5!) USER MOD Single : A 102 ASN : amide:sc= 1.07 K(o=1.1,f=-0.3) USER MOD Single : A 108 MET CE :methyl 149:sc= -4.18! (180deg=-5.94!) USER MOD Single : A 109 SER OG : rot -150:sc= 0.672 USER MOD Single : A 116 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 118 SER OG : rot 88:sc= 0.993 USER MOD Single : A 120 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 TYR OH : rot -11:sc= 0.859 USER MOD Single : A 127 SER OG : rot 180:sc=-0.00475 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 SER OG : rot -112:sc= 0.174 USER MOD Single : A 145 THR OG1 : rot -58:sc= 0.436 USER MOD ----------------------------------------------------------------- ATOM 48 N THR A 36 0.773 -6.137 9.125 1.00 0.00 N ATOM 49 CA THR A 36 -0.571 -6.245 8.524 1.00 0.00 C ATOM 50 C THR A 36 -0.963 -4.965 7.786 1.00 0.00 C ATOM 51 O THR A 36 -0.458 -3.878 8.086 1.00 0.00 O ATOM 52 CB THR A 36 -1.626 -6.691 9.550 1.00 0.00 C ATOM 53 OG1 THR A 36 -2.843 -6.945 8.881 1.00 0.00 O ATOM 54 CG2 THR A 36 -1.877 -5.672 10.664 1.00 0.00 C ATOM 0 HA THR A 36 -0.530 -7.033 7.772 1.00 0.00 H new ATOM 0 HB THR A 36 -1.233 -7.588 10.028 1.00 0.00 H new ATOM 0 HG1 THR A 36 -3.519 -7.231 9.530 1.00 0.00 H new ATOM 0 HG21 THR A 36 -2.633 -6.059 11.347 1.00 0.00 H new ATOM 0 HG22 THR A 36 -0.951 -5.495 11.210 1.00 0.00 H new ATOM 0 HG23 THR A 36 -2.226 -4.736 10.229 1.00 0.00 H new ATOM 62 N PHE A 37 -1.829 -5.117 6.778 1.00 0.00 N ATOM 63 CA PHE A 37 -2.188 -4.080 5.800 1.00 0.00 C ATOM 64 C PHE A 37 -3.706 -3.869 5.766 1.00 0.00 C ATOM 65 O PHE A 37 -4.481 -4.827 5.760 1.00 0.00 O ATOM 66 CB PHE A 37 -1.682 -4.447 4.387 1.00 0.00 C ATOM 67 CG PHE A 37 -0.313 -5.103 4.317 1.00 0.00 C ATOM 68 CD1 PHE A 37 0.724 -4.686 5.169 1.00 0.00 C ATOM 69 CD2 PHE A 37 -0.103 -6.188 3.446 1.00 0.00 C ATOM 70 CE1 PHE A 37 1.913 -5.428 5.255 1.00 0.00 C ATOM 71 CE2 PHE A 37 1.107 -6.903 3.493 1.00 0.00 C ATOM 72 CZ PHE A 37 2.104 -6.539 4.416 1.00 0.00 C ATOM 0 H PHE A 37 -2.318 -5.997 6.614 1.00 0.00 H new ATOM 0 HA PHE A 37 -1.706 -3.153 6.112 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -2.408 -5.117 3.926 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -1.659 -3.539 3.784 1.00 0.00 H new ATOM 0 HD1 PHE A 37 0.606 -3.790 5.761 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -0.871 -6.472 2.742 1.00 0.00 H new ATOM 0 HE1 PHE A 37 2.678 -5.146 5.963 1.00 0.00 H new ATOM 0 HE2 PHE A 37 1.271 -7.732 2.820 1.00 0.00 H new ATOM 0 HZ PHE A 37 3.016 -7.113 4.480 1.00 0.00 H new ATOM 82 N SER A 38 -4.136 -2.612 5.726 1.00 0.00 N ATOM 83 CA SER A 38 -5.560 -2.236 5.639 1.00 0.00 C ATOM 84 C SER A 38 -5.850 -1.025 4.719 1.00 0.00 C ATOM 85 O SER A 38 -4.962 -0.196 4.491 1.00 0.00 O ATOM 86 CB SER A 38 -6.139 -2.027 7.050 1.00 0.00 C ATOM 87 OG SER A 38 -5.554 -0.918 7.721 1.00 0.00 O ATOM 0 H SER A 38 -3.506 -1.810 5.753 1.00 0.00 H new ATOM 0 HA SER A 38 -6.067 -3.073 5.158 1.00 0.00 H new ATOM 0 HB2 SER A 38 -7.216 -1.877 6.978 1.00 0.00 H new ATOM 0 HB3 SER A 38 -5.981 -2.929 7.641 1.00 0.00 H new ATOM 0 HG SER A 38 -5.955 -0.825 8.610 1.00 0.00 H new ATOM 93 N PRO A 39 -7.089 -0.879 4.199 1.00 0.00 N ATOM 94 CA PRO A 39 -8.164 -1.873 4.213 1.00 0.00 C ATOM 95 C PRO A 39 -7.841 -3.041 3.273 1.00 0.00 C ATOM 96 O PRO A 39 -7.027 -2.910 2.359 1.00 0.00 O ATOM 97 CB PRO A 39 -9.415 -1.125 3.742 1.00 0.00 C ATOM 98 CG PRO A 39 -8.842 -0.082 2.787 1.00 0.00 C ATOM 99 CD PRO A 39 -7.517 0.297 3.449 1.00 0.00 C ATOM 0 HA PRO A 39 -8.301 -2.305 5.204 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -10.119 -1.789 3.241 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -9.948 -0.664 4.573 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -8.692 -0.489 1.787 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -9.503 0.779 2.685 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -6.773 0.575 2.702 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -7.642 1.156 4.109 1.00 0.00 H new ATOM 107 N ALA A 40 -8.509 -4.181 3.476 1.00 0.00 N ATOM 108 CA ALA A 40 -8.423 -5.321 2.555 1.00 0.00 C ATOM 109 C ALA A 40 -8.906 -4.970 1.131 1.00 0.00 C ATOM 110 O ALA A 40 -8.372 -5.501 0.158 1.00 0.00 O ATOM 111 CB ALA A 40 -9.223 -6.490 3.144 1.00 0.00 C ATOM 0 H ALA A 40 -9.120 -4.340 4.277 1.00 0.00 H new ATOM 0 HA ALA A 40 -7.376 -5.605 2.451 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -9.168 -7.345 2.470 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -8.806 -6.765 4.113 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -10.264 -6.192 3.268 1.00 0.00 H new ATOM 117 N LEU A 41 -9.861 -4.039 1.010 1.00 0.00 N ATOM 118 CA LEU A 41 -10.326 -3.454 -0.250 1.00 0.00 C ATOM 119 C LEU A 41 -10.573 -1.952 -0.053 1.00 0.00 C ATOM 120 O LEU A 41 -11.408 -1.555 0.763 1.00 0.00 O ATOM 121 CB LEU A 41 -11.594 -4.198 -0.720 1.00 0.00 C ATOM 122 CG LEU A 41 -12.309 -3.566 -1.935 1.00 0.00 C ATOM 123 CD1 LEU A 41 -11.427 -3.508 -3.192 1.00 0.00 C ATOM 124 CD2 LEU A 41 -13.587 -4.356 -2.250 1.00 0.00 C ATOM 0 H LEU A 41 -10.349 -3.659 1.821 1.00 0.00 H new ATOM 0 HA LEU A 41 -9.570 -3.565 -1.027 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -11.323 -5.224 -0.970 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -12.297 -4.247 0.111 1.00 0.00 H new ATOM 0 HG LEU A 41 -12.546 -2.538 -1.660 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -11.987 -3.054 -4.009 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -10.538 -2.911 -2.986 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -11.129 -4.518 -3.474 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -14.090 -3.908 -3.107 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -13.328 -5.390 -2.480 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -14.252 -4.332 -1.387 1.00 0.00 H new ATOM 136 N LEU A 42 -9.869 -1.126 -0.826 1.00 0.00 N ATOM 137 CA LEU A 42 -10.063 0.321 -0.919 1.00 0.00 C ATOM 138 C LEU A 42 -10.818 0.646 -2.215 1.00 0.00 C ATOM 139 O LEU A 42 -10.369 0.252 -3.290 1.00 0.00 O ATOM 140 CB LEU A 42 -8.671 0.985 -0.900 1.00 0.00 C ATOM 141 CG LEU A 42 -8.677 2.523 -0.963 1.00 0.00 C ATOM 142 CD1 LEU A 42 -9.389 3.164 0.237 1.00 0.00 C ATOM 143 CD2 LEU A 42 -7.231 3.025 -1.021 1.00 0.00 C ATOM 0 H LEU A 42 -9.117 -1.460 -1.429 1.00 0.00 H new ATOM 0 HA LEU A 42 -10.653 0.698 -0.084 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -8.151 0.677 0.007 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -8.093 0.605 -1.743 1.00 0.00 H new ATOM 0 HG LEU A 42 -9.229 2.812 -1.857 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -9.362 4.249 0.139 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -10.425 2.828 0.267 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -8.886 2.870 1.158 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -7.225 4.114 -1.066 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -6.696 2.696 -0.130 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -6.742 2.623 -1.908 1.00 0.00 H new ATOM 155 N VAL A 43 -11.924 1.389 -2.132 1.00 0.00 N ATOM 156 CA VAL A 43 -12.647 1.923 -3.303 1.00 0.00 C ATOM 157 C VAL A 43 -12.453 3.440 -3.353 1.00 0.00 C ATOM 158 O VAL A 43 -12.753 4.132 -2.381 1.00 0.00 O ATOM 159 CB VAL A 43 -14.157 1.571 -3.302 1.00 0.00 C ATOM 160 CG1 VAL A 43 -14.810 1.979 -4.635 1.00 0.00 C ATOM 161 CG2 VAL A 43 -14.394 0.066 -3.078 1.00 0.00 C ATOM 0 H VAL A 43 -12.353 1.643 -1.242 1.00 0.00 H new ATOM 0 HA VAL A 43 -12.229 1.452 -4.193 1.00 0.00 H new ATOM 0 HB VAL A 43 -14.609 2.125 -2.479 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -15.869 1.724 -4.614 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -14.698 3.053 -4.781 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -14.325 1.449 -5.455 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -15.465 -0.139 -3.084 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -13.912 -0.501 -3.874 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -13.974 -0.229 -2.117 1.00 0.00 H new ATOM 171 N VAL A 44 -11.959 3.944 -4.486 1.00 0.00 N ATOM 172 CA VAL A 44 -11.841 5.390 -4.783 1.00 0.00 C ATOM 173 C VAL A 44 -12.496 5.745 -6.123 1.00 0.00 C ATOM 174 O VAL A 44 -12.842 4.851 -6.895 1.00 0.00 O ATOM 175 CB VAL A 44 -10.373 5.880 -4.771 1.00 0.00 C ATOM 176 CG1 VAL A 44 -9.720 5.676 -3.397 1.00 0.00 C ATOM 177 CG2 VAL A 44 -9.521 5.218 -5.865 1.00 0.00 C ATOM 0 H VAL A 44 -11.620 3.353 -5.245 1.00 0.00 H new ATOM 0 HA VAL A 44 -12.372 5.905 -3.982 1.00 0.00 H new ATOM 0 HB VAL A 44 -10.411 6.948 -4.984 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -8.690 6.032 -3.427 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -10.275 6.235 -2.644 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -9.730 4.616 -3.143 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -8.501 5.598 -5.811 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -9.515 4.138 -5.718 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -9.943 5.448 -6.844 1.00 0.00 H new ATOM 187 N THR A 45 -12.640 7.046 -6.408 1.00 0.00 N ATOM 188 CA THR A 45 -13.110 7.583 -7.698 1.00 0.00 C ATOM 189 C THR A 45 -11.920 8.067 -8.530 1.00 0.00 C ATOM 190 O THR A 45 -10.920 8.534 -7.987 1.00 0.00 O ATOM 191 CB THR A 45 -14.135 8.701 -7.463 1.00 0.00 C ATOM 192 OG1 THR A 45 -15.224 8.157 -6.747 1.00 0.00 O ATOM 193 CG2 THR A 45 -14.706 9.273 -8.760 1.00 0.00 C ATOM 0 H THR A 45 -12.427 7.777 -5.730 1.00 0.00 H new ATOM 0 HA THR A 45 -13.608 6.793 -8.261 1.00 0.00 H new ATOM 0 HB THR A 45 -13.620 9.499 -6.929 1.00 0.00 H new ATOM 0 HG1 THR A 45 -15.891 8.857 -6.585 1.00 0.00 H new ATOM 0 HG21 THR A 45 -15.424 10.059 -8.526 1.00 0.00 H new ATOM 0 HG22 THR A 45 -13.897 9.688 -9.362 1.00 0.00 H new ATOM 0 HG23 THR A 45 -15.204 8.481 -9.319 1.00 0.00 H new ATOM 201 N GLU A 46 -12.019 7.947 -9.852 1.00 0.00 N ATOM 202 CA GLU A 46 -10.939 8.253 -10.787 1.00 0.00 C ATOM 203 C GLU A 46 -10.479 9.715 -10.670 1.00 0.00 C ATOM 204 O GLU A 46 -11.281 10.651 -10.736 1.00 0.00 O ATOM 205 CB GLU A 46 -11.347 7.893 -12.229 1.00 0.00 C ATOM 206 CG GLU A 46 -10.112 7.503 -13.041 1.00 0.00 C ATOM 207 CD GLU A 46 -10.391 7.236 -14.519 1.00 0.00 C ATOM 208 OE1 GLU A 46 -11.139 7.993 -15.176 1.00 0.00 O ATOM 209 OE2 GLU A 46 -9.866 6.223 -15.032 1.00 0.00 O1- ATOM 0 H GLU A 46 -12.871 7.627 -10.313 1.00 0.00 H new ATOM 0 HA GLU A 46 -10.082 7.635 -10.520 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -12.060 7.069 -12.219 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -11.847 8.741 -12.697 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -9.372 8.300 -12.961 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -9.668 6.610 -12.600 1.00 0.00 H new ATOM 216 N GLY A 47 -9.171 9.898 -10.476 1.00 0.00 N ATOM 217 CA GLY A 47 -8.510 11.180 -10.213 1.00 0.00 C ATOM 218 C GLY A 47 -8.365 11.526 -8.729 1.00 0.00 C ATOM 219 O GLY A 47 -7.757 12.550 -8.422 1.00 0.00 O ATOM 0 H GLY A 47 -8.512 9.120 -10.499 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -7.520 11.164 -10.668 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -9.074 11.973 -10.705 1.00 0.00 H new ATOM 223 N ASP A 48 -8.877 10.709 -7.802 1.00 0.00 N ATOM 224 CA ASP A 48 -8.661 10.888 -6.358 1.00 0.00 C ATOM 225 C ASP A 48 -7.320 10.280 -5.894 1.00 0.00 C ATOM 226 O ASP A 48 -6.773 9.371 -6.524 1.00 0.00 O ATOM 227 CB ASP A 48 -9.851 10.295 -5.581 1.00 0.00 C ATOM 228 CG ASP A 48 -9.892 10.682 -4.090 1.00 0.00 C ATOM 229 OD1 ASP A 48 -9.370 11.761 -3.720 1.00 0.00 O1- ATOM 230 OD2 ASP A 48 -10.487 9.912 -3.300 1.00 0.00 O ATOM 0 H ASP A 48 -9.456 9.901 -8.031 1.00 0.00 H new ATOM 0 HA ASP A 48 -8.601 11.956 -6.149 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -10.777 10.621 -6.054 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -9.817 9.208 -5.661 1.00 0.00 H new ATOM 235 N ASN A 49 -6.791 10.768 -4.768 1.00 0.00 N ATOM 236 CA ASN A 49 -5.644 10.166 -4.085 1.00 0.00 C ATOM 237 C ASN A 49 -6.106 8.946 -3.265 1.00 0.00 C ATOM 238 O ASN A 49 -6.976 9.063 -2.400 1.00 0.00 O ATOM 239 CB ASN A 49 -4.948 11.203 -3.184 1.00 0.00 C ATOM 240 CG ASN A 49 -3.961 12.104 -3.925 1.00 0.00 C ATOM 241 OD1 ASN A 49 -2.824 12.274 -3.499 1.00 0.00 O ATOM 242 ND2 ASN A 49 -4.346 12.702 -5.039 1.00 0.00 N ATOM 0 H ASN A 49 -7.151 11.600 -4.301 1.00 0.00 H new ATOM 0 HA ASN A 49 -4.922 9.831 -4.830 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -5.707 11.825 -2.709 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -4.420 10.681 -2.386 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -3.697 13.305 -5.545 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -5.292 12.560 -5.393 1.00 0.00 H new ATOM 249 N ALA A 50 -5.509 7.777 -3.521 1.00 0.00 N ATOM 250 CA ALA A 50 -5.828 6.522 -2.824 1.00 0.00 C ATOM 251 C ALA A 50 -4.752 6.198 -1.776 1.00 0.00 C ATOM 252 O ALA A 50 -3.577 6.205 -2.142 1.00 0.00 O ATOM 253 CB ALA A 50 -5.933 5.407 -3.875 1.00 0.00 C ATOM 0 H ALA A 50 -4.781 7.672 -4.227 1.00 0.00 H new ATOM 0 HA ALA A 50 -6.775 6.615 -2.293 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -6.169 4.464 -3.382 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -6.721 5.652 -4.588 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -4.983 5.313 -4.402 1.00 0.00 H new ATOM 259 N THR A 51 -5.124 5.904 -0.518 1.00 0.00 N ATOM 260 CA THR A 51 -4.177 5.631 0.586 1.00 0.00 C ATOM 261 C THR A 51 -4.558 4.379 1.379 1.00 0.00 C ATOM 262 O THR A 51 -5.688 4.253 1.851 1.00 0.00 O ATOM 263 CB THR A 51 -4.057 6.833 1.537 1.00 0.00 C ATOM 264 OG1 THR A 51 -3.749 7.992 0.790 1.00 0.00 O ATOM 265 CG2 THR A 51 -2.939 6.653 2.572 1.00 0.00 C ATOM 0 H THR A 51 -6.102 5.848 -0.232 1.00 0.00 H new ATOM 0 HA THR A 51 -3.208 5.454 0.119 1.00 0.00 H new ATOM 0 HB THR A 51 -5.011 6.920 2.056 1.00 0.00 H new ATOM 0 HG1 THR A 51 -3.674 8.760 1.394 1.00 0.00 H new ATOM 0 HG21 THR A 51 -2.897 7.530 3.218 1.00 0.00 H new ATOM 0 HG22 THR A 51 -3.140 5.767 3.175 1.00 0.00 H new ATOM 0 HG23 THR A 51 -1.984 6.534 2.059 1.00 0.00 H new ATOM 273 N PHE A 52 -3.579 3.492 1.565 1.00 0.00 N ATOM 274 CA PHE A 52 -3.589 2.319 2.445 1.00 0.00 C ATOM 275 C PHE A 52 -2.716 2.564 3.690 1.00 0.00 C ATOM 276 O PHE A 52 -1.801 3.391 3.663 1.00 0.00 O ATOM 277 CB PHE A 52 -3.026 1.108 1.679 1.00 0.00 C ATOM 278 CG PHE A 52 -3.862 0.644 0.504 1.00 0.00 C ATOM 279 CD1 PHE A 52 -4.867 -0.323 0.698 1.00 0.00 C ATOM 280 CD2 PHE A 52 -3.620 1.156 -0.786 1.00 0.00 C ATOM 281 CE1 PHE A 52 -5.630 -0.773 -0.391 1.00 0.00 C ATOM 282 CE2 PHE A 52 -4.382 0.701 -1.878 1.00 0.00 C ATOM 283 CZ PHE A 52 -5.385 -0.262 -1.676 1.00 0.00 C ATOM 0 H PHE A 52 -2.692 3.580 1.068 1.00 0.00 H new ATOM 0 HA PHE A 52 -4.615 2.131 2.761 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -2.028 1.358 1.318 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -2.914 0.277 2.376 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -5.051 -0.719 1.686 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -2.850 1.898 -0.937 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -6.404 -1.511 -0.241 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -4.197 1.091 -2.868 1.00 0.00 H new ATOM 0 HZ PHE A 52 -5.971 -0.611 -2.513 1.00 0.00 H new ATOM 293 N THR A 53 -2.953 1.789 4.753 1.00 0.00 N ATOM 294 CA THR A 53 -2.120 1.721 5.963 1.00 0.00 C ATOM 295 C THR A 53 -1.407 0.374 6.003 1.00 0.00 C ATOM 296 O THR A 53 -2.032 -0.666 5.798 1.00 0.00 O ATOM 297 CB THR A 53 -2.984 1.906 7.217 1.00 0.00 C ATOM 298 OG1 THR A 53 -3.637 3.156 7.134 1.00 0.00 O ATOM 299 CG2 THR A 53 -2.157 1.899 8.505 1.00 0.00 C ATOM 0 H THR A 53 -3.760 1.167 4.798 1.00 0.00 H new ATOM 0 HA THR A 53 -1.381 2.522 5.940 1.00 0.00 H new ATOM 0 HB THR A 53 -3.687 1.074 7.255 1.00 0.00 H new ATOM 0 HG1 THR A 53 -4.195 3.287 7.929 1.00 0.00 H new ATOM 0 HG21 THR A 53 -2.817 2.033 9.362 1.00 0.00 H new ATOM 0 HG22 THR A 53 -1.633 0.947 8.596 1.00 0.00 H new ATOM 0 HG23 THR A 53 -1.431 2.711 8.475 1.00 0.00 H new ATOM 307 N CYS A 54 -0.111 0.384 6.311 1.00 0.00 N ATOM 308 CA CYS A 54 0.707 -0.810 6.542 1.00 0.00 C ATOM 309 C CYS A 54 1.517 -0.657 7.841 1.00 0.00 C ATOM 310 O CYS A 54 2.246 0.321 8.021 1.00 0.00 O ATOM 311 CB CYS A 54 1.622 -1.050 5.328 1.00 0.00 C ATOM 312 SG CYS A 54 0.767 -1.678 3.850 1.00 0.00 S ATOM 0 H CYS A 54 0.418 1.251 6.410 1.00 0.00 H new ATOM 0 HA CYS A 54 0.061 -1.680 6.659 1.00 0.00 H new ATOM 0 HB2 CYS A 54 2.120 -0.114 5.074 1.00 0.00 H new ATOM 0 HB3 CYS A 54 2.400 -1.759 5.610 1.00 0.00 H new ATOM 317 N SER A 55 1.398 -1.617 8.756 1.00 0.00 N ATOM 318 CA SER A 55 2.174 -1.668 10.001 1.00 0.00 C ATOM 319 C SER A 55 3.284 -2.724 9.909 1.00 0.00 C ATOM 320 O SER A 55 3.121 -3.749 9.240 1.00 0.00 O ATOM 321 CB SER A 55 1.255 -1.949 11.201 1.00 0.00 C ATOM 322 OG SER A 55 0.610 -3.213 11.120 1.00 0.00 O ATOM 0 H SER A 55 0.749 -2.397 8.654 1.00 0.00 H new ATOM 0 HA SER A 55 2.643 -0.695 10.149 1.00 0.00 H new ATOM 0 HB2 SER A 55 1.841 -1.904 12.119 1.00 0.00 H new ATOM 0 HB3 SER A 55 0.500 -1.165 11.266 1.00 0.00 H new ATOM 0 HG SER A 55 0.040 -3.341 11.907 1.00 0.00 H new ATOM 328 N PHE A 56 4.413 -2.480 10.588 1.00 0.00 N ATOM 329 CA PHE A 56 5.563 -3.386 10.654 1.00 0.00 C ATOM 330 C PHE A 56 6.262 -3.341 12.015 1.00 0.00 C ATOM 331 O PHE A 56 6.304 -2.309 12.681 1.00 0.00 O ATOM 332 CB PHE A 56 6.586 -3.033 9.562 1.00 0.00 C ATOM 333 CG PHE A 56 6.208 -3.558 8.199 1.00 0.00 C ATOM 334 CD1 PHE A 56 5.430 -2.771 7.336 1.00 0.00 C ATOM 335 CD2 PHE A 56 6.577 -4.863 7.827 1.00 0.00 C ATOM 336 CE1 PHE A 56 5.002 -3.297 6.110 1.00 0.00 C ATOM 337 CE2 PHE A 56 6.150 -5.389 6.595 1.00 0.00 C ATOM 338 CZ PHE A 56 5.353 -4.607 5.744 1.00 0.00 C ATOM 0 H PHE A 56 4.553 -1.622 11.121 1.00 0.00 H new ATOM 0 HA PHE A 56 5.176 -4.393 10.500 1.00 0.00 H new ATOM 0 HB2 PHE A 56 6.692 -1.949 9.510 1.00 0.00 H new ATOM 0 HB3 PHE A 56 7.559 -3.436 9.842 1.00 0.00 H new ATOM 0 HD1 PHE A 56 5.162 -1.763 7.616 1.00 0.00 H new ATOM 0 HD2 PHE A 56 7.188 -5.461 8.487 1.00 0.00 H new ATOM 0 HE1 PHE A 56 4.401 -2.694 5.445 1.00 0.00 H new ATOM 0 HE2 PHE A 56 6.434 -6.390 6.305 1.00 0.00 H new ATOM 0 HZ PHE A 56 5.009 -5.014 4.805 1.00 0.00 H new ATOM 424 N PHE A 63 14.828 -0.840 9.944 1.00 0.00 N ATOM 425 CA PHE A 63 14.621 -1.683 8.764 1.00 0.00 C ATOM 426 C PHE A 63 14.323 -0.832 7.512 1.00 0.00 C ATOM 427 O PHE A 63 13.994 0.351 7.625 1.00 0.00 O ATOM 428 CB PHE A 63 13.498 -2.702 9.070 1.00 0.00 C ATOM 429 CG PHE A 63 12.180 -2.138 9.569 1.00 0.00 C ATOM 430 CD1 PHE A 63 11.225 -1.655 8.653 1.00 0.00 C ATOM 431 CD2 PHE A 63 11.875 -2.160 10.945 1.00 0.00 C ATOM 432 CE1 PHE A 63 9.970 -1.215 9.105 1.00 0.00 C ATOM 433 CE2 PHE A 63 10.620 -1.716 11.399 1.00 0.00 C ATOM 434 CZ PHE A 63 9.666 -1.248 10.478 1.00 0.00 C ATOM 0 HA PHE A 63 15.535 -2.233 8.539 1.00 0.00 H new ATOM 0 HB2 PHE A 63 13.301 -3.274 8.163 1.00 0.00 H new ATOM 0 HB3 PHE A 63 13.871 -3.405 9.815 1.00 0.00 H new ATOM 0 HD1 PHE A 63 11.459 -1.623 7.599 1.00 0.00 H new ATOM 0 HD2 PHE A 63 12.607 -2.519 11.653 1.00 0.00 H new ATOM 0 HE1 PHE A 63 9.239 -0.851 8.398 1.00 0.00 H new ATOM 0 HE2 PHE A 63 10.389 -1.734 12.454 1.00 0.00 H new ATOM 0 HZ PHE A 63 8.699 -0.914 10.825 1.00 0.00 H new ATOM 444 N VAL A 64 14.395 -1.443 6.326 1.00 0.00 N ATOM 445 CA VAL A 64 13.944 -0.839 5.058 1.00 0.00 C ATOM 446 C VAL A 64 12.524 -1.328 4.795 1.00 0.00 C ATOM 447 O VAL A 64 12.269 -2.529 4.756 1.00 0.00 O ATOM 448 CB VAL A 64 14.841 -1.187 3.842 1.00 0.00 C ATOM 449 CG1 VAL A 64 14.353 -0.481 2.565 1.00 0.00 C ATOM 450 CG2 VAL A 64 16.301 -0.775 4.100 1.00 0.00 C ATOM 0 H VAL A 64 14.772 -2.384 6.213 1.00 0.00 H new ATOM 0 HA VAL A 64 13.997 0.244 5.168 1.00 0.00 H new ATOM 0 HB VAL A 64 14.781 -2.266 3.704 1.00 0.00 H new ATOM 0 HG11 VAL A 64 15.003 -0.746 1.731 1.00 0.00 H new ATOM 0 HG12 VAL A 64 13.333 -0.794 2.343 1.00 0.00 H new ATOM 0 HG13 VAL A 64 14.377 0.598 2.714 1.00 0.00 H new ATOM 0 HG21 VAL A 64 16.910 -1.030 3.232 1.00 0.00 H new ATOM 0 HG22 VAL A 64 16.350 0.300 4.275 1.00 0.00 H new ATOM 0 HG23 VAL A 64 16.679 -1.303 4.976 1.00 0.00 H new ATOM 460 N LEU A 65 11.613 -0.378 4.621 1.00 0.00 N ATOM 461 CA LEU A 65 10.200 -0.572 4.313 1.00 0.00 C ATOM 462 C LEU A 65 9.988 -0.373 2.807 1.00 0.00 C ATOM 463 O LEU A 65 10.605 0.501 2.203 1.00 0.00 O ATOM 464 CB LEU A 65 9.438 0.442 5.187 1.00 0.00 C ATOM 465 CG LEU A 65 7.920 0.592 4.999 1.00 0.00 C ATOM 466 CD1 LEU A 65 7.546 1.336 3.709 1.00 0.00 C ATOM 467 CD2 LEU A 65 7.177 -0.741 5.151 1.00 0.00 C ATOM 0 H LEU A 65 11.856 0.610 4.696 1.00 0.00 H new ATOM 0 HA LEU A 65 9.835 -1.575 4.534 1.00 0.00 H new ATOM 0 HB2 LEU A 65 9.616 0.178 6.229 1.00 0.00 H new ATOM 0 HB3 LEU A 65 9.888 1.421 5.024 1.00 0.00 H new ATOM 0 HG LEU A 65 7.578 1.228 5.815 1.00 0.00 H new ATOM 0 HD11 LEU A 65 6.461 1.410 3.633 1.00 0.00 H new ATOM 0 HD12 LEU A 65 7.977 2.337 3.728 1.00 0.00 H new ATOM 0 HD13 LEU A 65 7.934 0.790 2.849 1.00 0.00 H new ATOM 0 HD21 LEU A 65 6.108 -0.580 5.009 1.00 0.00 H new ATOM 0 HD22 LEU A 65 7.540 -1.447 4.404 1.00 0.00 H new ATOM 0 HD23 LEU A 65 7.354 -1.145 6.148 1.00 0.00 H new ATOM 479 N ASN A 66 9.117 -1.182 2.205 1.00 0.00 N ATOM 480 CA ASN A 66 8.834 -1.224 0.769 1.00 0.00 C ATOM 481 C ASN A 66 7.331 -1.460 0.501 1.00 0.00 C ATOM 482 O ASN A 66 6.624 -2.065 1.314 1.00 0.00 O ATOM 483 CB ASN A 66 9.654 -2.355 0.122 1.00 0.00 C ATOM 484 CG ASN A 66 11.148 -2.312 0.435 1.00 0.00 C ATOM 485 OD1 ASN A 66 11.924 -1.624 -0.215 1.00 0.00 O ATOM 486 ND2 ASN A 66 11.595 -3.057 1.432 1.00 0.00 N ATOM 0 H ASN A 66 8.563 -1.859 2.730 1.00 0.00 H new ATOM 0 HA ASN A 66 9.111 -0.263 0.336 1.00 0.00 H new ATOM 0 HB2 ASN A 66 9.253 -3.313 0.454 1.00 0.00 H new ATOM 0 HB3 ASN A 66 9.521 -2.311 -0.959 1.00 0.00 H new ATOM 0 HD21 ASN A 66 12.589 -3.059 1.661 1.00 0.00 H new ATOM 0 HD22 ASN A 66 10.946 -3.629 1.972 1.00 0.00 H new ATOM 493 N TRP A 67 6.845 -1.024 -0.664 1.00 0.00 N ATOM 494 CA TRP A 67 5.472 -1.242 -1.137 1.00 0.00 C ATOM 495 C TRP A 67 5.455 -1.839 -2.553 1.00 0.00 C ATOM 496 O TRP A 67 6.292 -1.484 -3.385 1.00 0.00 O ATOM 497 CB TRP A 67 4.719 0.094 -1.075 1.00 0.00 C ATOM 498 CG TRP A 67 3.255 0.044 -1.394 1.00 0.00 C ATOM 499 CD1 TRP A 67 2.402 -0.955 -1.071 1.00 0.00 C ATOM 500 CD2 TRP A 67 2.435 1.055 -2.057 1.00 0.00 C ATOM 501 NE1 TRP A 67 1.132 -0.656 -1.516 1.00 0.00 N ATOM 502 CE2 TRP A 67 1.089 0.580 -2.120 1.00 0.00 C ATOM 503 CE3 TRP A 67 2.687 2.341 -2.581 1.00 0.00 C ATOM 504 CZ2 TRP A 67 0.046 1.341 -2.668 1.00 0.00 C ATOM 505 CZ3 TRP A 67 1.647 3.114 -3.128 1.00 0.00 C ATOM 506 CH2 TRP A 67 0.331 2.621 -3.168 1.00 0.00 C ATOM 0 H TRP A 67 7.412 -0.493 -1.325 1.00 0.00 H new ATOM 0 HA TRP A 67 4.973 -1.967 -0.494 1.00 0.00 H new ATOM 0 HB2 TRP A 67 4.838 0.508 -0.074 1.00 0.00 H new ATOM 0 HB3 TRP A 67 5.197 0.789 -1.766 1.00 0.00 H new ATOM 0 HD1 TRP A 67 2.676 -1.856 -0.542 1.00 0.00 H new ATOM 0 HE1 TRP A 67 0.326 -1.273 -1.411 1.00 0.00 H new ATOM 0 HE3 TRP A 67 3.692 2.737 -2.562 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 -0.960 0.949 -2.705 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 1.862 4.097 -3.521 1.00 0.00 H new ATOM 0 HH2 TRP A 67 -0.460 3.227 -3.583 1.00 0.00 H new ATOM 517 N TYR A 68 4.508 -2.744 -2.828 1.00 0.00 N ATOM 518 CA TYR A 68 4.459 -3.561 -4.044 1.00 0.00 C ATOM 519 C TYR A 68 3.050 -3.706 -4.650 1.00 0.00 C ATOM 520 O TYR A 68 2.047 -3.776 -3.934 1.00 0.00 O ATOM 521 CB TYR A 68 5.002 -4.967 -3.751 1.00 0.00 C ATOM 522 CG TYR A 68 6.389 -5.017 -3.142 1.00 0.00 C ATOM 523 CD1 TYR A 68 7.527 -5.024 -3.972 1.00 0.00 C ATOM 524 CD2 TYR A 68 6.540 -5.071 -1.742 1.00 0.00 C ATOM 525 CE1 TYR A 68 8.815 -5.092 -3.408 1.00 0.00 C ATOM 526 CE2 TYR A 68 7.824 -5.147 -1.173 1.00 0.00 C ATOM 527 CZ TYR A 68 8.967 -5.160 -2.004 1.00 0.00 C ATOM 528 OH TYR A 68 10.210 -5.239 -1.450 1.00 0.00 O ATOM 0 H TYR A 68 3.733 -2.933 -2.192 1.00 0.00 H new ATOM 0 HA TYR A 68 5.073 -3.034 -4.774 1.00 0.00 H new ATOM 0 HB2 TYR A 68 4.310 -5.472 -3.077 1.00 0.00 H new ATOM 0 HB3 TYR A 68 5.012 -5.535 -4.681 1.00 0.00 H new ATOM 0 HD1 TYR A 68 7.411 -4.977 -5.045 1.00 0.00 H new ATOM 0 HD2 TYR A 68 5.668 -5.054 -1.105 1.00 0.00 H new ATOM 0 HE1 TYR A 68 9.686 -5.092 -4.047 1.00 0.00 H new ATOM 0 HE2 TYR A 68 7.937 -5.195 -0.100 1.00 0.00 H new ATOM 0 HH TYR A 68 10.131 -5.277 -0.474 1.00 0.00 H new ATOM 538 N ARG A 69 2.991 -3.827 -5.983 1.00 0.00 N ATOM 539 CA ARG A 69 1.793 -4.208 -6.749 1.00 0.00 C ATOM 540 C ARG A 69 1.972 -5.620 -7.317 1.00 0.00 C ATOM 541 O ARG A 69 3.073 -5.963 -7.751 1.00 0.00 O ATOM 542 CB ARG A 69 1.562 -3.201 -7.887 1.00 0.00 C ATOM 543 CG ARG A 69 0.245 -3.463 -8.623 1.00 0.00 C ATOM 544 CD ARG A 69 -0.024 -2.386 -9.679 1.00 0.00 C ATOM 545 NE ARG A 69 -1.436 -2.368 -10.094 1.00 0.00 N ATOM 546 CZ ARG A 69 -2.083 -3.262 -10.831 1.00 0.00 C ATOM 547 NH1 ARG A 69 -1.526 -4.372 -11.268 1.00 0.00 N ATOM 548 NH2 ARG A 69 -3.338 -3.034 -11.131 1.00 0.00 N1+ ATOM 0 H ARG A 69 3.801 -3.657 -6.579 1.00 0.00 H new ATOM 0 HA ARG A 69 0.924 -4.200 -6.091 1.00 0.00 H new ATOM 0 HB2 ARG A 69 1.556 -2.189 -7.481 1.00 0.00 H new ATOM 0 HB3 ARG A 69 2.390 -3.256 -8.594 1.00 0.00 H new ATOM 0 HG2 ARG A 69 0.281 -4.443 -9.100 1.00 0.00 H new ATOM 0 HG3 ARG A 69 -0.576 -3.487 -7.907 1.00 0.00 H new ATOM 0 HD2 ARG A 69 0.250 -1.409 -9.280 1.00 0.00 H new ATOM 0 HD3 ARG A 69 0.608 -2.564 -10.549 1.00 0.00 H new ATOM 0 HE ARG A 69 -1.985 -1.570 -9.776 1.00 0.00 H new ATOM 0 HH11 ARG A 69 -0.553 -4.577 -11.043 1.00 0.00 H new ATOM 0 HH12 ARG A 69 -2.068 -5.027 -11.832 1.00 0.00 H new ATOM 0 HH21 ARG A 69 -3.795 -2.185 -10.799 1.00 0.00 H new ATOM 0 HH22 ARG A 69 -3.857 -3.706 -11.696 1.00 0.00 H new ATOM 562 N MET A 70 0.908 -6.423 -7.364 1.00 0.00 N ATOM 563 CA MET A 70 0.944 -7.744 -8.008 1.00 0.00 C ATOM 564 C MET A 70 0.924 -7.621 -9.539 1.00 0.00 C ATOM 565 O MET A 70 0.130 -6.863 -10.099 1.00 0.00 O ATOM 566 CB MET A 70 -0.213 -8.630 -7.530 1.00 0.00 C ATOM 567 CG MET A 70 -0.238 -8.837 -6.007 1.00 0.00 C ATOM 568 SD MET A 70 1.300 -9.386 -5.222 1.00 0.00 S ATOM 569 CE MET A 70 1.567 -10.963 -6.069 1.00 0.00 C ATOM 0 H MET A 70 0.002 -6.182 -6.961 1.00 0.00 H new ATOM 0 HA MET A 70 1.881 -8.218 -7.716 1.00 0.00 H new ATOM 0 HB2 MET A 70 -1.156 -8.183 -7.843 1.00 0.00 H new ATOM 0 HB3 MET A 70 -0.143 -9.601 -8.020 1.00 0.00 H new ATOM 0 HG2 MET A 70 -0.538 -7.897 -5.543 1.00 0.00 H new ATOM 0 HG3 MET A 70 -1.014 -9.567 -5.778 1.00 0.00 H new ATOM 0 HE1 MET A 70 2.480 -11.427 -5.695 1.00 0.00 H new ATOM 0 HE2 MET A 70 0.721 -11.624 -5.882 1.00 0.00 H new ATOM 0 HE3 MET A 70 1.662 -10.789 -7.141 1.00 0.00 H new ATOM 579 N SER A 71 1.774 -8.376 -10.230 1.00 0.00 N ATOM 580 CA SER A 71 1.763 -8.475 -11.697 1.00 0.00 C ATOM 581 C SER A 71 0.766 -9.545 -12.210 1.00 0.00 C ATOM 582 O SER A 71 0.331 -10.402 -11.427 1.00 0.00 O ATOM 583 CB SER A 71 3.185 -8.747 -12.219 1.00 0.00 C ATOM 584 OG SER A 71 3.548 -10.120 -12.143 1.00 0.00 O ATOM 0 H SER A 71 2.498 -8.943 -9.789 1.00 0.00 H new ATOM 0 HA SER A 71 1.418 -7.518 -12.089 1.00 0.00 H new ATOM 0 HB2 SER A 71 3.257 -8.414 -13.254 1.00 0.00 H new ATOM 0 HB3 SER A 71 3.897 -8.155 -11.644 1.00 0.00 H new ATOM 0 HG SER A 71 4.386 -10.264 -12.630 1.00 0.00 H new ATOM 590 N PRO A 72 0.426 -9.554 -13.519 1.00 0.00 N ATOM 591 CA PRO A 72 -0.347 -10.631 -14.146 1.00 0.00 C ATOM 592 C PRO A 72 0.317 -12.013 -14.025 1.00 0.00 C ATOM 593 O PRO A 72 -0.378 -13.027 -13.985 1.00 0.00 O ATOM 594 CB PRO A 72 -0.495 -10.233 -15.621 1.00 0.00 C ATOM 595 CG PRO A 72 -0.342 -8.715 -15.604 1.00 0.00 C ATOM 596 CD PRO A 72 0.686 -8.501 -14.494 1.00 0.00 C ATOM 0 HA PRO A 72 -1.307 -10.737 -13.640 1.00 0.00 H new ATOM 0 HB2 PRO A 72 0.267 -10.705 -16.241 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -1.463 -10.533 -16.021 1.00 0.00 H new ATOM 0 HG2 PRO A 72 0.009 -8.331 -16.562 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -1.285 -8.214 -15.386 1.00 0.00 H new ATOM 0 HD2 PRO A 72 1.703 -8.567 -14.882 1.00 0.00 H new ATOM 0 HD3 PRO A 72 0.579 -7.514 -14.044 1.00 0.00 H new ATOM 604 N SER A 73 1.650 -12.066 -13.938 1.00 0.00 N ATOM 605 CA SER A 73 2.433 -13.298 -13.729 1.00 0.00 C ATOM 606 C SER A 73 2.538 -13.710 -12.244 1.00 0.00 C ATOM 607 O SER A 73 3.201 -14.699 -11.924 1.00 0.00 O ATOM 608 CB SER A 73 3.845 -13.123 -14.318 1.00 0.00 C ATOM 609 OG SER A 73 3.808 -12.745 -15.691 1.00 0.00 O ATOM 0 H SER A 73 2.234 -11.233 -14.012 1.00 0.00 H new ATOM 0 HA SER A 73 1.900 -14.099 -14.242 1.00 0.00 H new ATOM 0 HB2 SER A 73 4.384 -12.366 -13.748 1.00 0.00 H new ATOM 0 HB3 SER A 73 4.399 -14.056 -14.214 1.00 0.00 H new ATOM 0 HG SER A 73 4.723 -12.642 -16.027 1.00 0.00 H new ATOM 615 N ASN A 74 1.915 -12.949 -11.330 1.00 0.00 N ATOM 616 CA ASN A 74 1.888 -13.139 -9.870 1.00 0.00 C ATOM 617 C ASN A 74 3.216 -12.766 -9.178 1.00 0.00 C ATOM 618 O ASN A 74 3.488 -13.211 -8.059 1.00 0.00 O ATOM 619 CB ASN A 74 1.370 -14.537 -9.465 1.00 0.00 C ATOM 620 CG ASN A 74 0.044 -14.897 -10.129 1.00 0.00 C ATOM 621 OD1 ASN A 74 -1.022 -14.453 -9.715 1.00 0.00 O ATOM 622 ND2 ASN A 74 0.067 -15.711 -11.171 1.00 0.00 N ATOM 0 H ASN A 74 1.380 -12.128 -11.611 1.00 0.00 H new ATOM 0 HA ASN A 74 1.159 -12.422 -9.493 1.00 0.00 H new ATOM 0 HB2 ASN A 74 2.117 -15.286 -9.729 1.00 0.00 H new ATOM 0 HB3 ASN A 74 1.250 -14.574 -8.382 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -0.804 -15.972 -11.634 1.00 0.00 H new ATOM 0 HD22 ASN A 74 0.956 -16.078 -11.512 1.00 0.00 H new ATOM 629 N GLN A 75 4.038 -11.935 -9.826 1.00 0.00 N ATOM 630 CA GLN A 75 5.223 -11.324 -9.217 1.00 0.00 C ATOM 631 C GLN A 75 4.845 -10.006 -8.510 1.00 0.00 C ATOM 632 O GLN A 75 3.674 -9.619 -8.499 1.00 0.00 O ATOM 633 CB GLN A 75 6.328 -11.122 -10.277 1.00 0.00 C ATOM 634 CG GLN A 75 6.739 -12.410 -11.018 1.00 0.00 C ATOM 635 CD GLN A 75 7.319 -13.475 -10.086 1.00 0.00 C ATOM 636 OE1 GLN A 75 6.665 -14.439 -9.709 1.00 0.00 O ATOM 637 NE2 GLN A 75 8.557 -13.336 -9.651 1.00 0.00 N ATOM 0 H GLN A 75 3.897 -11.665 -10.799 1.00 0.00 H new ATOM 0 HA GLN A 75 5.622 -11.995 -8.457 1.00 0.00 H new ATOM 0 HB2 GLN A 75 5.985 -10.390 -11.008 1.00 0.00 H new ATOM 0 HB3 GLN A 75 7.208 -10.699 -9.792 1.00 0.00 H new ATOM 0 HG2 GLN A 75 5.870 -12.820 -11.533 1.00 0.00 H new ATOM 0 HG3 GLN A 75 7.476 -12.164 -11.783 1.00 0.00 H new ATOM 0 HE21 GLN A 75 9.118 -12.539 -9.954 1.00 0.00 H new ATOM 0 HE22 GLN A 75 8.953 -14.025 -9.012 1.00 0.00 H new ATOM 646 N THR A 76 5.829 -9.316 -7.921 1.00 0.00 N ATOM 647 CA THR A 76 5.663 -8.112 -7.092 1.00 0.00 C ATOM 648 C THR A 76 6.554 -7.006 -7.626 1.00 0.00 C ATOM 649 O THR A 76 7.775 -7.156 -7.666 1.00 0.00 O ATOM 650 CB THR A 76 6.002 -8.383 -5.617 1.00 0.00 C ATOM 651 OG1 THR A 76 7.154 -9.194 -5.493 1.00 0.00 O ATOM 652 CG2 THR A 76 4.844 -9.067 -4.896 1.00 0.00 C ATOM 0 H THR A 76 6.807 -9.592 -8.012 1.00 0.00 H new ATOM 0 HA THR A 76 4.617 -7.810 -7.142 1.00 0.00 H new ATOM 0 HB THR A 76 6.191 -7.412 -5.159 1.00 0.00 H new ATOM 0 HG1 THR A 76 7.836 -8.893 -6.129 1.00 0.00 H new ATOM 0 HG21 THR A 76 5.117 -9.244 -3.856 1.00 0.00 H new ATOM 0 HG22 THR A 76 3.962 -8.428 -4.936 1.00 0.00 H new ATOM 0 HG23 THR A 76 4.625 -10.018 -5.381 1.00 0.00 H new ATOM 660 N ASP A 77 5.946 -5.895 -8.034 1.00 0.00 N ATOM 661 CA ASP A 77 6.653 -4.739 -8.594 1.00 0.00 C ATOM 662 C ASP A 77 6.746 -3.600 -7.575 1.00 0.00 C ATOM 663 O ASP A 77 5.741 -3.200 -6.991 1.00 0.00 O ATOM 664 CB ASP A 77 5.919 -4.273 -9.849 1.00 0.00 C ATOM 665 CG ASP A 77 6.749 -3.277 -10.678 1.00 0.00 C ATOM 666 OD1 ASP A 77 7.896 -3.616 -11.055 1.00 0.00 O1- ATOM 667 OD2 ASP A 77 6.240 -2.169 -10.968 1.00 0.00 O ATOM 0 H ASP A 77 4.935 -5.767 -7.986 1.00 0.00 H new ATOM 0 HA ASP A 77 7.671 -5.033 -8.848 1.00 0.00 H new ATOM 0 HB2 ASP A 77 5.673 -5.138 -10.465 1.00 0.00 H new ATOM 0 HB3 ASP A 77 4.976 -3.807 -9.563 1.00 0.00 H new ATOM 672 N LYS A 78 7.958 -3.085 -7.364 1.00 0.00 N ATOM 673 CA LYS A 78 8.264 -2.106 -6.312 1.00 0.00 C ATOM 674 C LYS A 78 7.780 -0.691 -6.680 1.00 0.00 C ATOM 675 O LYS A 78 8.098 -0.161 -7.749 1.00 0.00 O ATOM 676 CB LYS A 78 9.771 -2.155 -5.998 1.00 0.00 C ATOM 677 CG LYS A 78 10.144 -1.352 -4.738 1.00 0.00 C ATOM 678 CD LYS A 78 11.652 -1.448 -4.467 1.00 0.00 C ATOM 679 CE LYS A 78 12.053 -0.629 -3.231 1.00 0.00 C ATOM 680 NZ LYS A 78 13.521 -0.660 -3.010 1.00 0.00 N1+ ATOM 0 H LYS A 78 8.770 -3.339 -7.927 1.00 0.00 H new ATOM 0 HA LYS A 78 7.715 -2.371 -5.408 1.00 0.00 H new ATOM 0 HB2 LYS A 78 10.076 -3.193 -5.866 1.00 0.00 H new ATOM 0 HB3 LYS A 78 10.328 -1.765 -6.850 1.00 0.00 H new ATOM 0 HG2 LYS A 78 9.857 -0.308 -4.866 1.00 0.00 H new ATOM 0 HG3 LYS A 78 9.589 -1.732 -3.880 1.00 0.00 H new ATOM 0 HD2 LYS A 78 11.931 -2.491 -4.320 1.00 0.00 H new ATOM 0 HD3 LYS A 78 12.203 -1.090 -5.337 1.00 0.00 H new ATOM 0 HE2 LYS A 78 11.724 0.403 -3.355 1.00 0.00 H new ATOM 0 HE3 LYS A 78 11.543 -1.022 -2.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 13.757 -0.097 -2.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 13.830 -1.643 -2.868 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 14.005 -0.262 -3.840 1.00 0.00 H new ATOM 694 N LEU A 79 7.016 -0.079 -5.772 1.00 0.00 N ATOM 695 CA LEU A 79 6.276 1.170 -5.988 1.00 0.00 C ATOM 696 C LEU A 79 6.916 2.361 -5.265 1.00 0.00 C ATOM 697 O LEU A 79 7.059 3.434 -5.849 1.00 0.00 O ATOM 698 CB LEU A 79 4.841 0.959 -5.474 1.00 0.00 C ATOM 699 CG LEU A 79 4.095 -0.259 -6.052 1.00 0.00 C ATOM 700 CD1 LEU A 79 2.725 -0.310 -5.371 1.00 0.00 C ATOM 701 CD2 LEU A 79 3.955 -0.205 -7.578 1.00 0.00 C ATOM 0 H LEU A 79 6.890 -0.452 -4.831 1.00 0.00 H new ATOM 0 HA LEU A 79 6.288 1.406 -7.052 1.00 0.00 H new ATOM 0 HB2 LEU A 79 4.875 0.860 -4.389 1.00 0.00 H new ATOM 0 HB3 LEU A 79 4.261 1.855 -5.694 1.00 0.00 H new ATOM 0 HG LEU A 79 4.669 -1.164 -5.852 1.00 0.00 H new ATOM 0 HD11 LEU A 79 2.161 -1.161 -5.752 1.00 0.00 H new ATOM 0 HD12 LEU A 79 2.858 -0.415 -4.294 1.00 0.00 H new ATOM 0 HD13 LEU A 79 2.180 0.610 -5.581 1.00 0.00 H new ATOM 0 HD21 LEU A 79 3.421 -1.089 -7.926 1.00 0.00 H new ATOM 0 HD22 LEU A 79 3.399 0.689 -7.861 1.00 0.00 H new ATOM 0 HD23 LEU A 79 4.945 -0.176 -8.033 1.00 0.00 H new ATOM 713 N ALA A 80 7.314 2.158 -4.007 1.00 0.00 N ATOM 714 CA ALA A 80 7.873 3.159 -3.100 1.00 0.00 C ATOM 715 C ALA A 80 8.502 2.478 -1.869 1.00 0.00 C ATOM 716 O ALA A 80 8.343 1.268 -1.677 1.00 0.00 O ATOM 717 CB ALA A 80 6.777 4.177 -2.737 1.00 0.00 C ATOM 0 H ALA A 80 7.251 1.238 -3.571 1.00 0.00 H new ATOM 0 HA ALA A 80 8.680 3.706 -3.587 1.00 0.00 H new ATOM 0 HB1 ALA A 80 7.187 4.927 -2.060 1.00 0.00 H new ATOM 0 HB2 ALA A 80 6.418 4.664 -3.644 1.00 0.00 H new ATOM 0 HB3 ALA A 80 5.949 3.662 -2.249 1.00 0.00 H new ATOM 723 N ALA A 81 9.236 3.242 -1.057 1.00 0.00 N ATOM 724 CA ALA A 81 10.056 2.736 0.048 1.00 0.00 C ATOM 725 C ALA A 81 10.378 3.819 1.096 1.00 0.00 C ATOM 726 O ALA A 81 10.230 5.014 0.831 1.00 0.00 O ATOM 727 CB ALA A 81 11.339 2.128 -0.545 1.00 0.00 C ATOM 0 H ALA A 81 9.278 4.257 -1.152 1.00 0.00 H new ATOM 0 HA ALA A 81 9.491 1.973 0.584 1.00 0.00 H new ATOM 0 HB1 ALA A 81 11.966 1.744 0.260 1.00 0.00 H new ATOM 0 HB2 ALA A 81 11.077 1.314 -1.220 1.00 0.00 H new ATOM 0 HB3 ALA A 81 11.884 2.895 -1.095 1.00 0.00 H new ATOM 733 N PHE A 82 10.860 3.389 2.265 1.00 0.00 N ATOM 734 CA PHE A 82 11.404 4.242 3.323 1.00 0.00 C ATOM 735 C PHE A 82 12.534 3.508 4.085 1.00 0.00 C ATOM 736 O PHE A 82 12.273 2.438 4.640 1.00 0.00 O ATOM 737 CB PHE A 82 10.283 4.681 4.277 1.00 0.00 C ATOM 738 CG PHE A 82 10.768 5.620 5.365 1.00 0.00 C ATOM 739 CD1 PHE A 82 10.847 7.003 5.116 1.00 0.00 C ATOM 740 CD2 PHE A 82 11.188 5.109 6.609 1.00 0.00 C ATOM 741 CE1 PHE A 82 11.339 7.871 6.107 1.00 0.00 C ATOM 742 CE2 PHE A 82 11.677 5.978 7.601 1.00 0.00 C ATOM 743 CZ PHE A 82 11.754 7.359 7.349 1.00 0.00 C ATOM 0 H PHE A 82 10.883 2.399 2.509 1.00 0.00 H new ATOM 0 HA PHE A 82 11.834 5.135 2.870 1.00 0.00 H new ATOM 0 HB2 PHE A 82 9.497 5.172 3.704 1.00 0.00 H new ATOM 0 HB3 PHE A 82 9.838 3.799 4.737 1.00 0.00 H new ATOM 0 HD1 PHE A 82 10.529 7.398 4.162 1.00 0.00 H new ATOM 0 HD2 PHE A 82 11.134 4.048 6.801 1.00 0.00 H new ATOM 0 HE1 PHE A 82 11.398 8.932 5.914 1.00 0.00 H new ATOM 0 HE2 PHE A 82 11.993 5.585 8.556 1.00 0.00 H new ATOM 0 HZ PHE A 82 12.132 8.026 8.109 1.00 0.00 H new ATOM 753 N PRO A 83 13.766 4.056 4.163 1.00 0.00 N ATOM 754 CA PRO A 83 14.268 5.211 3.418 1.00 0.00 C ATOM 755 C PRO A 83 14.126 5.021 1.901 1.00 0.00 C ATOM 756 O PRO A 83 14.247 3.903 1.397 1.00 0.00 O ATOM 757 CB PRO A 83 15.741 5.365 3.819 1.00 0.00 C ATOM 758 CG PRO A 83 15.819 4.670 5.178 1.00 0.00 C ATOM 759 CD PRO A 83 14.815 3.532 5.025 1.00 0.00 C ATOM 0 HA PRO A 83 13.691 6.105 3.657 1.00 0.00 H new ATOM 0 HB2 PRO A 83 16.405 4.898 3.092 1.00 0.00 H new ATOM 0 HB3 PRO A 83 16.030 6.414 3.888 1.00 0.00 H new ATOM 0 HG2 PRO A 83 16.823 4.300 5.388 1.00 0.00 H new ATOM 0 HG3 PRO A 83 15.550 5.342 5.993 1.00 0.00 H new ATOM 0 HD2 PRO A 83 15.283 2.652 4.584 1.00 0.00 H new ATOM 0 HD3 PRO A 83 14.414 3.229 5.992 1.00 0.00 H new ATOM 907 N ARG A 94 4.203 8.632 -8.984 1.00 0.00 N ATOM 908 CA ARG A 94 2.783 8.572 -8.597 1.00 0.00 C ATOM 909 C ARG A 94 2.561 7.798 -7.293 1.00 0.00 C ATOM 910 O ARG A 94 1.632 8.125 -6.550 1.00 0.00 O ATOM 911 CB ARG A 94 1.946 7.898 -9.695 1.00 0.00 C ATOM 912 CG ARG A 94 1.908 8.697 -11.008 1.00 0.00 C ATOM 913 CD ARG A 94 1.046 7.990 -12.061 1.00 0.00 C ATOM 914 NE ARG A 94 -0.367 7.909 -11.639 1.00 0.00 N ATOM 915 CZ ARG A 94 -1.112 6.817 -11.511 1.00 0.00 C ATOM 916 NH1 ARG A 94 -0.676 5.604 -11.779 1.00 0.00 N1+ ATOM 917 NH2 ARG A 94 -2.349 6.929 -11.095 1.00 0.00 N ATOM 0 HA ARG A 94 2.469 9.606 -8.452 1.00 0.00 H new ATOM 0 HB2 ARG A 94 2.351 6.906 -9.893 1.00 0.00 H new ATOM 0 HB3 ARG A 94 0.927 7.760 -9.332 1.00 0.00 H new ATOM 0 HG2 ARG A 94 1.511 9.694 -10.819 1.00 0.00 H new ATOM 0 HG3 ARG A 94 2.921 8.824 -11.389 1.00 0.00 H new ATOM 0 HD2 ARG A 94 1.114 8.526 -13.008 1.00 0.00 H new ATOM 0 HD3 ARG A 94 1.433 6.986 -12.235 1.00 0.00 H new ATOM 0 HE ARG A 94 -0.824 8.794 -11.420 1.00 0.00 H new ATOM 0 HH11 ARG A 94 0.281 5.466 -12.104 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -1.295 4.802 -11.662 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -2.731 7.848 -10.873 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -2.930 6.097 -10.993 1.00 0.00 H new ATOM 931 N PHE A 95 3.373 6.774 -7.022 1.00 0.00 N ATOM 932 CA PHE A 95 3.329 5.988 -5.786 1.00 0.00 C ATOM 933 C PHE A 95 4.221 6.608 -4.694 1.00 0.00 C ATOM 934 O PHE A 95 5.303 7.122 -4.989 1.00 0.00 O ATOM 935 CB PHE A 95 3.747 4.544 -6.091 1.00 0.00 C ATOM 936 CG PHE A 95 2.872 3.829 -7.111 1.00 0.00 C ATOM 937 CD1 PHE A 95 1.525 3.544 -6.816 1.00 0.00 C ATOM 938 CD2 PHE A 95 3.403 3.439 -8.354 1.00 0.00 C ATOM 939 CE1 PHE A 95 0.714 2.891 -7.763 1.00 0.00 C ATOM 940 CE2 PHE A 95 2.587 2.808 -9.311 1.00 0.00 C ATOM 941 CZ PHE A 95 1.242 2.532 -9.015 1.00 0.00 C ATOM 0 H PHE A 95 4.096 6.461 -7.670 1.00 0.00 H new ATOM 0 HA PHE A 95 2.309 5.991 -5.401 1.00 0.00 H new ATOM 0 HB2 PHE A 95 4.775 4.547 -6.453 1.00 0.00 H new ATOM 0 HB3 PHE A 95 3.738 3.974 -5.162 1.00 0.00 H new ATOM 0 HD1 PHE A 95 1.112 3.828 -5.859 1.00 0.00 H new ATOM 0 HD2 PHE A 95 4.444 3.625 -8.575 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -0.316 2.665 -7.527 1.00 0.00 H new ATOM 0 HE2 PHE A 95 2.995 2.536 -10.273 1.00 0.00 H new ATOM 0 HZ PHE A 95 0.615 2.045 -9.748 1.00 0.00 H new ATOM 951 N ARG A 96 3.765 6.558 -3.435 1.00 0.00 N ATOM 952 CA ARG A 96 4.385 7.237 -2.282 1.00 0.00 C ATOM 953 C ARG A 96 4.312 6.405 -0.991 1.00 0.00 C ATOM 954 O ARG A 96 3.379 5.623 -0.809 1.00 0.00 O ATOM 955 CB ARG A 96 3.647 8.560 -2.002 1.00 0.00 C ATOM 956 CG ARG A 96 3.552 9.535 -3.187 1.00 0.00 C ATOM 957 CD ARG A 96 2.861 10.842 -2.771 1.00 0.00 C ATOM 958 NE ARG A 96 1.484 10.597 -2.301 1.00 0.00 N ATOM 959 CZ ARG A 96 0.468 11.447 -2.282 1.00 0.00 C ATOM 960 NH1 ARG A 96 0.587 12.714 -2.618 1.00 0.00 N1+ ATOM 961 NH2 ARG A 96 -0.709 10.998 -1.921 1.00 0.00 N ATOM 0 H ARG A 96 2.931 6.030 -3.180 1.00 0.00 H new ATOM 0 HA ARG A 96 5.431 7.395 -2.546 1.00 0.00 H new ATOM 0 HB2 ARG A 96 2.637 8.327 -1.665 1.00 0.00 H new ATOM 0 HB3 ARG A 96 4.149 9.067 -1.178 1.00 0.00 H new ATOM 0 HG2 ARG A 96 4.551 9.752 -3.565 1.00 0.00 H new ATOM 0 HG3 ARG A 96 2.997 9.070 -4.002 1.00 0.00 H new ATOM 0 HD2 ARG A 96 3.436 11.324 -1.981 1.00 0.00 H new ATOM 0 HD3 ARG A 96 2.842 11.530 -3.616 1.00 0.00 H new ATOM 0 HE ARG A 96 1.291 9.660 -1.948 1.00 0.00 H new ATOM 0 HH11 ARG A 96 1.493 13.081 -2.910 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -0.227 13.329 -2.587 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -0.824 10.018 -1.664 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -1.510 11.629 -1.897 1.00 0.00 H new ATOM 975 N VAL A 97 5.254 6.645 -0.075 1.00 0.00 N ATOM 976 CA VAL A 97 5.260 6.165 1.325 1.00 0.00 C ATOM 977 C VAL A 97 5.447 7.369 2.257 1.00 0.00 C ATOM 978 O VAL A 97 6.340 8.188 2.027 1.00 0.00 O ATOM 979 CB VAL A 97 6.386 5.130 1.584 1.00 0.00 C ATOM 980 CG1 VAL A 97 6.650 4.873 3.080 1.00 0.00 C ATOM 981 CG2 VAL A 97 6.048 3.777 0.940 1.00 0.00 C ATOM 0 H VAL A 97 6.077 7.206 -0.292 1.00 0.00 H new ATOM 0 HA VAL A 97 4.310 5.667 1.518 1.00 0.00 H new ATOM 0 HB VAL A 97 7.280 5.569 1.140 1.00 0.00 H new ATOM 0 HG11 VAL A 97 7.449 4.139 3.188 1.00 0.00 H new ATOM 0 HG12 VAL A 97 6.945 5.805 3.563 1.00 0.00 H new ATOM 0 HG13 VAL A 97 5.743 4.493 3.550 1.00 0.00 H new ATOM 0 HG21 VAL A 97 6.853 3.069 1.136 1.00 0.00 H new ATOM 0 HG22 VAL A 97 5.118 3.395 1.362 1.00 0.00 H new ATOM 0 HG23 VAL A 97 5.932 3.905 -0.136 1.00 0.00 H new ATOM 991 N THR A 98 4.640 7.444 3.323 1.00 0.00 N ATOM 992 CA THR A 98 4.800 8.383 4.446 1.00 0.00 C ATOM 993 C THR A 98 4.879 7.584 5.743 1.00 0.00 C ATOM 994 O THR A 98 3.992 6.785 6.030 1.00 0.00 O ATOM 995 CB THR A 98 3.625 9.367 4.502 1.00 0.00 C ATOM 996 OG1 THR A 98 3.582 10.098 3.296 1.00 0.00 O ATOM 997 CG2 THR A 98 3.761 10.379 5.643 1.00 0.00 C ATOM 0 H THR A 98 3.830 6.834 3.433 1.00 0.00 H new ATOM 0 HA THR A 98 5.714 8.960 4.308 1.00 0.00 H new ATOM 0 HB THR A 98 2.722 8.778 4.662 1.00 0.00 H new ATOM 0 HG1 THR A 98 2.832 10.729 3.322 1.00 0.00 H new ATOM 0 HG21 THR A 98 2.903 11.051 5.637 1.00 0.00 H new ATOM 0 HG22 THR A 98 3.801 9.850 6.595 1.00 0.00 H new ATOM 0 HG23 THR A 98 4.676 10.957 5.510 1.00 0.00 H new ATOM 1005 N GLN A 99 5.925 7.798 6.535 1.00 0.00 N ATOM 1006 CA GLN A 99 6.095 7.196 7.859 1.00 0.00 C ATOM 1007 C GLN A 99 5.346 8.001 8.935 1.00 0.00 C ATOM 1008 O GLN A 99 5.330 9.235 8.901 1.00 0.00 O ATOM 1009 CB GLN A 99 7.597 7.018 8.178 1.00 0.00 C ATOM 1010 CG GLN A 99 8.379 8.261 8.660 1.00 0.00 C ATOM 1011 CD GLN A 99 8.531 9.410 7.652 1.00 0.00 C ATOM 1012 OE1 GLN A 99 8.260 9.310 6.462 1.00 0.00 O ATOM 1013 NE2 GLN A 99 8.988 10.566 8.093 1.00 0.00 N ATOM 0 H GLN A 99 6.698 8.409 6.270 1.00 0.00 H new ATOM 0 HA GLN A 99 5.648 6.202 7.857 1.00 0.00 H new ATOM 0 HB2 GLN A 99 7.689 6.246 8.942 1.00 0.00 H new ATOM 0 HB3 GLN A 99 8.088 6.639 7.282 1.00 0.00 H new ATOM 0 HG2 GLN A 99 7.884 8.651 9.550 1.00 0.00 H new ATOM 0 HG3 GLN A 99 9.375 7.940 8.964 1.00 0.00 H new ATOM 0 HE21 GLN A 99 9.222 10.679 9.079 1.00 0.00 H new ATOM 0 HE22 GLN A 99 9.107 11.347 7.448 1.00 0.00 H new ATOM 1022 N LEU A 100 4.736 7.310 9.904 1.00 0.00 N ATOM 1023 CA LEU A 100 4.006 7.935 11.014 1.00 0.00 C ATOM 1024 C LEU A 100 4.941 8.252 12.199 1.00 0.00 C ATOM 1025 O LEU A 100 5.956 7.564 12.372 1.00 0.00 O ATOM 1026 CB LEU A 100 2.839 7.024 11.461 1.00 0.00 C ATOM 1027 CG LEU A 100 1.840 6.619 10.358 1.00 0.00 C ATOM 1028 CD1 LEU A 100 0.579 6.016 10.994 1.00 0.00 C ATOM 1029 CD2 LEU A 100 1.419 7.778 9.440 1.00 0.00 C ATOM 0 H LEU A 100 4.735 6.291 9.941 1.00 0.00 H new ATOM 0 HA LEU A 100 3.598 8.882 10.661 1.00 0.00 H new ATOM 0 HB2 LEU A 100 3.258 6.117 11.896 1.00 0.00 H new ATOM 0 HB3 LEU A 100 2.289 7.533 12.253 1.00 0.00 H new ATOM 0 HG LEU A 100 2.362 5.891 9.737 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -0.123 5.732 10.210 1.00 0.00 H new ATOM 0 HD12 LEU A 100 0.850 5.135 11.575 1.00 0.00 H new ATOM 0 HD13 LEU A 100 0.114 6.753 11.648 1.00 0.00 H new ATOM 0 HD21 LEU A 100 0.716 7.412 8.691 1.00 0.00 H new ATOM 0 HD22 LEU A 100 0.943 8.558 10.034 1.00 0.00 H new ATOM 0 HD23 LEU A 100 2.299 8.186 8.943 1.00 0.00 H new ATOM 1041 N PRO A 101 4.585 9.224 13.066 1.00 0.00 N ATOM 1042 CA PRO A 101 5.354 9.552 14.268 1.00 0.00 C ATOM 1043 C PRO A 101 5.367 8.438 15.331 1.00 0.00 C ATOM 1044 O PRO A 101 6.088 8.573 16.318 1.00 0.00 O ATOM 1045 CB PRO A 101 4.742 10.854 14.803 1.00 0.00 C ATOM 1046 CG PRO A 101 3.299 10.797 14.310 1.00 0.00 C ATOM 1047 CD PRO A 101 3.447 10.132 12.945 1.00 0.00 C ATOM 0 HA PRO A 101 6.409 9.666 14.017 1.00 0.00 H new ATOM 0 HB2 PRO A 101 4.793 10.904 15.891 1.00 0.00 H new ATOM 0 HB3 PRO A 101 5.263 11.731 14.418 1.00 0.00 H new ATOM 0 HG2 PRO A 101 2.664 10.216 14.979 1.00 0.00 H new ATOM 0 HG3 PRO A 101 2.856 11.790 14.233 1.00 0.00 H new ATOM 0 HD2 PRO A 101 2.541 9.590 12.674 1.00 0.00 H new ATOM 0 HD3 PRO A 101 3.620 10.874 12.165 1.00 0.00 H new ATOM 1055 N ASN A 102 4.631 7.327 15.147 1.00 0.00 N ATOM 1056 CA ASN A 102 4.735 6.156 16.034 1.00 0.00 C ATOM 1057 C ASN A 102 6.058 5.366 15.854 1.00 0.00 C ATOM 1058 O ASN A 102 6.375 4.485 16.655 1.00 0.00 O ATOM 1059 CB ASN A 102 3.493 5.268 15.843 1.00 0.00 C ATOM 1060 CG ASN A 102 3.313 4.276 16.995 1.00 0.00 C ATOM 1061 OD1 ASN A 102 3.422 4.619 18.168 1.00 0.00 O ATOM 1062 ND2 ASN A 102 3.020 3.021 16.707 1.00 0.00 N ATOM 0 H ASN A 102 3.956 7.216 14.390 1.00 0.00 H new ATOM 0 HA ASN A 102 4.766 6.512 17.064 1.00 0.00 H new ATOM 0 HB2 ASN A 102 2.606 5.897 15.765 1.00 0.00 H new ATOM 0 HB3 ASN A 102 3.580 4.721 14.904 1.00 0.00 H new ATOM 0 HD21 ASN A 102 2.886 2.343 17.458 1.00 0.00 H new ATOM 0 HD22 ASN A 102 2.928 2.729 15.734 1.00 0.00 H new ATOM 1069 N GLY A 103 6.843 5.673 14.808 1.00 0.00 N ATOM 1070 CA GLY A 103 8.221 5.198 14.597 1.00 0.00 C ATOM 1071 C GLY A 103 8.371 3.914 13.774 1.00 0.00 C ATOM 1072 O GLY A 103 9.457 3.674 13.242 1.00 0.00 O ATOM 0 H GLY A 103 6.522 6.283 14.056 1.00 0.00 H new ATOM 0 HA2 GLY A 103 8.785 5.990 14.104 1.00 0.00 H new ATOM 0 HA3 GLY A 103 8.682 5.037 15.572 1.00 0.00 H new ATOM 1076 N ARG A 104 7.310 3.107 13.642 1.00 0.00 N ATOM 1077 CA ARG A 104 7.262 1.921 12.771 1.00 0.00 C ATOM 1078 C ARG A 104 5.816 1.602 12.361 1.00 0.00 C ATOM 1079 O ARG A 104 5.192 0.645 12.815 1.00 0.00 O ATOM 1080 CB ARG A 104 8.038 0.731 13.382 1.00 0.00 C ATOM 1081 CG ARG A 104 7.767 0.437 14.872 1.00 0.00 C ATOM 1082 CD ARG A 104 8.474 -0.841 15.355 1.00 0.00 C ATOM 1083 NE ARG A 104 9.946 -0.748 15.255 1.00 0.00 N ATOM 1084 CZ ARG A 104 10.817 -1.731 15.461 1.00 0.00 C ATOM 1085 NH1 ARG A 104 10.447 -2.935 15.842 1.00 0.00 N1+ ATOM 1086 NH2 ARG A 104 12.101 -1.522 15.277 1.00 0.00 N ATOM 0 H ARG A 104 6.439 3.263 14.150 1.00 0.00 H new ATOM 0 HA ARG A 104 7.787 2.142 11.842 1.00 0.00 H new ATOM 0 HB2 ARG A 104 7.801 -0.164 12.807 1.00 0.00 H new ATOM 0 HB3 ARG A 104 9.105 0.917 13.258 1.00 0.00 H new ATOM 0 HG2 ARG A 104 8.101 1.283 15.473 1.00 0.00 H new ATOM 0 HG3 ARG A 104 6.693 0.337 15.030 1.00 0.00 H new ATOM 0 HD2 ARG A 104 8.195 -1.037 16.390 1.00 0.00 H new ATOM 0 HD3 ARG A 104 8.126 -1.689 14.765 1.00 0.00 H new ATOM 0 HE ARG A 104 10.332 0.162 15.003 1.00 0.00 H new ATOM 0 HH11 ARG A 104 9.459 -3.142 15.990 1.00 0.00 H new ATOM 0 HH12 ARG A 104 11.148 -3.661 15.989 1.00 0.00 H new ATOM 0 HH21 ARG A 104 12.430 -0.605 14.976 1.00 0.00 H new ATOM 0 HH22 ARG A 104 12.768 -2.277 15.435 1.00 0.00 H new ATOM 1100 N ASP A 105 5.300 2.435 11.461 1.00 0.00 N ATOM 1101 CA ASP A 105 3.952 2.457 10.907 1.00 0.00 C ATOM 1102 C ASP A 105 3.958 3.396 9.693 1.00 0.00 C ATOM 1103 O ASP A 105 4.667 4.409 9.703 1.00 0.00 O ATOM 1104 CB ASP A 105 2.974 2.998 11.948 1.00 0.00 C ATOM 1105 CG ASP A 105 2.366 1.921 12.855 1.00 0.00 C ATOM 1106 OD1 ASP A 105 1.741 0.975 12.322 1.00 0.00 O ATOM 1107 OD2 ASP A 105 2.474 2.063 14.096 1.00 0.00 O1- ATOM 0 H ASP A 105 5.871 3.182 11.065 1.00 0.00 H new ATOM 0 HA ASP A 105 3.647 1.451 10.621 1.00 0.00 H new ATOM 0 HB2 ASP A 105 3.489 3.732 12.568 1.00 0.00 H new ATOM 0 HB3 ASP A 105 2.168 3.523 11.435 1.00 0.00 H new ATOM 1112 N PHE A 106 3.177 3.072 8.658 1.00 0.00 N ATOM 1113 CA PHE A 106 3.282 3.739 7.360 1.00 0.00 C ATOM 1114 C PHE A 106 1.942 3.871 6.620 1.00 0.00 C ATOM 1115 O PHE A 106 1.071 3.005 6.699 1.00 0.00 O ATOM 1116 CB PHE A 106 4.281 2.955 6.489 1.00 0.00 C ATOM 1117 CG PHE A 106 5.643 2.717 7.119 1.00 0.00 C ATOM 1118 CD1 PHE A 106 6.680 3.653 6.950 1.00 0.00 C ATOM 1119 CD2 PHE A 106 5.862 1.572 7.915 1.00 0.00 C ATOM 1120 CE1 PHE A 106 7.917 3.459 7.591 1.00 0.00 C ATOM 1121 CE2 PHE A 106 7.096 1.384 8.564 1.00 0.00 C ATOM 1122 CZ PHE A 106 8.123 2.329 8.402 1.00 0.00 C ATOM 0 H PHE A 106 2.461 2.347 8.697 1.00 0.00 H new ATOM 0 HA PHE A 106 3.624 4.757 7.545 1.00 0.00 H new ATOM 0 HB2 PHE A 106 3.841 1.990 6.239 1.00 0.00 H new ATOM 0 HB3 PHE A 106 4.421 3.493 5.552 1.00 0.00 H new ATOM 0 HD1 PHE A 106 6.526 4.522 6.327 1.00 0.00 H new ATOM 0 HD2 PHE A 106 5.079 0.837 8.026 1.00 0.00 H new ATOM 0 HE1 PHE A 106 8.711 4.180 7.460 1.00 0.00 H new ATOM 0 HE2 PHE A 106 7.254 0.515 9.186 1.00 0.00 H new ATOM 0 HZ PHE A 106 9.071 2.187 8.900 1.00 0.00 H new ATOM 1132 N HIS A 107 1.811 4.959 5.860 1.00 0.00 N ATOM 1133 CA HIS A 107 0.751 5.196 4.878 1.00 0.00 C ATOM 1134 C HIS A 107 1.333 5.114 3.453 1.00 0.00 C ATOM 1135 O HIS A 107 2.316 5.786 3.134 1.00 0.00 O ATOM 1136 CB HIS A 107 0.108 6.571 5.121 1.00 0.00 C ATOM 1137 CG HIS A 107 -0.809 6.675 6.315 1.00 0.00 C ATOM 1138 ND1 HIS A 107 -1.382 7.868 6.766 1.00 0.00 N ATOM 1139 CD2 HIS A 107 -1.274 5.649 7.087 1.00 0.00 C ATOM 1140 CE1 HIS A 107 -2.168 7.527 7.800 1.00 0.00 C ATOM 1141 NE2 HIS A 107 -2.124 6.201 8.016 1.00 0.00 N ATOM 0 H HIS A 107 2.471 5.735 5.914 1.00 0.00 H new ATOM 0 HA HIS A 107 -0.018 4.431 4.986 1.00 0.00 H new ATOM 0 HB2 HIS A 107 0.904 7.306 5.235 1.00 0.00 H new ATOM 0 HB3 HIS A 107 -0.456 6.848 4.230 1.00 0.00 H new ATOM 0 HD2 HIS A 107 -1.022 4.604 6.987 1.00 0.00 H new ATOM 0 HE1 HIS A 107 -2.756 8.224 8.379 1.00 0.00 H new ATOM 0 HE2 HIS A 107 -2.632 5.694 8.741 1.00 0.00 H new ATOM 1149 N MET A 108 0.715 4.303 2.596 1.00 0.00 N ATOM 1150 CA MET A 108 1.128 4.021 1.216 1.00 0.00 C ATOM 1151 C MET A 108 0.076 4.588 0.268 1.00 0.00 C ATOM 1152 O MET A 108 -1.098 4.269 0.435 1.00 0.00 O ATOM 1153 CB MET A 108 1.203 2.498 1.016 1.00 0.00 C ATOM 1154 CG MET A 108 2.489 1.852 1.539 1.00 0.00 C ATOM 1155 SD MET A 108 2.805 2.008 3.315 1.00 0.00 S ATOM 1156 CE MET A 108 4.195 0.866 3.456 1.00 0.00 C ATOM 0 H MET A 108 -0.132 3.797 2.856 1.00 0.00 H new ATOM 0 HA MET A 108 2.101 4.471 1.017 1.00 0.00 H new ATOM 0 HB2 MET A 108 0.351 2.036 1.514 1.00 0.00 H new ATOM 0 HB3 MET A 108 1.108 2.279 -0.047 1.00 0.00 H new ATOM 0 HG2 MET A 108 2.465 0.791 1.288 1.00 0.00 H new ATOM 0 HG3 MET A 108 3.332 2.287 1.003 1.00 0.00 H new ATOM 0 HE1 MET A 108 4.860 1.198 4.253 1.00 0.00 H new ATOM 0 HE2 MET A 108 3.824 -0.133 3.686 1.00 0.00 H new ATOM 0 HE3 MET A 108 4.743 0.841 2.514 1.00 0.00 H new ATOM 1166 N SER A 109 0.437 5.414 -0.716 1.00 0.00 N ATOM 1167 CA SER A 109 -0.576 6.119 -1.516 1.00 0.00 C ATOM 1168 C SER A 109 -0.280 6.292 -3.014 1.00 0.00 C ATOM 1169 O SER A 109 0.870 6.427 -3.432 1.00 0.00 O ATOM 1170 CB SER A 109 -0.918 7.472 -0.874 1.00 0.00 C ATOM 1171 OG SER A 109 0.187 8.364 -0.831 1.00 0.00 O ATOM 0 H SER A 109 1.403 5.611 -0.978 1.00 0.00 H new ATOM 0 HA SER A 109 -1.435 5.449 -1.499 1.00 0.00 H new ATOM 0 HB2 SER A 109 -1.731 7.937 -1.432 1.00 0.00 H new ATOM 0 HB3 SER A 109 -1.282 7.305 0.140 1.00 0.00 H new ATOM 0 HG SER A 109 0.100 8.956 -0.055 1.00 0.00 H new ATOM 1177 N VAL A 110 -1.355 6.314 -3.814 1.00 0.00 N ATOM 1178 CA VAL A 110 -1.373 6.582 -5.261 1.00 0.00 C ATOM 1179 C VAL A 110 -1.876 8.009 -5.489 1.00 0.00 C ATOM 1180 O VAL A 110 -2.999 8.337 -5.095 1.00 0.00 O ATOM 1181 CB VAL A 110 -2.310 5.618 -6.042 1.00 0.00 C ATOM 1182 CG1 VAL A 110 -2.066 5.736 -7.558 1.00 0.00 C ATOM 1183 CG2 VAL A 110 -2.172 4.147 -5.618 1.00 0.00 C ATOM 0 H VAL A 110 -2.290 6.135 -3.448 1.00 0.00 H new ATOM 0 HA VAL A 110 -0.357 6.438 -5.628 1.00 0.00 H new ATOM 0 HB VAL A 110 -3.325 5.929 -5.796 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -2.731 5.054 -8.088 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -2.264 6.758 -7.880 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -1.030 5.479 -7.781 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -2.856 3.534 -6.205 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.148 3.814 -5.788 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -2.414 4.049 -4.560 1.00 0.00 H new ATOM 1193 N VAL A 111 -1.068 8.834 -6.158 1.00 0.00 N ATOM 1194 CA VAL A 111 -1.464 10.163 -6.658 1.00 0.00 C ATOM 1195 C VAL A 111 -2.383 10.004 -7.874 1.00 0.00 C ATOM 1196 O VAL A 111 -1.973 9.429 -8.885 1.00 0.00 O ATOM 1197 CB VAL A 111 -0.231 11.022 -7.037 1.00 0.00 C ATOM 1198 CG1 VAL A 111 -0.625 12.367 -7.676 1.00 0.00 C ATOM 1199 CG2 VAL A 111 0.624 11.323 -5.799 1.00 0.00 C ATOM 0 H VAL A 111 -0.100 8.597 -6.374 1.00 0.00 H new ATOM 0 HA VAL A 111 -1.996 10.679 -5.858 1.00 0.00 H new ATOM 0 HB VAL A 111 0.332 10.435 -7.762 1.00 0.00 H new ATOM 0 HG11 VAL A 111 0.275 12.930 -7.923 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -1.199 12.184 -8.584 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -1.230 12.940 -6.974 1.00 0.00 H new ATOM 0 HG21 VAL A 111 1.484 11.927 -6.089 1.00 0.00 H new ATOM 0 HG22 VAL A 111 0.027 11.869 -5.068 1.00 0.00 H new ATOM 0 HG23 VAL A 111 0.969 10.387 -5.359 1.00 0.00 H new ATOM 1209 N ARG A 112 -3.606 10.547 -7.772 1.00 0.00 N ATOM 1210 CA ARG A 112 -4.599 10.660 -8.859 1.00 0.00 C ATOM 1211 C ARG A 112 -4.795 9.328 -9.592 1.00 0.00 C ATOM 1212 O ARG A 112 -4.298 9.120 -10.704 1.00 0.00 O ATOM 1213 CB ARG A 112 -4.232 11.819 -9.803 1.00 0.00 C ATOM 1214 CG ARG A 112 -4.278 13.166 -9.067 1.00 0.00 C ATOM 1215 CD ARG A 112 -3.985 14.333 -10.016 1.00 0.00 C ATOM 1216 NE ARG A 112 -4.042 15.624 -9.307 1.00 0.00 N ATOM 1217 CZ ARG A 112 -3.778 16.819 -9.824 1.00 0.00 C ATOM 1218 NH1 ARG A 112 -3.424 16.975 -11.083 1.00 0.00 N1+ ATOM 1219 NH2 ARG A 112 -3.868 17.891 -9.067 1.00 0.00 N ATOM 0 H ARG A 112 -3.947 10.937 -6.893 1.00 0.00 H new ATOM 0 HA ARG A 112 -5.568 10.898 -8.419 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -3.234 11.658 -10.211 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -4.922 11.838 -10.646 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -5.260 13.301 -8.614 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -3.550 13.164 -8.255 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -2.999 14.203 -10.462 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -4.707 14.331 -10.832 1.00 0.00 H new ATOM 0 HE ARG A 112 -4.310 15.597 -8.323 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -3.345 16.163 -11.695 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -3.229 17.908 -11.446 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -4.139 17.803 -8.088 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -3.666 18.811 -9.459 1.00 0.00 H new ATOM 1233 N ALA A 113 -5.460 8.390 -8.924 1.00 0.00 N ATOM 1234 CA ALA A 113 -5.620 7.012 -9.378 1.00 0.00 C ATOM 1235 C ALA A 113 -6.505 6.919 -10.638 1.00 0.00 C ATOM 1236 O ALA A 113 -7.548 7.566 -10.719 1.00 0.00 O ATOM 1237 CB ALA A 113 -6.161 6.202 -8.197 1.00 0.00 C ATOM 0 H ALA A 113 -5.914 8.572 -8.029 1.00 0.00 H new ATOM 0 HA ALA A 113 -4.662 6.596 -9.689 1.00 0.00 H new ATOM 0 HB1 ALA A 113 -6.294 5.163 -8.499 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -5.455 6.251 -7.368 1.00 0.00 H new ATOM 0 HB3 ALA A 113 -7.120 6.614 -7.882 1.00 0.00 H new ATOM 1243 N ARG A 114 -6.080 6.121 -11.621 1.00 0.00 N ATOM 1244 CA ARG A 114 -6.802 5.810 -12.864 1.00 0.00 C ATOM 1245 C ARG A 114 -7.425 4.412 -12.771 1.00 0.00 C ATOM 1246 O ARG A 114 -6.920 3.561 -12.039 1.00 0.00 O ATOM 1247 CB ARG A 114 -5.836 5.876 -14.065 1.00 0.00 C ATOM 1248 CG ARG A 114 -5.710 7.272 -14.694 1.00 0.00 C ATOM 1249 CD ARG A 114 -5.102 8.342 -13.780 1.00 0.00 C ATOM 1250 NE ARG A 114 -4.836 9.572 -14.547 1.00 0.00 N ATOM 1251 CZ ARG A 114 -4.044 10.577 -14.191 1.00 0.00 C ATOM 1252 NH1 ARG A 114 -3.478 10.636 -13.004 1.00 0.00 N ATOM 1253 NH2 ARG A 114 -3.808 11.552 -15.042 1.00 0.00 N1+ ATOM 0 H ARG A 114 -5.177 5.649 -11.572 1.00 0.00 H new ATOM 0 HA ARG A 114 -7.595 6.544 -13.006 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -4.849 5.545 -13.742 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -6.174 5.175 -14.828 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -5.100 7.195 -15.594 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -6.700 7.603 -15.008 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -5.783 8.558 -12.957 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -4.176 7.972 -13.339 1.00 0.00 H new ATOM 0 HE ARG A 114 -5.310 9.661 -15.446 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -3.642 9.894 -12.323 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -2.875 11.423 -12.765 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -4.232 11.533 -15.969 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -3.201 12.327 -14.774 1.00 0.00 H new ATOM 1267 N ARG A 115 -8.464 4.121 -13.565 1.00 0.00 N ATOM 1268 CA ARG A 115 -9.090 2.783 -13.643 1.00 0.00 C ATOM 1269 C ARG A 115 -8.082 1.647 -13.914 1.00 0.00 C ATOM 1270 O ARG A 115 -8.247 0.545 -13.390 1.00 0.00 O ATOM 1271 CB ARG A 115 -10.230 2.813 -14.673 1.00 0.00 C ATOM 1272 CG ARG A 115 -11.486 3.448 -14.049 1.00 0.00 C ATOM 1273 CD ARG A 115 -12.576 3.744 -15.081 1.00 0.00 C ATOM 1274 NE ARG A 115 -12.252 4.957 -15.845 1.00 0.00 N ATOM 1275 CZ ARG A 115 -12.941 5.511 -16.830 1.00 0.00 C ATOM 1276 NH1 ARG A 115 -13.952 4.905 -17.418 1.00 0.00 N1+ ATOM 1277 NH2 ARG A 115 -12.605 6.718 -17.218 1.00 0.00 N ATOM 0 H ARG A 115 -8.901 4.809 -14.178 1.00 0.00 H new ATOM 0 HA ARG A 115 -9.504 2.551 -12.662 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -9.923 3.381 -15.551 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -10.453 1.801 -15.010 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -11.886 2.779 -13.287 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -11.208 4.374 -13.546 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -12.681 2.898 -15.760 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -13.535 3.870 -14.579 1.00 0.00 H new ATOM 0 HE ARG A 115 -11.388 5.431 -15.583 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -14.231 3.971 -17.118 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -14.455 5.370 -18.174 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -11.832 7.203 -16.763 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -13.117 7.172 -17.975 1.00 0.00 H new ATOM 1291 N ASN A 116 -6.992 1.939 -14.632 1.00 0.00 N ATOM 1292 CA ASN A 116 -5.868 1.027 -14.876 1.00 0.00 C ATOM 1293 C ASN A 116 -5.089 0.595 -13.606 1.00 0.00 C ATOM 1294 O ASN A 116 -4.472 -0.472 -13.611 1.00 0.00 O ATOM 1295 CB ASN A 116 -4.932 1.715 -15.885 1.00 0.00 C ATOM 1296 CG ASN A 116 -3.788 0.811 -16.338 1.00 0.00 C ATOM 1297 OD1 ASN A 116 -3.983 -0.142 -17.084 1.00 0.00 O ATOM 1298 ND2 ASN A 116 -2.567 1.076 -15.903 1.00 0.00 N ATOM 0 H ASN A 116 -6.863 2.849 -15.075 1.00 0.00 H new ATOM 0 HA ASN A 116 -6.275 0.094 -15.265 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -5.509 2.028 -16.755 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -4.520 2.618 -15.435 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -1.785 0.487 -16.188 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -2.408 1.870 -15.282 1.00 0.00 H new ATOM 1305 N ASP A 117 -5.102 1.379 -12.516 1.00 0.00 N ATOM 1306 CA ASP A 117 -4.374 1.051 -11.278 1.00 0.00 C ATOM 1307 C ASP A 117 -5.053 -0.066 -10.462 1.00 0.00 C ATOM 1308 O ASP A 117 -4.386 -0.723 -9.664 1.00 0.00 O ATOM 1309 CB ASP A 117 -4.210 2.303 -10.397 1.00 0.00 C ATOM 1310 CG ASP A 117 -3.356 3.414 -11.024 1.00 0.00 C ATOM 1311 OD1 ASP A 117 -2.221 3.153 -11.485 1.00 0.00 O ATOM 1312 OD2 ASP A 117 -3.805 4.581 -11.016 1.00 0.00 O1- ATOM 0 H ASP A 117 -5.617 2.258 -12.467 1.00 0.00 H new ATOM 0 HA ASP A 117 -3.395 0.684 -11.587 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -5.198 2.705 -10.171 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -3.761 2.008 -9.448 1.00 0.00 H new ATOM 1317 N SER A 118 -6.352 -0.312 -10.664 1.00 0.00 N ATOM 1318 CA SER A 118 -7.147 -1.287 -9.897 1.00 0.00 C ATOM 1319 C SER A 118 -6.578 -2.718 -9.960 1.00 0.00 C ATOM 1320 O SER A 118 -6.266 -3.228 -11.042 1.00 0.00 O ATOM 1321 CB SER A 118 -8.604 -1.312 -10.385 1.00 0.00 C ATOM 1322 OG SER A 118 -9.191 -0.017 -10.401 1.00 0.00 O ATOM 0 H SER A 118 -6.895 0.170 -11.380 1.00 0.00 H new ATOM 0 HA SER A 118 -7.101 -0.953 -8.860 1.00 0.00 H new ATOM 0 HB2 SER A 118 -8.642 -1.738 -11.388 1.00 0.00 H new ATOM 0 HB3 SER A 118 -9.190 -1.966 -9.739 1.00 0.00 H new ATOM 0 HG SER A 118 -9.004 0.416 -11.260 1.00 0.00 H new ATOM 1328 N GLY A 119 -6.451 -3.380 -8.803 1.00 0.00 N ATOM 1329 CA GLY A 119 -5.795 -4.687 -8.659 1.00 0.00 C ATOM 1330 C GLY A 119 -5.287 -4.952 -7.241 1.00 0.00 C ATOM 1331 O GLY A 119 -5.680 -4.258 -6.301 1.00 0.00 O ATOM 0 H GLY A 119 -6.809 -3.014 -7.921 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -6.498 -5.472 -8.939 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -4.958 -4.745 -9.355 1.00 0.00 H new ATOM 1335 N THR A 120 -4.434 -5.970 -7.086 1.00 0.00 N ATOM 1336 CA THR A 120 -3.910 -6.447 -5.792 1.00 0.00 C ATOM 1337 C THR A 120 -2.578 -5.782 -5.459 1.00 0.00 C ATOM 1338 O THR A 120 -1.733 -5.583 -6.332 1.00 0.00 O ATOM 1339 CB THR A 120 -3.733 -7.969 -5.808 1.00 0.00 C ATOM 1340 OG1 THR A 120 -4.846 -8.576 -6.433 1.00 0.00 O ATOM 1341 CG2 THR A 120 -3.615 -8.565 -4.406 1.00 0.00 C ATOM 0 H THR A 120 -4.076 -6.504 -7.878 1.00 0.00 H new ATOM 0 HA THR A 120 -4.636 -6.179 -5.025 1.00 0.00 H new ATOM 0 HB THR A 120 -2.809 -8.164 -6.352 1.00 0.00 H new ATOM 0 HG1 THR A 120 -4.726 -9.549 -6.442 1.00 0.00 H new ATOM 0 HG21 THR A 120 -3.492 -9.646 -4.479 1.00 0.00 H new ATOM 0 HG22 THR A 120 -2.751 -8.135 -3.899 1.00 0.00 H new ATOM 0 HG23 THR A 120 -4.518 -8.341 -3.838 1.00 0.00 H new ATOM 1349 N TYR A 121 -2.375 -5.488 -4.177 1.00 0.00 N ATOM 1350 CA TYR A 121 -1.195 -4.810 -3.631 1.00 0.00 C ATOM 1351 C TYR A 121 -0.769 -5.417 -2.280 1.00 0.00 C ATOM 1352 O TYR A 121 -1.595 -5.983 -1.560 1.00 0.00 O ATOM 1353 CB TYR A 121 -1.509 -3.313 -3.423 1.00 0.00 C ATOM 1354 CG TYR A 121 -1.666 -2.467 -4.676 1.00 0.00 C ATOM 1355 CD1 TYR A 121 -2.862 -2.502 -5.421 1.00 0.00 C ATOM 1356 CD2 TYR A 121 -0.633 -1.594 -5.067 1.00 0.00 C ATOM 1357 CE1 TYR A 121 -3.012 -1.700 -6.569 1.00 0.00 C ATOM 1358 CE2 TYR A 121 -0.787 -0.766 -6.196 1.00 0.00 C ATOM 1359 CZ TYR A 121 -1.977 -0.818 -6.952 1.00 0.00 C ATOM 1360 OH TYR A 121 -2.124 -0.017 -8.043 1.00 0.00 O ATOM 0 H TYR A 121 -3.057 -5.725 -3.456 1.00 0.00 H new ATOM 0 HA TYR A 121 -0.380 -4.937 -4.343 1.00 0.00 H new ATOM 0 HB2 TYR A 121 -2.429 -3.236 -2.843 1.00 0.00 H new ATOM 0 HB3 TYR A 121 -0.713 -2.879 -2.817 1.00 0.00 H new ATOM 0 HD1 TYR A 121 -3.669 -3.148 -5.109 1.00 0.00 H new ATOM 0 HD2 TYR A 121 0.284 -1.559 -4.497 1.00 0.00 H new ATOM 0 HE1 TYR A 121 -3.917 -1.759 -7.156 1.00 0.00 H new ATOM 0 HE2 TYR A 121 0.006 -0.091 -6.483 1.00 0.00 H new ATOM 0 HH TYR A 121 -2.917 -0.294 -8.548 1.00 0.00 H new ATOM 1370 N LEU A 122 0.498 -5.249 -1.888 1.00 0.00 N ATOM 1371 CA LEU A 122 1.017 -5.646 -0.571 1.00 0.00 C ATOM 1372 C LEU A 122 2.244 -4.826 -0.172 1.00 0.00 C ATOM 1373 O LEU A 122 2.950 -4.288 -1.021 1.00 0.00 O ATOM 1374 CB LEU A 122 1.239 -7.176 -0.498 1.00 0.00 C ATOM 1375 CG LEU A 122 2.295 -7.792 -1.449 1.00 0.00 C ATOM 1376 CD1 LEU A 122 3.729 -7.696 -0.902 1.00 0.00 C ATOM 1377 CD2 LEU A 122 1.969 -9.277 -1.665 1.00 0.00 C ATOM 0 H LEU A 122 1.207 -4.825 -2.487 1.00 0.00 H new ATOM 0 HA LEU A 122 0.261 -5.414 0.179 1.00 0.00 H new ATOM 0 HB2 LEU A 122 1.521 -7.426 0.525 1.00 0.00 H new ATOM 0 HB3 LEU A 122 0.284 -7.664 -0.694 1.00 0.00 H new ATOM 0 HG LEU A 122 2.252 -7.224 -2.378 1.00 0.00 H new ATOM 0 HD11 LEU A 122 4.421 -8.145 -1.614 1.00 0.00 H new ATOM 0 HD12 LEU A 122 3.992 -6.649 -0.752 1.00 0.00 H new ATOM 0 HD13 LEU A 122 3.792 -8.226 0.048 1.00 0.00 H new ATOM 0 HD21 LEU A 122 2.708 -9.718 -2.334 1.00 0.00 H new ATOM 0 HD22 LEU A 122 1.990 -9.797 -0.707 1.00 0.00 H new ATOM 0 HD23 LEU A 122 0.977 -9.371 -2.108 1.00 0.00 H new ATOM 1389 N CYS A 123 2.505 -4.731 1.127 1.00 0.00 N ATOM 1390 CA CYS A 123 3.709 -4.103 1.677 1.00 0.00 C ATOM 1391 C CYS A 123 4.732 -5.171 2.111 1.00 0.00 C ATOM 1392 O CYS A 123 4.385 -6.339 2.304 1.00 0.00 O ATOM 1393 CB CYS A 123 3.289 -3.182 2.830 1.00 0.00 C ATOM 1394 SG CYS A 123 2.157 -1.840 2.361 1.00 0.00 S ATOM 0 H CYS A 123 1.876 -5.094 1.844 1.00 0.00 H new ATOM 0 HA CYS A 123 4.208 -3.501 0.917 1.00 0.00 H new ATOM 0 HB2 CYS A 123 2.814 -3.785 3.603 1.00 0.00 H new ATOM 0 HB3 CYS A 123 4.185 -2.745 3.272 1.00 0.00 H new ATOM 1399 N GLY A 124 5.998 -4.780 2.291 1.00 0.00 N ATOM 1400 CA GLY A 124 7.049 -5.650 2.838 1.00 0.00 C ATOM 1401 C GLY A 124 8.183 -4.872 3.496 1.00 0.00 C ATOM 1402 O GLY A 124 8.389 -3.702 3.186 1.00 0.00 O ATOM 0 H GLY A 124 6.327 -3.843 2.060 1.00 0.00 H new ATOM 0 HA2 GLY A 124 6.608 -6.327 3.569 1.00 0.00 H new ATOM 0 HA3 GLY A 124 7.456 -6.267 2.037 1.00 0.00 H new ATOM 1406 N ALA A 125 8.948 -5.511 4.380 1.00 0.00 N ATOM 1407 CA ALA A 125 10.072 -4.871 5.075 1.00 0.00 C ATOM 1408 C ALA A 125 11.222 -5.842 5.362 1.00 0.00 C ATOM 1409 O ALA A 125 11.016 -7.049 5.440 1.00 0.00 O ATOM 1410 CB ALA A 125 9.562 -4.216 6.365 1.00 0.00 C ATOM 0 H ALA A 125 8.809 -6.488 4.637 1.00 0.00 H new ATOM 0 HA ALA A 125 10.485 -4.107 4.416 1.00 0.00 H new ATOM 0 HB1 ALA A 125 10.393 -3.739 6.884 1.00 0.00 H new ATOM 0 HB2 ALA A 125 8.810 -3.466 6.120 1.00 0.00 H new ATOM 0 HB3 ALA A 125 9.120 -4.976 7.009 1.00 0.00 H new ATOM 1416 N ILE A 126 12.436 -5.319 5.537 1.00 0.00 N ATOM 1417 CA ILE A 126 13.668 -6.101 5.737 1.00 0.00 C ATOM 1418 C ILE A 126 14.645 -5.361 6.663 1.00 0.00 C ATOM 1419 O ILE A 126 14.861 -4.158 6.518 1.00 0.00 O ATOM 1420 CB ILE A 126 14.287 -6.458 4.360 1.00 0.00 C ATOM 1421 CG1 ILE A 126 15.462 -7.441 4.528 1.00 0.00 C ATOM 1422 CG2 ILE A 126 14.729 -5.215 3.565 1.00 0.00 C ATOM 1423 CD1 ILE A 126 16.011 -8.000 3.211 1.00 0.00 C ATOM 0 H ILE A 126 12.600 -4.312 5.545 1.00 0.00 H new ATOM 0 HA ILE A 126 13.430 -7.038 6.241 1.00 0.00 H new ATOM 0 HB ILE A 126 13.501 -6.941 3.779 1.00 0.00 H new ATOM 0 HG12 ILE A 126 16.269 -6.937 5.059 1.00 0.00 H new ATOM 0 HG13 ILE A 126 15.138 -8.272 5.155 1.00 0.00 H new ATOM 0 HG21 ILE A 126 15.154 -5.526 2.611 1.00 0.00 H new ATOM 0 HG22 ILE A 126 13.867 -4.572 3.386 1.00 0.00 H new ATOM 0 HG23 ILE A 126 15.479 -4.666 4.135 1.00 0.00 H new ATOM 0 HD11 ILE A 126 16.835 -8.682 3.421 1.00 0.00 H new ATOM 0 HD12 ILE A 126 15.221 -8.536 2.686 1.00 0.00 H new ATOM 0 HD13 ILE A 126 16.369 -7.180 2.589 1.00 0.00 H new ATOM 1435 N SER A 127 15.223 -6.070 7.630 1.00 0.00 N ATOM 1436 CA SER A 127 16.203 -5.520 8.583 1.00 0.00 C ATOM 1437 C SER A 127 17.486 -5.000 7.899 1.00 0.00 C ATOM 1438 O SER A 127 17.844 -5.413 6.791 1.00 0.00 O ATOM 1439 CB SER A 127 16.534 -6.582 9.645 1.00 0.00 C ATOM 1440 OG SER A 127 17.488 -6.112 10.588 1.00 0.00 O ATOM 0 H SER A 127 15.025 -7.059 7.782 1.00 0.00 H new ATOM 0 HA SER A 127 15.748 -4.652 9.060 1.00 0.00 H new ATOM 0 HB2 SER A 127 15.621 -6.871 10.166 1.00 0.00 H new ATOM 0 HB3 SER A 127 16.918 -7.477 9.156 1.00 0.00 H new ATOM 0 HG SER A 127 17.670 -6.814 11.247 1.00 0.00 H new ATOM 1446 N LEU A 128 18.210 -4.104 8.582 1.00 0.00 N ATOM 1447 CA LEU A 128 19.492 -3.553 8.122 1.00 0.00 C ATOM 1448 C LEU A 128 20.652 -4.569 8.214 1.00 0.00 C ATOM 1449 O LEU A 128 21.722 -4.328 7.647 1.00 0.00 O ATOM 1450 CB LEU A 128 19.807 -2.271 8.920 1.00 0.00 C ATOM 1451 CG LEU A 128 18.719 -1.172 8.881 1.00 0.00 C ATOM 1452 CD1 LEU A 128 19.191 0.048 9.683 1.00 0.00 C ATOM 1453 CD2 LEU A 128 18.358 -0.742 7.452 1.00 0.00 C ATOM 0 H LEU A 128 17.916 -3.735 9.486 1.00 0.00 H new ATOM 0 HA LEU A 128 19.394 -3.313 7.063 1.00 0.00 H new ATOM 0 HB2 LEU A 128 19.982 -2.546 9.960 1.00 0.00 H new ATOM 0 HB3 LEU A 128 20.738 -1.849 8.541 1.00 0.00 H new ATOM 0 HG LEU A 128 17.818 -1.595 9.325 1.00 0.00 H new ATOM 0 HD11 LEU A 128 18.423 0.821 9.654 1.00 0.00 H new ATOM 0 HD12 LEU A 128 19.373 -0.245 10.717 1.00 0.00 H new ATOM 0 HD13 LEU A 128 20.112 0.435 9.248 1.00 0.00 H new ATOM 0 HD21 LEU A 128 17.590 0.031 7.488 1.00 0.00 H new ATOM 0 HD22 LEU A 128 19.245 -0.349 6.955 1.00 0.00 H new ATOM 0 HD23 LEU A 128 17.982 -1.602 6.897 1.00 0.00 H new ATOM 1465 N ALA A 129 20.463 -5.697 8.909 1.00 0.00 N ATOM 1466 CA ALA A 129 21.457 -6.767 9.040 1.00 0.00 C ATOM 1467 C ALA A 129 21.724 -7.501 7.697 1.00 0.00 C ATOM 1468 O ALA A 129 20.770 -7.736 6.946 1.00 0.00 O ATOM 1469 CB ALA A 129 20.972 -7.742 10.122 1.00 0.00 C ATOM 0 H ALA A 129 19.595 -5.895 9.407 1.00 0.00 H new ATOM 0 HA ALA A 129 22.412 -6.328 9.329 1.00 0.00 H new ATOM 0 HB1 ALA A 129 21.697 -8.548 10.237 1.00 0.00 H new ATOM 0 HB2 ALA A 129 20.866 -7.212 11.068 1.00 0.00 H new ATOM 0 HB3 ALA A 129 20.009 -8.160 9.830 1.00 0.00 H new ATOM 1475 N PRO A 130 22.971 -7.933 7.401 1.00 0.00 N ATOM 1476 CA PRO A 130 23.303 -8.688 6.186 1.00 0.00 C ATOM 1477 C PRO A 130 22.515 -9.994 6.002 1.00 0.00 C ATOM 1478 O PRO A 130 22.254 -10.400 4.871 1.00 0.00 O ATOM 1479 CB PRO A 130 24.805 -8.989 6.283 1.00 0.00 C ATOM 1480 CG PRO A 130 25.340 -7.865 7.162 1.00 0.00 C ATOM 1481 CD PRO A 130 24.191 -7.624 8.139 1.00 0.00 C ATOM 0 HA PRO A 130 23.033 -8.088 5.317 1.00 0.00 H new ATOM 0 HB2 PRO A 130 24.990 -9.967 6.727 1.00 0.00 H new ATOM 0 HB3 PRO A 130 25.278 -8.990 5.301 1.00 0.00 H new ATOM 0 HG2 PRO A 130 26.255 -8.155 7.678 1.00 0.00 H new ATOM 0 HG3 PRO A 130 25.571 -6.972 6.581 1.00 0.00 H new ATOM 0 HD2 PRO A 130 24.287 -8.259 9.020 1.00 0.00 H new ATOM 0 HD3 PRO A 130 24.185 -6.592 8.489 1.00 0.00 H new ATOM 1489 N LYS A 131 22.127 -10.652 7.103 1.00 0.00 N ATOM 1490 CA LYS A 131 21.426 -11.949 7.102 1.00 0.00 C ATOM 1491 C LYS A 131 19.883 -11.836 7.014 1.00 0.00 C ATOM 1492 O LYS A 131 19.178 -12.838 7.173 1.00 0.00 O ATOM 1493 CB LYS A 131 21.875 -12.748 8.346 1.00 0.00 C ATOM 1494 CG LYS A 131 23.383 -13.061 8.337 1.00 0.00 C ATOM 1495 CD LYS A 131 23.791 -14.064 9.430 1.00 0.00 C ATOM 1496 CE LYS A 131 23.532 -13.587 10.869 1.00 0.00 C ATOM 1497 NZ LYS A 131 24.437 -12.476 11.273 1.00 0.00 N1+ ATOM 0 H LYS A 131 22.294 -10.291 8.042 1.00 0.00 H new ATOM 0 HA LYS A 131 21.705 -12.479 6.191 1.00 0.00 H new ATOM 0 HB2 LYS A 131 21.631 -12.181 9.245 1.00 0.00 H new ATOM 0 HB3 LYS A 131 21.314 -13.681 8.395 1.00 0.00 H new ATOM 0 HG2 LYS A 131 23.660 -13.461 7.362 1.00 0.00 H new ATOM 0 HG3 LYS A 131 23.942 -12.135 8.473 1.00 0.00 H new ATOM 0 HD2 LYS A 131 23.251 -14.997 9.268 1.00 0.00 H new ATOM 0 HD3 LYS A 131 24.852 -14.287 9.321 1.00 0.00 H new ATOM 0 HE2 LYS A 131 22.497 -13.259 10.959 1.00 0.00 H new ATOM 0 HE3 LYS A 131 23.661 -14.424 11.555 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 24.222 -12.191 12.250 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 25.425 -12.795 11.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 24.297 -11.665 10.637 1.00 0.00 H new ATOM 1511 N ALA A 132 19.343 -10.630 6.801 1.00 0.00 N ATOM 1512 CA ALA A 132 17.904 -10.343 6.795 1.00 0.00 C ATOM 1513 C ALA A 132 17.128 -10.998 5.626 1.00 0.00 C ATOM 1514 O ALA A 132 17.707 -11.449 4.635 1.00 0.00 O ATOM 1515 CB ALA A 132 17.732 -8.819 6.806 1.00 0.00 C ATOM 0 H ALA A 132 19.912 -9.803 6.623 1.00 0.00 H new ATOM 0 HA ALA A 132 17.464 -10.792 7.685 1.00 0.00 H new ATOM 0 HB1 ALA A 132 16.670 -8.573 6.802 1.00 0.00 H new ATOM 0 HB2 ALA A 132 18.197 -8.407 7.702 1.00 0.00 H new ATOM 0 HB3 ALA A 132 18.207 -8.393 5.922 1.00 0.00 H new ATOM 1521 N GLN A 133 15.795 -11.008 5.741 1.00 0.00 N ATOM 1522 CA GLN A 133 14.845 -11.548 4.763 1.00 0.00 C ATOM 1523 C GLN A 133 13.558 -10.700 4.788 1.00 0.00 C ATOM 1524 O GLN A 133 13.210 -10.129 5.825 1.00 0.00 O ATOM 1525 CB GLN A 133 14.579 -13.027 5.110 1.00 0.00 C ATOM 1526 CG GLN A 133 13.686 -13.759 4.093 1.00 0.00 C ATOM 1527 CD GLN A 133 13.557 -15.250 4.421 1.00 0.00 C ATOM 1528 OE1 GLN A 133 12.584 -15.705 5.012 1.00 0.00 O ATOM 1529 NE2 GLN A 133 14.530 -16.069 4.069 1.00 0.00 N ATOM 0 H GLN A 133 15.327 -10.620 6.560 1.00 0.00 H new ATOM 0 HA GLN A 133 15.246 -11.503 3.750 1.00 0.00 H new ATOM 0 HB2 GLN A 133 15.533 -13.550 5.182 1.00 0.00 H new ATOM 0 HB3 GLN A 133 14.111 -13.080 6.093 1.00 0.00 H new ATOM 0 HG2 GLN A 133 12.697 -13.302 4.082 1.00 0.00 H new ATOM 0 HG3 GLN A 133 14.102 -13.641 3.092 1.00 0.00 H new ATOM 0 HE21 GLN A 133 15.347 -15.708 3.577 1.00 0.00 H new ATOM 0 HE22 GLN A 133 14.465 -17.063 4.289 1.00 0.00 H new ATOM 1538 N ILE A 134 12.855 -10.592 3.653 1.00 0.00 N ATOM 1539 CA ILE A 134 11.655 -9.744 3.519 1.00 0.00 C ATOM 1540 C ILE A 134 10.451 -10.367 4.250 1.00 0.00 C ATOM 1541 O ILE A 134 10.049 -11.499 3.970 1.00 0.00 O ATOM 1542 CB ILE A 134 11.326 -9.434 2.032 1.00 0.00 C ATOM 1543 CG1 ILE A 134 12.544 -8.830 1.289 1.00 0.00 C ATOM 1544 CG2 ILE A 134 10.122 -8.471 1.949 1.00 0.00 C ATOM 1545 CD1 ILE A 134 12.323 -8.578 -0.208 1.00 0.00 C ATOM 0 H ILE A 134 13.100 -11.090 2.797 1.00 0.00 H new ATOM 0 HA ILE A 134 11.875 -8.790 3.998 1.00 0.00 H new ATOM 0 HB ILE A 134 11.074 -10.375 1.543 1.00 0.00 H new ATOM 0 HG12 ILE A 134 12.812 -7.887 1.766 1.00 0.00 H new ATOM 0 HG13 ILE A 134 13.394 -9.501 1.409 1.00 0.00 H new ATOM 0 HG21 ILE A 134 9.897 -8.258 0.904 1.00 0.00 H new ATOM 0 HG22 ILE A 134 9.254 -8.932 2.420 1.00 0.00 H new ATOM 0 HG23 ILE A 134 10.363 -7.541 2.465 1.00 0.00 H new ATOM 0 HD11 ILE A 134 13.228 -8.155 -0.643 1.00 0.00 H new ATOM 0 HD12 ILE A 134 12.087 -9.519 -0.704 1.00 0.00 H new ATOM 0 HD13 ILE A 134 11.496 -7.880 -0.341 1.00 0.00 H new ATOM 1557 N LYS A 135 9.849 -9.601 5.161 1.00 0.00 N ATOM 1558 CA LYS A 135 8.603 -9.918 5.868 1.00 0.00 C ATOM 1559 C LYS A 135 7.376 -9.507 5.031 1.00 0.00 C ATOM 1560 O LYS A 135 7.397 -8.464 4.377 1.00 0.00 O ATOM 1561 CB LYS A 135 8.594 -9.208 7.239 1.00 0.00 C ATOM 1562 CG LYS A 135 9.877 -9.350 8.081 1.00 0.00 C ATOM 1563 CD LYS A 135 10.289 -10.806 8.356 1.00 0.00 C ATOM 1564 CE LYS A 135 11.645 -10.900 9.071 1.00 0.00 C ATOM 1565 NZ LYS A 135 11.616 -10.326 10.442 1.00 0.00 N1+ ATOM 0 H LYS A 135 10.234 -8.699 5.441 1.00 0.00 H new ATOM 0 HA LYS A 135 8.549 -10.995 6.025 1.00 0.00 H new ATOM 0 HB2 LYS A 135 8.406 -8.147 7.075 1.00 0.00 H new ATOM 0 HB3 LYS A 135 7.757 -9.594 7.820 1.00 0.00 H new ATOM 0 HG2 LYS A 135 10.694 -8.843 7.567 1.00 0.00 H new ATOM 0 HG3 LYS A 135 9.733 -8.838 9.033 1.00 0.00 H new ATOM 0 HD2 LYS A 135 9.525 -11.289 8.965 1.00 0.00 H new ATOM 0 HD3 LYS A 135 10.338 -11.352 7.414 1.00 0.00 H new ATOM 0 HE2 LYS A 135 11.949 -11.945 9.126 1.00 0.00 H new ATOM 0 HE3 LYS A 135 12.399 -10.379 8.480 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 12.557 -10.417 10.876 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 11.353 -9.321 10.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 10.918 -10.838 11.018 1.00 0.00 H new ATOM 1579 N GLU A 136 6.304 -10.301 5.075 1.00 0.00 N ATOM 1580 CA GLU A 136 5.075 -10.140 4.280 1.00 0.00 C ATOM 1581 C GLU A 136 3.836 -10.519 5.113 1.00 0.00 C ATOM 1582 O GLU A 136 3.934 -11.252 6.098 1.00 0.00 O ATOM 1583 CB GLU A 136 5.130 -11.023 3.018 1.00 0.00 C ATOM 1584 CG GLU A 136 6.079 -10.498 1.934 1.00 0.00 C ATOM 1585 CD GLU A 136 6.138 -11.477 0.750 1.00 0.00 C ATOM 1586 OE1 GLU A 136 5.235 -11.439 -0.119 1.00 0.00 O1- ATOM 1587 OE2 GLU A 136 7.082 -12.298 0.683 1.00 0.00 O ATOM 0 H GLU A 136 6.263 -11.112 5.692 1.00 0.00 H new ATOM 0 HA GLU A 136 5.001 -9.093 3.985 1.00 0.00 H new ATOM 0 HB2 GLU A 136 5.440 -12.028 3.303 1.00 0.00 H new ATOM 0 HB3 GLU A 136 4.127 -11.105 2.600 1.00 0.00 H new ATOM 0 HG2 GLU A 136 5.741 -9.521 1.589 1.00 0.00 H new ATOM 0 HG3 GLU A 136 7.077 -10.362 2.351 1.00 0.00 H new ATOM 1594 N SER A 137 2.660 -10.033 4.713 1.00 0.00 N ATOM 1595 CA SER A 137 1.366 -10.370 5.331 1.00 0.00 C ATOM 1596 C SER A 137 0.232 -10.452 4.287 1.00 0.00 C ATOM 1597 O SER A 137 0.480 -10.421 3.076 1.00 0.00 O ATOM 1598 CB SER A 137 1.048 -9.362 6.446 1.00 0.00 C ATOM 1599 OG SER A 137 0.065 -9.883 7.330 1.00 0.00 O ATOM 0 H SER A 137 2.573 -9.380 3.934 1.00 0.00 H new ATOM 0 HA SER A 137 1.441 -11.363 5.773 1.00 0.00 H new ATOM 0 HB2 SER A 137 1.956 -9.128 7.001 1.00 0.00 H new ATOM 0 HB3 SER A 137 0.693 -8.429 6.009 1.00 0.00 H new ATOM 0 HG SER A 137 -0.764 -9.369 7.237 1.00 0.00 H new ATOM 1605 N LEU A 138 -1.019 -10.580 4.745 1.00 0.00 N ATOM 1606 CA LEU A 138 -2.212 -10.741 3.909 1.00 0.00 C ATOM 1607 C LEU A 138 -2.428 -9.497 3.029 1.00 0.00 C ATOM 1608 O LEU A 138 -2.505 -8.375 3.536 1.00 0.00 O ATOM 1609 CB LEU A 138 -3.449 -11.015 4.793 1.00 0.00 C ATOM 1610 CG LEU A 138 -3.547 -12.383 5.508 1.00 0.00 C ATOM 1611 CD1 LEU A 138 -3.489 -13.558 4.520 1.00 0.00 C ATOM 1612 CD2 LEU A 138 -2.505 -12.582 6.621 1.00 0.00 C ATOM 0 H LEU A 138 -1.235 -10.574 5.742 1.00 0.00 H new ATOM 0 HA LEU A 138 -2.065 -11.597 3.250 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -3.493 -10.237 5.555 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -4.336 -10.901 4.170 1.00 0.00 H new ATOM 0 HG LEU A 138 -4.526 -12.371 5.987 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -3.561 -14.498 5.068 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -4.318 -13.483 3.817 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -2.546 -13.528 3.974 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -2.639 -13.564 7.074 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -1.503 -12.511 6.198 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -2.633 -11.812 7.381 1.00 0.00 H new ATOM 1624 N ARG A 139 -2.529 -9.706 1.710 1.00 0.00 N ATOM 1625 CA ARG A 139 -2.592 -8.639 0.702 1.00 0.00 C ATOM 1626 C ARG A 139 -3.859 -7.765 0.784 1.00 0.00 C ATOM 1627 O ARG A 139 -4.876 -8.148 1.368 1.00 0.00 O ATOM 1628 CB ARG A 139 -2.339 -9.218 -0.708 1.00 0.00 C ATOM 1629 CG ARG A 139 -3.248 -10.354 -1.214 1.00 0.00 C ATOM 1630 CD ARG A 139 -4.744 -10.028 -1.174 1.00 0.00 C ATOM 1631 NE ARG A 139 -5.530 -10.883 -2.078 1.00 0.00 N ATOM 1632 CZ ARG A 139 -6.813 -10.695 -2.364 1.00 0.00 C ATOM 1633 NH1 ARG A 139 -7.544 -9.821 -1.708 1.00 0.00 N1+ ATOM 1634 NH2 ARG A 139 -7.388 -11.375 -3.330 1.00 0.00 N ATOM 0 H ARG A 139 -2.570 -10.641 1.305 1.00 0.00 H new ATOM 0 HA ARG A 139 -1.787 -7.940 0.929 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -2.409 -8.396 -1.421 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -1.311 -9.579 -0.738 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -2.968 -10.598 -2.239 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -3.066 -11.245 -0.613 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -5.112 -10.147 -0.155 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -4.893 -8.983 -1.446 1.00 0.00 H new ATOM 0 HE ARG A 139 -5.057 -11.674 -2.515 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -7.128 -9.268 -0.959 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -8.527 -9.696 -1.948 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -6.848 -12.054 -3.867 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -8.374 -11.224 -3.543 1.00 0.00 H new ATOM 1648 N ALA A 140 -3.804 -6.606 0.131 1.00 0.00 N ATOM 1649 CA ALA A 140 -4.884 -5.630 -0.025 1.00 0.00 C ATOM 1650 C ALA A 140 -5.295 -5.479 -1.507 1.00 0.00 C ATOM 1651 O ALA A 140 -4.596 -5.959 -2.400 1.00 0.00 O ATOM 1652 CB ALA A 140 -4.369 -4.311 0.569 1.00 0.00 C ATOM 0 H ALA A 140 -2.948 -6.303 -0.334 1.00 0.00 H new ATOM 0 HA ALA A 140 -5.785 -5.954 0.495 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -5.140 -3.545 0.478 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -4.125 -4.457 1.621 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -3.476 -3.993 0.030 1.00 0.00 H new ATOM 1658 N GLU A 141 -6.419 -4.811 -1.780 1.00 0.00 N ATOM 1659 CA GLU A 141 -6.925 -4.534 -3.132 1.00 0.00 C ATOM 1660 C GLU A 141 -7.314 -3.059 -3.299 1.00 0.00 C ATOM 1661 O GLU A 141 -7.884 -2.452 -2.391 1.00 0.00 O ATOM 1662 CB GLU A 141 -8.155 -5.403 -3.445 1.00 0.00 C ATOM 1663 CG GLU A 141 -7.850 -6.904 -3.453 1.00 0.00 C ATOM 1664 CD GLU A 141 -9.071 -7.731 -3.891 1.00 0.00 C ATOM 1665 OE1 GLU A 141 -9.499 -7.622 -5.063 1.00 0.00 O1- ATOM 1666 OE2 GLU A 141 -9.590 -8.528 -3.071 1.00 0.00 O ATOM 0 H GLU A 141 -7.021 -4.436 -1.047 1.00 0.00 H new ATOM 0 HA GLU A 141 -6.117 -4.771 -3.824 1.00 0.00 H new ATOM 0 HB2 GLU A 141 -8.931 -5.201 -2.707 1.00 0.00 H new ATOM 0 HB3 GLU A 141 -8.556 -5.116 -4.417 1.00 0.00 H new ATOM 0 HG2 GLU A 141 -7.016 -7.102 -4.126 1.00 0.00 H new ATOM 0 HG3 GLU A 141 -7.537 -7.217 -2.457 1.00 0.00 H new ATOM 1673 N LEU A 142 -7.054 -2.504 -4.485 1.00 0.00 N ATOM 1674 CA LEU A 142 -7.501 -1.182 -4.933 1.00 0.00 C ATOM 1675 C LEU A 142 -8.562 -1.334 -6.027 1.00 0.00 C ATOM 1676 O LEU A 142 -8.352 -2.067 -6.998 1.00 0.00 O ATOM 1677 CB LEU A 142 -6.281 -0.411 -5.480 1.00 0.00 C ATOM 1678 CG LEU A 142 -6.576 1.005 -6.018 1.00 0.00 C ATOM 1679 CD1 LEU A 142 -7.104 1.947 -4.927 1.00 0.00 C ATOM 1680 CD2 LEU A 142 -5.299 1.594 -6.632 1.00 0.00 C ATOM 0 H LEU A 142 -6.500 -2.986 -5.193 1.00 0.00 H new ATOM 0 HA LEU A 142 -7.941 -0.634 -4.100 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -5.538 -0.332 -4.687 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -5.831 -0.998 -6.280 1.00 0.00 H new ATOM 0 HG LEU A 142 -7.356 0.913 -6.774 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -7.296 2.930 -5.357 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -8.029 1.544 -4.515 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -6.362 2.037 -4.133 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -5.506 2.594 -7.012 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -4.521 1.649 -5.870 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -4.961 0.957 -7.450 1.00 0.00 H new ATOM 1692 N ARG A 143 -9.652 -0.577 -5.907 1.00 0.00 N ATOM 1693 CA ARG A 143 -10.677 -0.389 -6.933 1.00 0.00 C ATOM 1694 C ARG A 143 -10.827 1.108 -7.219 1.00 0.00 C ATOM 1695 O ARG A 143 -11.180 1.892 -6.335 1.00 0.00 O ATOM 1696 CB ARG A 143 -12.000 -1.007 -6.454 1.00 0.00 C ATOM 1697 CG ARG A 143 -13.115 -0.894 -7.506 1.00 0.00 C ATOM 1698 CD ARG A 143 -14.431 -1.483 -6.985 1.00 0.00 C ATOM 1699 NE ARG A 143 -15.499 -1.357 -7.992 1.00 0.00 N ATOM 1700 CZ ARG A 143 -16.807 -1.451 -7.776 1.00 0.00 C ATOM 1701 NH1 ARG A 143 -17.305 -1.693 -6.580 1.00 0.00 N1+ ATOM 1702 NH2 ARG A 143 -17.645 -1.302 -8.779 1.00 0.00 N ATOM 0 H ARG A 143 -9.854 -0.055 -5.054 1.00 0.00 H new ATOM 0 HA ARG A 143 -10.388 -0.889 -7.858 1.00 0.00 H new ATOM 0 HB2 ARG A 143 -11.840 -2.057 -6.210 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -12.318 -0.511 -5.537 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -13.262 0.153 -7.772 1.00 0.00 H new ATOM 0 HG3 ARG A 143 -12.815 -1.415 -8.415 1.00 0.00 H new ATOM 0 HD2 ARG A 143 -14.288 -2.533 -6.730 1.00 0.00 H new ATOM 0 HD3 ARG A 143 -14.726 -0.970 -6.070 1.00 0.00 H new ATOM 0 HE ARG A 143 -15.205 -1.180 -8.952 1.00 0.00 H new ATOM 0 HH11 ARG A 143 -16.681 -1.815 -5.783 1.00 0.00 H new ATOM 0 HH12 ARG A 143 -18.315 -1.758 -6.452 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -17.290 -1.115 -9.717 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -18.650 -1.373 -8.619 1.00 0.00 H new ATOM 1716 N VAL A 144 -10.589 1.504 -8.463 1.00 0.00 N ATOM 1717 CA VAL A 144 -10.867 2.852 -8.968 1.00 0.00 C ATOM 1718 C VAL A 144 -12.131 2.787 -9.832 1.00 0.00 C ATOM 1719 O VAL A 144 -12.182 2.049 -10.814 1.00 0.00 O ATOM 1720 CB VAL A 144 -9.672 3.422 -9.759 1.00 0.00 C ATOM 1721 CG1 VAL A 144 -9.959 4.868 -10.190 1.00 0.00 C ATOM 1722 CG2 VAL A 144 -8.367 3.384 -8.949 1.00 0.00 C ATOM 0 H VAL A 144 -10.188 0.886 -9.169 1.00 0.00 H new ATOM 0 HA VAL A 144 -11.027 3.530 -8.130 1.00 0.00 H new ATOM 0 HB VAL A 144 -9.542 2.789 -10.637 1.00 0.00 H new ATOM 0 HG11 VAL A 144 -9.107 5.257 -10.747 1.00 0.00 H new ATOM 0 HG12 VAL A 144 -10.847 4.890 -10.822 1.00 0.00 H new ATOM 0 HG13 VAL A 144 -10.127 5.484 -9.307 1.00 0.00 H new ATOM 0 HG21 VAL A 144 -7.555 3.796 -9.548 1.00 0.00 H new ATOM 0 HG22 VAL A 144 -8.485 3.976 -8.041 1.00 0.00 H new ATOM 0 HG23 VAL A 144 -8.134 2.353 -8.682 1.00 0.00 H new ATOM 1732 N THR A 145 -13.152 3.550 -9.435 1.00 0.00 N ATOM 1733 CA THR A 145 -14.446 3.700 -10.123 1.00 0.00 C ATOM 1734 C THR A 145 -14.432 4.976 -10.965 1.00 0.00 C ATOM 1735 O THR A 145 -13.739 5.928 -10.618 1.00 0.00 O ATOM 1736 CB THR A 145 -15.605 3.682 -9.113 1.00 0.00 C ATOM 1737 OG1 THR A 145 -15.452 4.696 -8.143 1.00 0.00 O ATOM 1738 CG2 THR A 145 -15.705 2.342 -8.383 1.00 0.00 C ATOM 0 H THR A 145 -13.101 4.109 -8.584 1.00 0.00 H new ATOM 0 HA THR A 145 -14.603 2.856 -10.794 1.00 0.00 H new ATOM 0 HB THR A 145 -16.514 3.849 -9.692 1.00 0.00 H new ATOM 0 HG1 THR A 145 -14.597 4.578 -7.679 1.00 0.00 H new ATOM 0 HG21 THR A 145 -16.537 2.372 -7.679 1.00 0.00 H new ATOM 0 HG22 THR A 145 -15.872 1.545 -9.107 1.00 0.00 H new ATOM 0 HG23 THR A 145 -14.778 2.153 -7.842 1.00 0.00 H new ATOM 1746 N GLU A 146 -15.144 5.012 -12.089 1.00 0.00 N ATOM 1747 CA GLU A 146 -15.077 6.118 -13.055 1.00 0.00 C ATOM 1748 C GLU A 146 -15.575 7.458 -12.480 1.00 0.00 C ATOM 1749 O GLU A 146 -16.442 7.506 -11.601 1.00 0.00 O ATOM 1750 CB GLU A 146 -15.800 5.775 -14.372 1.00 0.00 C ATOM 1751 CG GLU A 146 -17.279 5.397 -14.240 1.00 0.00 C ATOM 1752 CD GLU A 146 -17.492 3.885 -14.056 1.00 0.00 C ATOM 1753 OE1 GLU A 146 -17.216 3.357 -12.952 1.00 0.00 O ATOM 1754 OE2 GLU A 146 -17.931 3.212 -15.019 1.00 0.00 O1- ATOM 0 H GLU A 146 -15.790 4.271 -12.362 1.00 0.00 H new ATOM 0 HA GLU A 146 -14.018 6.251 -13.277 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -15.721 6.631 -15.042 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -15.274 4.948 -14.849 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -17.710 5.926 -13.390 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -17.815 5.730 -15.129 1.00 0.00 H new ATOM 1761 N ARG A 147 -15.031 8.565 -12.997 1.00 0.00 N ATOM 1762 CA ARG A 147 -15.285 9.914 -12.490 1.00 0.00 C ATOM 1763 C ARG A 147 -16.696 10.331 -12.898 1.00 0.00 C ATOM 1764 O ARG A 147 -17.049 10.275 -14.081 1.00 0.00 O ATOM 1765 CB ARG A 147 -14.204 10.896 -12.973 1.00 0.00 C ATOM 1766 CG ARG A 147 -14.190 12.173 -12.120 1.00 0.00 C ATOM 1767 CD ARG A 147 -12.993 13.062 -12.478 1.00 0.00 C ATOM 1768 NE ARG A 147 -12.922 14.246 -11.603 1.00 0.00 N ATOM 1769 CZ ARG A 147 -12.378 14.313 -10.392 1.00 0.00 C ATOM 1770 NH1 ARG A 147 -11.808 13.278 -9.809 1.00 0.00 N1+ ATOM 1771 NH2 ARG A 147 -12.405 15.452 -9.733 1.00 0.00 N ATOM 0 H ARG A 147 -14.392 8.546 -13.792 1.00 0.00 H new ATOM 0 HA ARG A 147 -15.229 9.926 -11.402 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -13.227 10.415 -12.928 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -14.385 11.155 -14.016 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -15.117 12.726 -12.273 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -14.147 11.908 -11.064 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -12.071 12.487 -12.390 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -13.072 13.380 -13.518 1.00 0.00 H new ATOM 0 HE ARG A 147 -13.334 15.106 -11.965 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -11.772 12.379 -10.289 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -11.403 13.376 -8.878 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -12.841 16.273 -10.152 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -11.990 15.513 -8.803 1.00 0.00 H new