Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4kh6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 4.A N VAL 1.A O no hydrogen 2.898 N/A THR 5.A N VAL 1.A O no hydrogen 2.798 N/A THR 5.A OG1 VAL 1.A O no hydrogen 3.250 N/A THR 5.A OG1 ASP 2.A OD1 no hydrogen 3.488 N/A ILE 9.A N THR 5.A O no hydrogen 3.048 N/A ASN 10.A N GLU 6.A O no hydrogen 3.273 N/A VAL 11.A N LYS 7.A O no hydrogen 3.094 N/A VAL 11.A N ARG 8.A O no hydrogen 3.249 N/A GLY 12.A N ARG 8.A O no hydrogen 3.145 N/A LYS 13.A N ILE 9.A O no hydrogen 3.043 N/A THR 14.A N ASN 10.A O no hydrogen 3.051 N/A THR 14.A OG1 ASN 10.A O no hydrogen 2.794 N/A HIS 15.A N VAL 11.A O no hydrogen 2.958 N/A LEU 16.A N GLY 12.A O no hydrogen 3.341 N/A GLN 17.A N LYS 13.A O no hydrogen 3.100 N/A THR 18.A N THR 14.A O no hydrogen 2.759 N/A THR 18.A OG1 THR 14.A O no hydrogen 2.676 N/A LEU 19.A N HIS 15.A O no hydrogen 3.181 N/A ARG 20.A N LEU 16.A O no hydrogen 2.939 N/A ASN 21.A N GLN 17.A O no hydrogen 2.944 N/A LEU 22.A N THR 18.A O no hydrogen 3.001 N/A GLU 23.A N LEU 19.A O no hydrogen 3.173 N/A THR 24.A N ASN 21.A O no hydrogen 3.104 N/A THR 24.A OG1 ARG 20.A O no hydrogen 2.800 N/A THR 24.A OG1 ASN 21.A O no hydrogen 3.140 N/A ARG 25.A N ASN 21.A O no hydrogen 2.899 N/A HIS 27.A N SER 54.A O no hydrogen 2.837 N/A SER 29.A N THR 52.A O no hydrogen 2.891 N/A LEU 30.A N GLN 142.A OE1 no hydrogen 3.040 N/A GLN 31.A N ALA 50.A O no hydrogen 2.919 N/A GLN 31.A NE2 GLY 147.A O no hydrogen 3.049 N/A LEU 33.A N PHE 48.A O no hydrogen 2.997 N/A VAL 34.A N PRO 149.A O no hydrogen 2.913 N/A VAL 35.A N ASN 46.A O no hydrogen 2.889 N/A ILE 36.A N MET 151.A O no hydrogen 2.809 N/A ASP 37.A N ARG 44.A O no hydrogen 2.867 N/A ALA 38.A N CYS 153.A O no hydrogen 2.961 N/A GLY 39.A N SER 42.A O no hydrogen 2.822 N/A THR 43.A N PHE 76.A O no hydrogen 3.019 N/A THR 43.A OG1 THR 77.A O no hydrogen 2.559 N/A ARG 44.A N ASP 37.A O no hydrogen 3.003 N/A ARG 44.A NE SER 42.A O no hydrogen 3.517 N/A ARG 44.A NE SER 42.A OG no hydrogen 3.049 N/A THR 45.A OG1 THR 127.A OG1 no hydrogen 3.067 N/A ASN 46.A ND2 VAL 35.A O no hydrogen 3.354 N/A VAL 47.A N ARG 71.A O no hydrogen 2.941 N/A PHE 48.A N LEU 33.A O no hydrogen 2.862 N/A LEU 49.A N GLN 68.A O no hydrogen 2.922 N/A ALA 50.A N GLN 31.A O no hydrogen 2.926 N/A LYS 51.A N SER 66.A OG no hydrogen 2.804 N/A LYS 51.A NZ ASP 28.A OD2 no hydrogen 3.310 N/A THR 52.A N SER 29.A O no hydrogen 2.682 N/A THR 52.A OG1 SER 29.A O no hydrogen 3.101 N/A ARG 53.A N SER 61.A O no hydrogen 2.843 N/A ARG 53.A NE ASP 28.A OD1 no hydrogen 2.825 N/A ARG 53.A NH2 ASP 28.A OD2 no hydrogen 3.162 N/A SER 54.A N HIS 27.A O no hydrogen 2.936 N/A CYS 55.A N GLY 59.A O no hydrogen 3.136 N/A LYS 58.A N CYS 55.A O no hydrogen 3.008 N/A ARG 60.A NH1 THR 52.A OG1 no hydrogen 2.887 N/A SER 61.A N ARG 53.A O no hydrogen 3.033 N/A ASP 63.A N LYS 51.A O no hydrogen 2.924 N/A ASP 65.A N ASP 63.A OD1 no hydrogen 3.192 N/A SER 66.A N ASP 63.A O no hydrogen 3.140 N/A SER 66.A OG ASP 63.A O no hydrogen 2.538 N/A GLN 68.A N LEU 49.A O no hydrogen 3.048 N/A LEU 69.A N LEU 560.A O no hydrogen 2.765 N/A ILE 70.A N VAL 47.A O no hydrogen 2.766 N/A ARG 71.A N VAL 47.A O no hydrogen 3.372 N/A ARG 71.A NH2 GLN 134.A OE1 no hydrogen 3.088 N/A GLY 73.A N THR 45.A O no hydrogen 2.618 N/A LYS 74.A N ASP 126.A OD2 no hydrogen 2.819 N/A ARG 75.A NH2 GLU 72.A OE2 no hydrogen 3.295 N/A PHE 76.A N THR 43.A O no hydrogen 2.967 N/A ARG 80.A NE GLY 157.A O no hydrogen 2.756 N/A ARG 80.A NH1 GLU 84.A OE2 no hydrogen 2.768 N/A ARG 80.A NH2 GLY 157.A O no hydrogen 2.988 N/A VAL 82.A N GLY 78.A O no hydrogen 3.345 N/A LEU 83.A N LEU 79.A O no hydrogen 3.144 N/A GLU 84.A N ARG 80.A O no hydrogen 2.818 N/A GLU 85.A N VAL 81.A O no hydrogen 2.872 N/A TRP 86.A N VAL 82.A O no hydrogen 3.162 N/A TRP 86.A NE1 TYR 108.A O no hydrogen 3.042 N/A LEU 87.A N LEU 83.A O no hydrogen 2.937 N/A ASP 88.A N GLU 84.A O no hydrogen 2.951 N/A THR 89.A N GLU 85.A O no hydrogen 3.146 N/A THR 89.A OG1 GLU 85.A O no hydrogen 3.162 N/A THR 89.A OG1 TRP 86.A O no hydrogen 2.824 N/A TYR 90.A N TRP 86.A O no hydrogen 2.923 N/A ALA 91.A N LEU 87.A O no hydrogen 2.726 N/A TRP 95.A NE1 ASP 88.A OD1 no hydrogen 2.758 N/A GLU 96.A N GLU 96.A OE1 no hydrogen 2.932 N/A SER 97.A N ASP 94.A O no hydrogen 3.031 N/A SER 97.A OG ASP 94.A OD1 no hydrogen 2.863 N/A SER 97.A OG ASP 94.A OD2 no hydrogen 3.515 N/A ARG 98.A NH2 ALA 91.A O no hydrogen 2.604 N/A LEU 104.A N ASP 101.A O no hydrogen 3.231 N/A LEU 105.A N ALA 102.A O no hydrogen 3.062 N/A PHE 106.A N ARG 103.A O no hydrogen 3.361 N/A GLN 107.A N LEU 104.A O no hydrogen 3.505 N/A GLN 107.A NE2 LEU 104.A O no hydrogen 2.821 N/A TYR 108.A N LEU 105.A O no hydrogen 3.041 N/A VAL 109.A N PHE 106.A O no hydrogen 3.453 N/A GLN 111.A N GLN 111.A OE1 no hydrogen 2.821 N/A MET 112.A N TYR 108.A O no hydrogen 3.054 N/A HIS 113.A N VAL 109.A O no hydrogen 2.976 N/A GLU 114.A N PRO 110.A O no hydrogen 3.030 N/A GLY 115.A N GLN 111.A O no hydrogen 3.115 N/A ALA 116.A N MET 112.A O no hydrogen 3.030 N/A LYS 117.A N HIS 113.A O no hydrogen 2.850 N/A LYS 118.A N GLU 114.A O no hydrogen 3.436 N/A MET 120.A N ALA 116.A O no hydrogen 2.965 N/A GLN 121.A N LYS 117.A O no hydrogen 2.902 N/A LEU 123.A N LEU 119.A O no hydrogen 3.117 N/A GLU 124.A N MET 120.A O no hydrogen 2.933 N/A GLU 125.A N GLN 121.A O no hydrogen 3.095 N/A ASP 126.A N LEU 122.A O no hydrogen 2.999 N/A THR 127.A N LEU 123.A O no hydrogen 2.923 N/A THR 127.A OG1 THR 45.A OG1 no hydrogen 3.067 N/A THR 127.A OG1 LEU 123.A O no hydrogen 2.694 N/A VAL 128.A N GLU 124.A O no hydrogen 2.969 N/A ALA 129.A N GLU 125.A O no hydrogen 2.996 N/A ILE 130.A N ASP 126.A O no hydrogen 3.030 N/A LEU 131.A N THR 127.A O no hydrogen 2.982 N/A ASP 132.A N VAL 128.A O no hydrogen 2.808 N/A SER 133.A N ALA 129.A O no hydrogen 3.002 N/A SER 133.A OG ALA 129.A O no hydrogen 3.199 N/A SER 133.A OG ILE 130.A O no hydrogen 3.033 N/A SER 133.A OG GLN 134.A OE1 no hydrogen 3.125 N/A GLN 134.A N ILE 130.A O no hydrogen 2.969 N/A LEU 135.A N LEU 131.A O no hydrogen 3.093 N/A ASN 136.A N GLN 139.A OE1 no hydrogen 2.901 N/A GLU 138.A N GLU 138.A OE2 no hydrogen 3.005 N/A GLN 139.A N ASN 136.A OD1 no hydrogen 2.925 N/A LYS 140.A N ASN 136.A O no hydrogen 2.923 N/A LYS 140.A NZ ASP 132.A O no hydrogen 3.357 N/A LYS 140.A NZ GLU 137.A OE2 no hydrogen 3.448 N/A VAL 141.A N GLU 137.A O no hydrogen 3.106 N/A GLN 142.A N GLU 138.A O no hydrogen 3.438 N/A VAL 143.A N GLN 139.A O no hydrogen 2.925 N/A LYS 144.A N LYS 140.A O no hydrogen 2.793 N/A LYS 144.A NZ HIS 184.A O no hydrogen 3.276 N/A ALA 145.A N VAL 141.A O no hydrogen 3.072 N/A LEU 146.A N GLN 142.A O no hydrogen 3.069 N/A ILE 148.A N LYS 187.A O no hydrogen 2.819 N/A VAL 150.A N PHE 189.A O no hydrogen 2.904 N/A MET 151.A N VAL 34.A O no hydrogen 2.806 N/A LEU 152.A N THR 195.A OG1 no hydrogen 3.177 N/A CYS 153.A N ILE 36.A O no hydrogen 3.036 N/A CYS 153.A SG TRP 194.A O no hydrogen 3.571 N/A THR 155.A N ALA 38.A O no hydrogen 3.267 N/A ARG 159.A NH1 GLU 203.A OE2 no hydrogen 3.059 N/A ARG 159.A NH2 ILE 198.A O no hydrogen 2.839 N/A ARG 159.A NH2 GLU 203.A OE2 no hydrogen 2.770 N/A ASP 160.A N ASP 160.A OD2 no hydrogen 2.723 N/A PHE 161.A N VAL 158.A O no hydrogen 3.153 N/A ARG 166.A NE VAL 158.A O no hydrogen 3.044 N/A ARG 166.A NH1 VAL 158.A O no hydrogen 3.174 N/A ARG 166.A NH2 ASP 167.A OD1 no hydrogen 3.060 N/A ALA 168.A N TRP 164.A O no hydrogen 3.274 N/A LEU 169.A N TYR 165.A O no hydrogen 2.988 N/A PHE 170.A N ARG 166.A O no hydrogen 3.073 N/A VAL 171.A N ASP 167.A O no hydrogen 3.438 N/A LEU 172.A N ALA 168.A O no hydrogen 3.326 N/A LEU 173.A N LEU 169.A O no hydrogen 2.847 N/A ARG 174.A N PHE 170.A O no hydrogen 3.077 N/A ARG 174.A NH2 THR 195.A O no hydrogen 2.840 N/A HIS 175.A N VAL 171.A O no hydrogen 3.320 N/A LEU 176.A N LEU 172.A O no hydrogen 3.045 N/A ILE 177.A N LEU 173.A O no hydrogen 3.007 N/A ASN 178.A N ARG 174.A O no hydrogen 2.962 N/A ASN 178.A ND2 THR 190.A O no hydrogen 3.219 N/A ASN 179.A N LEU 176.A O no hydrogen 3.102 N/A ASN 179.A ND2 HIS 175.A O no hydrogen 2.665 N/A SER 181.A N GLU 124.A OE2 no hydrogen 2.755 N/A HIS 184.A NE2 GLU 124.A OE2 no hydrogen 2.670 N/A GLY 185.A N PRO 182.A O no hydrogen 3.387 N/A TYR 186.A N HIS 184.A ND1 no hydrogen 3.089 N/A TYR 186.A OH ASP 132.A OD1 no hydrogen 2.686 N/A LYS 187.A NZ LYS 144.A O no hydrogen 2.771 N/A PHE 189.A N ILE 148.A O no hydrogen 3.241 N/A THR 190.A N ASN 178.A OD1 no hydrogen 2.790 N/A THR 190.A OG1 VAL 150.A O no hydrogen 2.638 N/A THR 190.A OG1 THR 195.A OG1 no hydrogen 2.593 N/A PHE 193.A N ASN 191.A OD1 no hydrogen 2.908 N/A TRP 194.A N ASN 191.A O no hydrogen 3.187 N/A TRP 194.A N ASN 191.A OD1 no hydrogen 3.080 N/A THR 195.A N ASN 191.A O no hydrogen 3.155 N/A THR 195.A OG1 VAL 150.A O no hydrogen 3.415 N/A THR 195.A OG1 THR 190.A OG1 no hydrogen 2.593 N/A ARG 196.A N LEU 152.A O no hydrogen 3.078 N/A ARG 196.A NH1 GLU 202.A OE1 no hydrogen 3.492 N/A ARG 196.A NH1 GLU 202.A OE2 no hydrogen 2.582 N/A ARG 196.A NH2 PRO 197.A O no hydrogen 3.130 N/A ARG 196.A NH2 GLU 202.A OE1 no hydrogen 2.840 N/A ARG 196.A NH2 GLU 202.A OE2 no hydrogen 3.319 N/A ILE 198.A N SER 154.A O no hydrogen 3.007 N/A THR 199.A N GLU 202.A OE1 no hydrogen 3.051 N/A THR 199.A OG1 GLU 430.A OE2 no hydrogen 3.411 N/A GLY 200.A N GLU 430.A OE1 no hydrogen 3.056 N/A ALA 201.A N GLU 430.A OE2 no hydrogen 3.113 N/A GLU 202.A N THR 199.A OG1 no hydrogen 3.109 N/A GLU 203.A N THR 199.A O no hydrogen 2.909 N/A GLY 204.A N GLY 200.A O no hydrogen 2.980 N/A LEU 205.A N ALA 201.A O no hydrogen 2.857 N/A PHE 206.A N GLU 202.A O no hydrogen 2.802 N/A ALA 207.A N GLU 203.A O no hydrogen 3.171 N/A PHE 208.A N GLY 204.A O no hydrogen 3.032 N/A ILE 209.A N LEU 205.A O no hydrogen 2.888 N/A THR 210.A N PHE 206.A O no hydrogen 2.882 N/A THR 210.A OG1 PHE 206.A O no hydrogen 3.045 N/A THR 210.A OG1 GLY 564.A O no hydrogen 2.637 N/A LEU 211.A N ALA 207.A O no hydrogen 3.002 N/A ASN 212.A N PHE 208.A O no hydrogen 3.143 N/A ASN 212.A ND2 PHE 208.A O no hydrogen 2.827 N/A ASN 212.A ND2 ALA 240.A O no hydrogen 2.884 N/A HIS 213.A N ILE 209.A O no hydrogen 2.948 N/A LEU 214.A N THR 210.A O no hydrogen 2.991 N/A SER 215.A N LEU 211.A O no hydrogen 3.115 N/A SER 215.A OG LEU 211.A O no hydrogen 2.733 N/A SER 215.A OG ASN 212.A O no hydrogen 3.489 N/A ARG 216.A N HIS 213.A O no hydrogen 3.201 N/A ARG 217.A N ASN 212.A O no hydrogen 2.839 N/A ARG 217.A NH1 ASP 238.A O no hydrogen 2.882 N/A LEU 218.A N ASN 212.A O no hydrogen 2.942 N/A ARG 224.A N ASP 221.A O no hydrogen 3.264 N/A ARG 224.A N ASP 221.A OD1 no hydrogen 3.059 N/A ARG 224.A NE ASP 221.A OD1 no hydrogen 3.028 N/A ARG 224.A NE ASP 221.A OD2 no hydrogen 3.432 N/A ARG 224.A NH1 ASP 65.A OD1 no hydrogen 2.877 N/A ARG 224.A NH2 ASP 65.A OD2 no hydrogen 2.985 N/A ARG 224.A NH2 ASP 221.A OD2 no hydrogen 2.746 N/A SER 225.A N ASP 221.A O no hydrogen 2.994 N/A SER 225.A OG ASP 221.A O no hydrogen 2.770 N/A MET 226.A N HIS 234.A O no hydrogen 2.844 N/A ASP 228.A N VAL 232.A O no hydrogen 2.951 N/A TYR 230.A N ASP 228.A OD1 no hydrogen 2.971 N/A GLY 231.A N ASP 228.A O no hydrogen 3.158 N/A VAL 232.A N ASP 228.A OD1 no hydrogen 2.908 N/A LYS 233.A NZ GLU 220.A O no hydrogen 2.757 N/A LYS 233.A NZ ARG 278.A O no hydrogen 2.785 N/A HIS 234.A N MET 226.A O no hydrogen 2.890 N/A HIS 234.A NE2 ASP 228.A OD2 no hydrogen 2.700 N/A SER 235.A OG ASN 237.A O no hydrogen 2.667 N/A ARG 236.A N ARG 224.A O no hydrogen 2.856 N/A ARG 236.A NE PRO 222.A O no hydrogen 3.130 N/A ARG 236.A NE ALA 223.A O no hydrogen 3.269 N/A ARG 236.A NH2 PRO 222.A O no hydrogen 2.763 N/A ARG 236.A NH2 SER 225.A O no hydrogen 2.983 N/A ALA 240.A N ASN 212.A OD1 no hydrogen 2.803 N/A GLY 241.A N PRO 451.A O no hydrogen 2.758 N/A VAL 242.A N VAL 253.A O no hydrogen 2.691 N/A VAL 243.A N PHE 453.A O no hydrogen 2.814 N/A GLU 244.A N GLN 251.A O no hydrogen 2.906 N/A VAL 245.A N THR 455.A O no hydrogen 3.137 N/A GLY 246.A N SER 249.A O no hydrogen 2.955 N/A SER 249.A OG GLN 251.A OE1 no hydrogen 2.865 N/A ALA 250.A N PHE 289.A O no hydrogen 3.137 N/A GLN 251.A N GLU 244.A O no hydrogen 2.692 N/A ILE 252.A N VAL 287.A O no hydrogen 2.883 N/A VAL 253.A N VAL 242.A O no hydrogen 2.846 N/A PHE 254.A N VAL 285.A O no hydrogen 2.867 N/A LEU 256.A N ASP 283.A O no hydrogen 2.647 N/A GLN 257.A NE2 THR 449.A OG1 no hydrogen 3.249 N/A VAL 264.A N PRO 261.A O no hydrogen 3.184 N/A ARG 265.A N SER 434.A O no hydrogen 2.964 N/A ARG 265.A NE SER 433.A O no hydrogen 3.100 N/A ARG 265.A NH2 SER 433.A OG no hydrogen 3.338 N/A VAL 267.A N VAL 284.A O no hydrogen 2.849 N/A ASN 268.A N GLU 272.A OE2 no hydrogen 2.765 N/A ASN 268.A ND2 SER 281.A OG no hydrogen 3.234 N/A ASN 268.A ND2 ASP 283.A OD1 no hydrogen 2.983 N/A LEU 269.A N ALA 282.A O no hydrogen 3.107 N/A GLN 270.A NE2 PRO 276.A O no hydrogen 3.205 N/A GLN 270.A NE2 PRO 280.A O no hydrogen 3.262 N/A ARG 271.A N ASN 268.A OD1 no hydrogen 3.028 N/A GLU 272.A N ASN 268.A O no hydrogen 2.822 N/A ARG 273.A N GLN 270.A O no hydrogen 3.044 N/A ARG 273.A NH1 GLU 579.A OE1 no hydrogen 3.105 N/A ARG 273.A NH2 GLU 579.A OE1 no hydrogen 3.182 N/A LEU 274.A N LEU 269.A O no hydrogen 2.757 N/A LEU 275.A N LEU 269.A O no hydrogen 3.128 N/A ARG 278.A NH1 LEU 575.A O no hydrogen 3.119 N/A ARG 278.A NH2 LEU 575.A O no hydrogen 2.774 N/A TYR 279.A N PRO 276.A O no hydrogen 3.206 N/A VAL 284.A N VAL 267.A O no hydrogen 2.687 N/A VAL 285.A N PHE 254.A O no hydrogen 2.920 N/A SER 286.A OG ALA 201.A O no hydrogen 2.676 N/A VAL 287.A N ILE 252.A O no hydrogen 2.958 N/A SER 288.A OG GLN 251.A OE1 no hydrogen 2.707 N/A PHE 289.A N ALA 250.A O no hydrogen 2.842 N/A MET 290.A N ASN 428.A OD1 no hydrogen 2.741 N/A GLN 291.A NE2 PRO 426.A O no hydrogen 2.943 N/A GLY 293.A N ALA 248.A O no hydrogen 3.186 N/A MET 294.A N GLY 246.A O no hydrogen 2.765 N/A ALA 295.A N GLY 247.A O no hydrogen 2.861 N/A SER 296.A N GLY 247.A O no hydrogen 3.297 N/A SER 296.A OG ALA 248.A O no hydrogen 2.711 N/A SER 296.A OG GLY 293.A O no hydrogen 3.504 N/A SER 297.A N GLY 293.A O no hydrogen 2.825 N/A SER 297.A OG GLY 293.A O no hydrogen 2.878 N/A ALA 298.A N MET 294.A O no hydrogen 3.331 N/A GLY 299.A N ALA 295.A O no hydrogen 3.301 N/A LEU 300.A N SER 296.A O no hydrogen 3.210 N/A PHE 301.A N SER 297.A O no hydrogen 2.778 N/A LEU 302.A N ALA 298.A O no hydrogen 3.194 N/A LYS 303.A N GLY 299.A O no hydrogen 3.136 N/A LYS 303.A NZ ARG 392.A O no hydrogen 2.799 N/A LYS 303.A NZ LYS 394.A O no hydrogen 2.676 N/A GLU 304.A N LEU 300.A O no hydrogen 2.919 N/A LEU 305.A N PHE 301.A O no hydrogen 2.822 N/A CYS 306.A N LEU 302.A O no hydrogen 2.919 N/A SER 307.A N GLU 304.A O no hydrogen 3.476 N/A SER 307.A OG LYS 303.A O no hydrogen 2.769 N/A ASN 308.A N LEU 305.A O no hydrogen 3.322 N/A GLU 310.A N ASN 308.A OD1 no hydrogen 2.981 N/A PHE 311.A N ASN 308.A O no hydrogen 2.977 N/A LEU 312.A N ASN 308.A O no hydrogen 2.848 N/A GLN 313.A N ILE 316.A O no hydrogen 3.019 N/A GLN 313.A NE2 ASP 309.A O no hydrogen 2.829 N/A GLN 313.A NE2 LEU 312.A O no hydrogen 3.109 N/A ILE 316.A N GLN 313.A O no hydrogen 3.031 N/A CYS 317.A N ILE 400.A O no hydrogen 2.877 N/A SER 318.A N PHE 311.A O no hydrogen 2.847 N/A ASN 319.A N GLU 402.A O no hydrogen 2.766 N/A CYS 321.A N ASN 319.A OD1 no hydrogen 2.974 N/A LEU 322.A N ASN 319.A O no hydrogen 3.371 N/A PHE 326.A N PHE 323.A O no hydrogen 3.131 N/A GLN 327.A NE2 GLU 402.A OE2 no hydrogen 3.058 N/A GLN 328.A N ILE 401.A O no hydrogen 3.044 N/A GLN 328.A NE2 SER 329.A O no hydrogen 3.056 N/A CYS 330.A N SER 399.A O no hydrogen 3.025 N/A SER 331.A OG GLU 347.A OE1 no hydrogen 3.232 N/A SER 331.A OG GLU 347.A OE2 no hydrogen 3.175 N/A GLY 333.A N SER 331.A OG no hydrogen 3.136 N/A GLU 336.A N SER 344.A O no hydrogen 2.808 N/A VAL 337.A N SER 517.A OG no hydrogen 2.888 N/A ARG 338.A N SER 342.A O no hydrogen 2.954 N/A ARG 338.A NE GLU 336.A OE1 no hydrogen 3.289 N/A GLY 341.A N ARG 338.A O no hydrogen 3.027 N/A SER 342.A N ASP 340.A OD1 no hydrogen 3.143 N/A SER 342.A OG ASP 340.A OD1 no hydrogen 2.773 N/A SER 344.A N GLU 336.A O no hydrogen 2.735 N/A ASN 346.A N GLU 334.A O no hydrogen 2.720 N/A ASP 348.A N ASN 346.A OD1 no hydrogen 3.214 N/A ARG 350.A N ASP 348.A OD1 no hydrogen 3.359 N/A ARG 350.A NH1 ASP 88.A OD2 no hydrogen 3.345 N/A LYS 351.A N ASP 348.A O no hydrogen 3.001 N/A ASN 352.A N VAL 349.A O no hydrogen 3.321 N/A ARG 353.A N ALA 332.A O no hydrogen 2.911 N/A ARG 353.A NE ALA 332.A O no hydrogen 2.873 N/A LEU 354.A N ASN 352.A OD1 no hydrogen 2.937 N/A LYS 355.A N ASN 352.A O no hydrogen 2.985 N/A LYS 355.A NZ GLU 84.A OE1 no hydrogen 3.172 N/A LYS 355.A NZ GLU 96.A OE2 no hydrogen 2.864 N/A LYS 355.A NZ THR 359.A OG1 no hydrogen 2.870 N/A ALA 358.A N LEU 354.A O no hydrogen 2.806 N/A THR 359.A N LYS 355.A O no hydrogen 2.793 N/A THR 359.A OG1 LYS 355.A O no hydrogen 2.634 N/A TYR 360.A N PRO 356.A O no hydrogen 3.038 N/A CYS 361.A N LEU 357.A O no hydrogen 2.744 N/A SER 362.A N TYR 360.A O no hydrogen 2.868 N/A SER 362.A OG GLU 96.A O no hydrogen 3.351 N/A VAL 363.A N PRO 385.A O no hydrogen 2.934 N/A HIS 364.A N SER 362.A OG no hydrogen 3.237 N/A ASN 365.A N SER 362.A O no hydrogen 3.013 N/A ASN 365.A ND2 TYR 360.A O no hydrogen 2.951 N/A GLU 367.A N ASN 365.A OD1 no hydrogen 3.387 N/A ILE 368.A N ASN 365.A O no hydrogen 2.839 N/A SER 369.A N ASN 365.A O no hydrogen 2.991 N/A SER 369.A OG ASN 365.A O no hydrogen 3.359 N/A PHE 370.A N PRO 366.A O no hydrogen 3.174 N/A LYS 371.A N ILE 368.A O no hydrogen 3.184 N/A LYS 371.A NZ GLU 367.A OE1 no hydrogen 3.272 N/A LYS 371.A NZ GLU 367.A OE2 no hydrogen 3.156 N/A ASN 374.A N LYS 371.A O no hydrogen 3.085 N/A ASN 374.A ND2 GLU 367.A O no hydrogen 2.897 N/A GLU 375.A N LYS 371.A O no hydrogen 3.278 N/A MET 376.A N VAL 372.A O no hydrogen 2.829 N/A GLN 377.A N THR 373.A O no hydrogen 3.191 N/A CYS 378.A N ASN 374.A O no hydrogen 3.153 N/A CYS 378.A SG ASN 374.A O no hydrogen 3.329 N/A ARG 379.A N GLU 375.A O no hydrogen 2.943 N/A GLU 380.A N MET 376.A O no hydrogen 2.805 N/A ASN 381.A N CYS 378.A O no hydrogen 2.886 N/A SER 382.A N ARG 379.A O no hydrogen 3.114 N/A SER 382.A OG GLU 304.A OE2 no hydrogen 3.023 N/A ILE 383.A N CYS 378.A O no hydrogen 3.226 N/A THR 386.A N ASP 384.A OD2 no hydrogen 3.084 N/A THR 386.A OG1 ASP 384.A OD2 no hydrogen 3.286 N/A LYS 387.A N ASP 384.A O no hydrogen 3.352 N/A LEU 389.A N SER 97.A OG no hydrogen 2.822 N/A ARG 392.A N PRO 388.A O no hydrogen 3.130 N/A ARG 392.A NE LYS 387.A O no hydrogen 2.652 N/A ARG 392.A NH1 GLU 96.A O no hydrogen 3.488 N/A ARG 392.A NH1 ALA 358.A O no hydrogen 2.581 N/A ARG 392.A NH2 GLU 96.A O no hydrogen 2.524 N/A ARG 392.A NH2 LYS 387.A O no hydrogen 3.254 N/A MET 393.A N LEU 389.A O no hydrogen 3.057 N/A CYS 398.A SG ILE 400.A O no hydrogen 3.869 N/A SER 399.A N GLY 315.A O no hydrogen 2.905 N/A ILE 400.A N GLY 315.A O no hydrogen 3.266 N/A ILE 401.A N GLN 328.A O no hydrogen 2.877 N/A GLU 402.A N CYS 317.A O no hydrogen 2.802 N/A GLY 403.A N PHE 326.A O no hydrogen 2.980 N/A THR 404.A N ASN 319.A O no hydrogen 2.894 N/A GLY 405.A N LEU 322.A O no hydrogen 2.819 N/A ASN 406.A N PRO 320.A O no hydrogen 3.094 N/A LYS 409.A N ASN 406.A OD1 no hydrogen 3.346 N/A LYS 409.A NZ GLU 310.A OE2 no hydrogen 3.136 N/A CYS 410.A N ASN 406.A O no hydrogen 3.061 N/A CYS 410.A SG CYS 523.A O no hydrogen 3.798 N/A VAL 411.A N PHE 407.A O no hydrogen 2.859 N/A SER 412.A N ASP 408.A O no hydrogen 3.003 N/A GLN 413.A N LYS 409.A O no hydrogen 3.046 N/A VAL 414.A N CYS 410.A O no hydrogen 2.867 N/A GLU 415.A N VAL 411.A O no hydrogen 2.855 N/A SER 416.A N SER 412.A O no hydrogen 3.039 N/A SER 416.A OG SER 412.A O no hydrogen 3.451 N/A SER 416.A OG GLN 413.A O no hydrogen 3.554 N/A ILE 417.A N GLN 413.A O no hydrogen 2.797 N/A LEU 418.A N VAL 414.A O no hydrogen 2.826 N/A VAL 419.A N VAL 414.A O no hydrogen 3.143 N/A ALA 420.A N GLU 415.A O no hydrogen 2.726 N/A ASN 428.A ND2 MET 290.A O no hydrogen 3.124 N/A ASN 428.A ND2 LEU 425.A O no hydrogen 2.847 N/A ALA 432.A N ASN 428.A O no hydrogen 3.058 N/A SER 433.A N ILE 429.A O no hydrogen 2.805 N/A SER 433.A OG GLU 430.A O no hydrogen 2.768 N/A SER 434.A N GLU 430.A O no hydrogen 3.161 N/A SER 434.A N ALA 431.A O no hydrogen 3.056 N/A SER 434.A OG GLU 430.A O no hydrogen 3.530 N/A SER 434.A OG ALA 431.A O no hydrogen 2.817 N/A GLY 435.A N ALA 432.A O no hydrogen 2.961 N/A PHE 436.A N ALA 431.A O no hydrogen 3.018 N/A GLU 437.A N GLN 441.A OE1 no hydrogen 2.848 N/A SER 438.A OG ASP 440.A OD2 no hydrogen 2.436 N/A ASP 440.A N VAL 419.A O no hydrogen 3.249 N/A GLN 441.A N SER 438.A O no hydrogen 3.175 N/A VAL 442.A N VAL 439.A O no hydrogen 3.140 N/A PHE 445.A N GLN 441.A O no hydrogen 3.177 N/A ALA 446.A N VAL 442.A O no hydrogen 3.290 N/A SER 448.A OG PRO 255.A O no hydrogen 2.624 N/A ALA 450.A N SER 448.A OG no hydrogen 3.181 N/A MET 452.A N PHE 545.A O no hydrogen 2.924 N/A PHE 453.A N GLY 241.A O no hydrogen 2.890 N/A ILE 454.A N LYS 547.A O no hydrogen 2.752 N/A THR 455.A N VAL 243.A O no hydrogen 2.696 N/A THR 455.A OG1 VAL 243.A O no hydrogen 2.932 N/A LEU 460.A N GLY 456.A O no hydrogen 3.038 N/A ALA 461.A N ARG 457.A O no hydrogen 2.922 N/A SER 462.A N GLY 458.A O no hydrogen 3.074 N/A SER 462.A OG GLY 458.A O no hydrogen 2.953 N/A ASP 464.A N LEU 460.A O no hydrogen 2.872 N/A THR 465.A N ALA 461.A O no hydrogen 2.894 N/A THR 465.A OG1 ALA 461.A O no hydrogen 2.636 N/A LYS 467.A N ILE 463.A O no hydrogen 2.927 N/A LYS 467.A NZ SER 474.A O no hydrogen 3.310 N/A ASP 468.A N ASP 464.A O no hydrogen 2.910 N/A HIS 469.A N THR 465.A O no hydrogen 3.224 N/A HIS 469.A NE2 GLN 513.A OE1 no hydrogen 2.742 N/A ARG 470.A N LYS 467.A O no hydrogen 2.990 N/A LEU 471.A N LEU 466.A O no hydrogen 2.863 N/A LEU 472.A N LEU 466.A O no hydrogen 3.170 N/A ARG 473.A N GLU 482.A OE2 no hydrogen 3.488 N/A PHE 476.A N ARG 473.A O no hydrogen 3.147 N/A GLU 482.A N ASP 479.A OD2 no hydrogen 3.323 N/A LEU 483.A N ASP 479.A O no hydrogen 2.956 N/A ALA 484.A N VAL 480.A O no hydrogen 2.863 N/A GLU 485.A N GLU 481.A O no hydrogen 2.974 N/A ALA 486.A N GLU 482.A O no hydrogen 3.084 N/A ALA 487.A N LEU 483.A O no hydrogen 2.907 N/A ARG 488.A N ALA 484.A O no hydrogen 2.863 N/A ARG 488.A NE ASP 408.A OD1 no hydrogen 3.324 N/A ARG 488.A NE ASP 408.A OD2 no hydrogen 3.006 N/A ARG 488.A NH2 ASP 408.A OD1 no hydrogen 2.939 N/A ARG 488.A NH2 ASP 408.A OD2 no hydrogen 3.444 N/A GLU 489.A N GLU 485.A O no hydrogen 3.179 N/A PHE 490.A N ALA 486.A O no hydrogen 2.921 N/A CYS 491.A N ALA 487.A O no hydrogen 2.684 N/A CYS 491.A SG ALA 487.A O no hydrogen 3.189 N/A SER 492.A N GLU 489.A O no hydrogen 3.331 N/A SER 492.A OG ARG 488.A O no hydrogen 3.287 N/A SER 492.A OG GLU 489.A O no hydrogen 2.840 N/A SER 493.A N PHE 490.A O no hydrogen 3.212 N/A SER 493.A OG PHE 490.A O no hydrogen 2.536 N/A GLU 494.A N GLN 505.A O no hydrogen 3.211 N/A VAL 495.A N LYS 324.A O no hydrogen 2.740 N/A ILE 496.A N VAL 503.A O no hydrogen 2.961 N/A ARG 498.A N GLY 501.A O no hydrogen 2.991 N/A ARG 498.A NE ASP 500.A OD2 no hydrogen 3.229 N/A ARG 498.A NH1 GLU 512.A OE1 no hydrogen 2.625 N/A ARG 498.A NH1 GLU 512.A OE2 no hydrogen 2.863 N/A ARG 498.A NH2 ASP 500.A OD1 no hydrogen 2.764 N/A ARG 498.A NH2 GLU 512.A OE2 no hydrogen 2.785 N/A GLY 501.A N ARG 498.A O no hydrogen 2.955 N/A VAL 503.A N ILE 496.A O no hydrogen 2.827 N/A ILE 504.A N GLN 513.A O no hydrogen 2.641 N/A GLN 505.A N GLU 494.A O no hydrogen 2.894 N/A LEU 506.A N GLY 511.A O no hydrogen 3.202 N/A ARG 510.A N PRO 507.A O no hydrogen 3.379 N/A GLN 513.A N ILE 504.A O no hydrogen 3.205 N/A LYS 514.A NZ ASP 500.A OD1 no hydrogen 2.773 N/A LEU 515.A N PRO 502.A O no hydrogen 2.996 N/A ASN 516.A N ASN 519.A OD1 no hydrogen 2.795 N/A LEU 518.A N ASN 516.A OD1 no hydrogen 2.803 N/A ASN 519.A N ASN 516.A OD1 no hydrogen 3.043 N/A ASN 519.A ND2 LYS 514.A O no hydrogen 2.956 N/A PHE 520.A N ASN 516.A O no hydrogen 3.089 N/A LEU 522.A N ASN 519.A O no hydrogen 3.211 N/A LYS 524.A N ASP 521.A O no hydrogen 3.246 N/A LYS 524.A NZ SER 297.A OG no hydrogen 2.791 N/A MET 526.A N LEU 522.A O no hydrogen 3.146 N/A ALA 527.A N CYS 523.A O no hydrogen 3.029 N/A LEU 528.A N LYS 524.A O no hydrogen 2.914 N/A THR 529.A N THR 525.A O no hydrogen 2.933 N/A THR 529.A OG1 THR 525.A O no hydrogen 2.696 N/A VAL 530.A N MET 526.A O no hydrogen 2.959 N/A SER 531.A N ALA 527.A O no hydrogen 3.023 N/A LEU 532.A N LEU 528.A O no hydrogen 2.928 N/A LEU 533.A N THR 529.A O no hydrogen 2.838 N/A ARG 534.A N VAL 530.A O no hydrogen 2.973 N/A ARG 534.A NH1 GLU 415.A OE2 no hydrogen 3.024 N/A HIS 535.A N SER 531.A O no hydrogen 3.079 N/A HIS 535.A ND1 SER 531.A O no hydrogen 3.035 N/A MET 536.A N LEU 532.A O no hydrogen 2.977 N/A ALA 537.A N LEU 533.A O no hydrogen 2.903 N/A ALA 538.A N HIS 535.A O no hydrogen 3.377 N/A GLY 539.A N MET 536.A O no hydrogen 3.243 N/A ASN 541.A N SER 447.A OG no hydrogen 2.879 N/A ASN 541.A ND2 SER 447.A O no hydrogen 3.389 N/A GLN 542.A NE2 GLU 540.A O no hydrogen 3.497 N/A SER 544.A N THR 449.A O no hydrogen 2.725 N/A SER 544.A OG THR 449.A O no hydrogen 3.299 N/A LYS 547.A N MET 452.A O no hydrogen 2.903 N/A GLU 549.A N ILE 454.A O no hydrogen 3.395 N/A GLY 554.A N LYS 558.A O no hydrogen 2.944 N/A GLY 557.A N GLY 554.A O no hydrogen 3.269 N/A GLN 566.A NE2 ASP 37.A OD1 no hydrogen 2.869 N/A GLY 568.A N THR 210.A OG1 no hydrogen 2.820 N/A VAL 569.A N TRP 565.A O no hydrogen 2.977 N/A ILE 570.A N GLN 566.A O no hydrogen 3.323 N/A LEU 571.A N VAL 567.A O no hydrogen 2.892 N/A HIS 572.A N GLY 568.A O no hydrogen 2.867 N/A HIS 573.A N ILE 570.A O no hydrogen 3.046 N/A VAL 574.A N ILE 570.A O no hydrogen 2.873 N/A LEU 575.A N LEU 571.A O no hydrogen 3.015 N/A GLU 579.A N GLU 579.A OE2 no hydrogen 2.595 N/A TRP 580.A N PHE 576.A O no hydrogen 2.877 N/A TRP 580.A NE1 TYR 585.A OH no hydrogen 3.018 N/A GLY 581.A N THR 577.A O no hydrogen 2.975 N/A ARG 582.A N GLU 578.A O no hydrogen 3.063 N/A THR 583.A N GLU 579.A O no hydrogen 3.017 N/A THR 583.A OG1 GLU 579.A O no hydrogen 3.168 N/A ALA 584.A N TRP 580.A O no hydrogen 2.742 N/A TYR 585.A N GLY 581.A O no hydrogen 3.022 N/A TYR 585.A OH GLN 31.A OE1 no hydrogen 2.663 N/A GLU 586.A N GLY 581.A O no hydrogen 2.956 N/A ALA 587.A N ARG 582.A O no hydrogen 2.903 N/A GLY 588.A N THR 583.A O no hydrogen 3.270 N/A HIS 591.A N GLY 588.A O no hydrogen 3.382 N/A ASN 592.A N TYR 589.A O no hydrogen 3.064 N/A ASN 592.A ND2 ASN 178.A OD1 no hydrogen 3.073 N/A LEU 593.A N SER 590.A O no hydrogen 3.090 N/A