Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1mdl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 3.A N SER 40.A OG no hydrogen 2.928 N/A ILE 4.A N GLU 74.A O no hydrogen 2.829 N/A THR 5.A N ALA 38.A O no hydrogen 2.776 N/A ARG 8.A N ASP 36.A O no hydrogen 2.959 N/A THR 9.A OG1 ASP 65.A OD1 no hydrogen 2.508 N/A ARG 10.A N LEU 34.A O no hydrogen 3.225 N/A ARG 10.A NH1 GLU 349.A OE1 no hydrogen 2.928 N/A VAL 12.A N LEU 32.A O no hydrogen 2.836 N/A ASN 13.A N TYR 355.A O no hydrogen 3.065 N/A VAL 14.A N ALA 30.A O no hydrogen 2.802 N/A LEU 16.A N GLY 28.A O no hydrogen 2.792 N/A VAL 20.A N VAL 27.A O no hydrogen 3.006 N/A HIS 21.A N SER 139.A OG no hydrogen 2.826 N/A THR 22.A OG1 GLY 25.A O no hydrogen 2.754 N/A GLY 25.A N THR 22.A OG1 no hydrogen 3.214 N/A VAL 27.A N VAL 20.A O no hydrogen 2.969 N/A THR 29.A OG1 ASN 13.A OD1 no hydrogen 3.258 N/A ALA 30.A N VAL 14.A O no hydrogen 2.670 N/A LEU 32.A N VAL 12.A O no hydrogen 2.944 N/A VAL 33.A N LEU 49.A O no hydrogen 2.940 N/A LEU 34.A N ARG 10.A O no hydrogen 2.927 N/A ILE 35.A N SER 47.A O no hydrogen 2.702 N/A ASP 36.A N ARG 8.A O no hydrogen 2.893 N/A LEU 37.A N GLY 45.A O no hydrogen 2.806 N/A ALA 38.A N GLY 6.A O no hydrogen 2.852 N/A THR 39.A N VAL 43.A O no hydrogen 3.213 N/A THR 39.A OG1 VAL 43.A O no hydrogen 2.901 N/A SER 40.A N LEU 3.A O no hydrogen 2.765 N/A ALA 41.A N THR 39.A OG1 no hydrogen 3.156 N/A GLY 42.A N THR 39.A O no hydrogen 3.079 N/A GLY 45.A N LEU 37.A O no hydrogen 2.824 N/A HIS 46.A N ASP 111.A OD2 no hydrogen 2.536 N/A SER 47.A N ILE 35.A O no hydrogen 3.205 N/A SER 47.A OG GLY 104.A O no hydrogen 2.992 N/A TYR 48.A OH GLU 299.A OE1 no hydrogen 2.823 N/A LEU 49.A N VAL 33.A O no hydrogen 2.775 N/A ALA 51.A N PRO 31.A O no hydrogen 2.916 N/A THR 53.A N ALA 51.A O no hydrogen 2.561 N/A VAL 55.A N THR 53.A OG1 no hydrogen 3.315 N/A ALA 56.A N THR 53.A O no hydrogen 2.907 N/A LEU 57.A N PRO 54.A O no hydrogen 3.243 N/A LEU 60.A N ALA 56.A O no hydrogen 2.937 N/A LYS 61.A N LEU 57.A O no hydrogen 3.025 N/A LYS 61.A NZ THR 9.A O no hydrogen 3.086 N/A LYS 61.A NZ THR 9.A OG1 no hydrogen 3.222 N/A LYS 61.A NZ ASP 65.A OD2 no hydrogen 3.134 N/A GLN 62.A N LYS 58.A O no hydrogen 2.893 N/A GLN 62.A NE2 ASP 66.A OD2 no hydrogen 2.891 N/A LEU 63.A N SER 59.A O no hydrogen 2.916 N/A LEU 64.A N LEU 60.A O no hydrogen 3.127 N/A ASP 65.A N LYS 61.A O no hydrogen 2.921 N/A ASP 66.A N GLN 62.A O no hydrogen 2.906 N/A MET 67.A N LEU 64.A O no hydrogen 2.833 N/A ALA 68.A N LEU 64.A O no hydrogen 3.098 N/A MET 70.A N MET 67.A O no hydrogen 2.772 N/A ILE 71.A N ALA 68.A O no hydrogen 3.211 N/A VAL 72.A N ALA 68.A O no hydrogen 3.027 N/A ASN 73.A N ILE 4.A O no hydrogen 2.665 N/A GLU 74.A N ILE 71.A O no hydrogen 3.167 N/A LEU 76.A N VAL 2.A O no hydrogen 2.882 N/A ALA 77.A N PRO 75.A O no hydrogen 2.873 N/A LEU 81.A N ALA 77.A O no hydrogen 2.778 N/A GLU 82.A N PRO 78.A O no hydrogen 2.951 N/A ALA 83.A N VAL 79.A O no hydrogen 3.322 N/A MET 84.A N SER 80.A O no hydrogen 3.216 N/A LEU 85.A N LEU 81.A O no hydrogen 3.054 N/A ALA 86.A N GLU 82.A O no hydrogen 2.941 N/A LYS 87.A N ALA 83.A O no hydrogen 3.160 N/A ARG 88.A N MET 84.A O no hydrogen 3.028 N/A PHE 89.A N LEU 85.A O no hydrogen 3.081 N/A CYS 90.A N LYS 87.A O no hydrogen 3.215 N/A CYS 90.A SG LYS 87.A O no hydrogen 3.417 N/A GLY 93.A N PHE 89.A O no hydrogen 3.047 N/A TYR 94.A OH GLU 82.A OE2 no hydrogen 2.852 N/A THR 95.A N GLY 93.A O no hydrogen 2.879 N/A ARG 99.A N THR 95.A O no hydrogen 3.149 N/A ARG 99.A NH1 TYR 94.A O no hydrogen 3.130 N/A ARG 99.A NH1 GLU 251.A OE2 no hydrogen 2.832 N/A ARG 99.A NH2 GLU 251.A OE1 no hydrogen 3.045 N/A ARG 99.A NH2 GLU 251.A OE2 no hydrogen 3.516 N/A MET 100.A N GLY 96.A O no hydrogen 3.080 N/A ALA 101.A N LEU 97.A O no hydrogen 2.962 N/A ALA 102.A N ILE 98.A O no hydrogen 3.092 N/A ALA 103.A N ARG 99.A O no hydrogen 3.009 N/A GLY 104.A N MET 100.A O no hydrogen 2.900 N/A GLY 104.A N ALA 101.A O no hydrogen 2.646 N/A ILE 105.A N ALA 101.A O no hydrogen 3.143 N/A ASP 106.A N ALA 102.A O no hydrogen 2.968 N/A MET 107.A N ALA 103.A O no hydrogen 3.101 N/A ALA 108.A N GLY 104.A O no hydrogen 3.102 N/A ALA 109.A N ILE 105.A O no hydrogen 2.735 N/A TRP 110.A N ASP 106.A O no hydrogen 2.931 N/A TRP 110.A NE1 THR 276.A OG1 no hydrogen 2.989 N/A ASP 111.A N MET 107.A O no hydrogen 3.118 N/A ALA 112.A N ALA 108.A O no hydrogen 3.098 N/A LEU 113.A N ALA 109.A O no hydrogen 3.062 N/A GLY 114.A N TRP 110.A O no hydrogen 2.949 N/A LYS 115.A N ASP 111.A O no hydrogen 3.019 N/A LYS 115.A NZ VAL 44.A O no hydrogen 2.744 N/A LYS 115.A NZ ASP 111.A OD2 no hydrogen 3.110 N/A VAL 116.A N ALA 112.A O no hydrogen 2.802 N/A HIS 117.A N LEU 113.A O no hydrogen 3.264 N/A GLU 118.A N LYS 115.A O no hydrogen 3.096 N/A THR 119.A N GLY 114.A O no hydrogen 2.882 N/A THR 119.A OG1 PRO 120.A O no hydrogen 3.488 N/A LEU 121.A N GLY 342.A O no hydrogen 2.969 N/A VAL 122.A N HIS 303.A ND1 no hydrogen 2.968 N/A LYS 123.A N PRO 120.A O no hydrogen 3.055 N/A LEU 124.A N PRO 120.A O no hydrogen 3.199 N/A LEU 125.A N LEU 121.A O no hydrogen 3.097 N/A GLY 126.A N LYS 123.A O no hydrogen 3.217 N/A ALA 127.A N VAL 122.A O no hydrogen 3.180 N/A ARG 130.A NH2 LEU 305.A O no hydrogen 3.247 N/A ARG 130.A NH2 THR 308.A O no hydrogen 3.286 N/A VAL 132.A N ALA 335.A O no hydrogen 3.106 N/A ALA 134.A N GLY 333.A O no hydrogen 2.982 N/A TYR 135.A N LEU 314.A O no hydrogen 2.921 N/A ASP 136.A N ALA 160.A O no hydrogen 3.154 N/A SER 137.A N ARG 316.A O no hydrogen 3.012 N/A SER 137.A OG GLU 315.A OE2 no hydrogen 2.709 N/A HIS 138.A N LYS 162.A O no hydrogen 2.948 N/A HIS 138.A NE2 ASP 136.A OD2 no hydrogen 2.725 N/A SER 139.A N ASP 141.A OD2 no hydrogen 3.210 N/A SER 139.A OG ASP 141.A OD1 no hydrogen 2.349 N/A LEU 140.A N HIS 21.A O no hydrogen 3.345 N/A GLY 142.A N TYR 167.A OH no hydrogen 2.932 N/A ALA 146.A N GLY 142.A O no hydrogen 2.905 N/A THR 147.A N VAL 143.A O no hydrogen 3.174 N/A THR 147.A OG1 VAL 143.A O no hydrogen 2.531 N/A THR 147.A OG1 SER 179.A OG no hydrogen 2.605 N/A GLU 148.A N LYS 144.A O no hydrogen 2.990 N/A ARG 149.A N LEU 145.A O no hydrogen 2.893 N/A ALA 150.A N ALA 146.A O no hydrogen 3.074 N/A VAL 151.A N THR 147.A O no hydrogen 2.917 N/A THR 152.A N GLU 148.A O no hydrogen 3.111 N/A THR 152.A OG1 GLU 148.A O no hydrogen 3.148 N/A ALA 153.A N ARG 149.A O no hydrogen 3.096 N/A ALA 154.A N ALA 150.A O no hydrogen 3.012 N/A GLU 155.A N VAL 151.A O no hydrogen 2.970 N/A LEU 156.A N THR 152.A O no hydrogen 2.774 N/A GLY 157.A N ALA 154.A O no hydrogen 2.936 N/A PHE 158.A N ALA 153.A O no hydrogen 2.846 N/A ARG 159.A NH2 ASP 187.A OD1 no hydrogen 3.217 N/A VAL 161.A N GLY 189.A O no hydrogen 3.122 N/A LYS 162.A N ASP 136.A O no hydrogen 2.953 N/A LYS 162.A NZ TYR 135.A OH no hydrogen 2.861 N/A LYS 162.A NZ GLU 219.A OE1 no hydrogen 2.904 N/A LYS 162.A NZ GLU 219.A OE2 no hydrogen 3.422 N/A LYS 162.A NZ GLU 315.A OE2 no hydrogen 3.377 N/A THR 163.A N MET 191.A O no hydrogen 3.072 N/A THR 163.A OG1 SER 139.A O no hydrogen 3.555 N/A ARG 164.A N SER 139.A O no hydrogen 3.266 N/A ILE 165.A N ASP 193.A O no hydrogen 2.924 N/A GLY 166.A N ASP 173.A OD1 no hydrogen 2.937 N/A TYR 167.A N ASP 173.A OD1 no hydrogen 2.934 N/A GLN 172.A N ALA 169.A O no hydrogen 2.748 N/A ASP 173.A N ALA 169.A O no hydrogen 3.355 N/A LEU 174.A N LEU 170.A O no hydrogen 3.109 N/A ALA 175.A N ASP 171.A O no hydrogen 3.117 N/A VAL 176.A N GLN 172.A O no hydrogen 3.243 N/A VAL 177.A N ASP 173.A O no hydrogen 3.272 N/A ARG 178.A N LEU 174.A O no hydrogen 2.986 N/A ARG 178.A NE GLU 213.A OE1 no hydrogen 3.230 N/A ARG 178.A NE GLU 213.A OE2 no hydrogen 3.380 N/A ARG 178.A NH2 GLU 213.A OE2 no hydrogen 2.917 N/A SER 179.A N ALA 175.A O no hydrogen 2.989 N/A SER 179.A OG THR 147.A OG1 no hydrogen 2.605 N/A ILE 180.A N VAL 176.A O no hydrogen 3.074 N/A ARG 181.A N VAL 177.A O no hydrogen 2.989 N/A ARG 181.A NE GLY 185.A O no hydrogen 3.367 N/A ARG 181.A NH2 GLY 185.A O no hydrogen 3.122 N/A ARG 181.A NH2 PHE 188.A O no hydrogen 2.455 N/A GLN 182.A N ARG 178.A O no hydrogen 3.065 N/A ALA 183.A N SER 179.A O no hydrogen 3.338 N/A VAL 184.A N ILE 180.A O no hydrogen 2.831 N/A GLY 185.A N ARG 181.A O no hydrogen 2.812 N/A GLY 189.A N ARG 159.A O no hydrogen 3.072 N/A ILE 190.A N THR 216.A OG1 no hydrogen 3.219 N/A MET 191.A N VAL 161.A O no hydrogen 2.784 N/A VAL 192.A N TRP 217.A O no hydrogen 3.396 N/A ASP 193.A N THR 163.A O no hydrogen 2.953 N/A TYR 194.A N GLU 219.A O no hydrogen 2.929 N/A TYR 194.A OH ASP 173.A OD2 no hydrogen 2.683 N/A ASN 195.A N ASP 193.A OD1 no hydrogen 2.806 N/A GLN 196.A N GLU 220.A O no hydrogen 2.570 N/A SER 197.A N TYR 194.A O no hydrogen 2.976 N/A SER 197.A OG TYR 194.A O no hydrogen 2.862 N/A LEU 198.A N PRO 221.A O no hydrogen 3.081 N/A ALA 202.A N ASP 199.A OD1 no hydrogen 2.841 N/A ALA 203.A N ASP 199.A O no hydrogen 2.853 N/A ILE 204.A N VAL 200.A O no hydrogen 2.948 N/A LYS 205.A N PRO 201.A O no hydrogen 3.046 N/A ARG 206.A N ALA 202.A O no hydrogen 3.031 N/A ARG 206.A NH1 TYR 167.A O no hydrogen 3.103 N/A ARG 206.A NH1 ASP 173.A OD2 no hydrogen 2.635 N/A ARG 206.A NH2 TYR 167.A O no hydrogen 3.326 N/A ARG 206.A NH2 PRO 168.A O no hydrogen 3.173 N/A SER 207.A N ALA 203.A O no hydrogen 2.797 N/A SER 207.A OG ALA 203.A O no hydrogen 2.687 N/A GLN 208.A N ILE 204.A O no hydrogen 3.158 N/A GLN 208.A NE2 LYS 236.A O no hydrogen 2.861 N/A ALA 209.A N LYS 205.A O no hydrogen 3.238 N/A LEU 210.A N ARG 206.A O no hydrogen 3.043 N/A GLN 211.A N SER 207.A O no hydrogen 2.833 N/A GLN 212.A N GLN 208.A O no hydrogen 3.315 N/A GLU 213.A N LEU 210.A O no hydrogen 2.612 N/A GLY 214.A N LEU 210.A O no hydrogen 3.076 N/A THR 216.A N ILE 190.A O no hydrogen 2.906 N/A THR 216.A OG1 ILE 190.A O no hydrogen 3.529 N/A TRP 217.A NE1 GLU 219.A OE1 no hydrogen 3.084 N/A ILE 218.A N PRO 240.A O no hydrogen 2.984 N/A GLU 219.A N VAL 192.A O no hydrogen 3.033 N/A GLU 220.A N GLN 242.A O no hydrogen 2.977 N/A THR 222.A OG1 LEU 198.A O no hydrogen 2.767 N/A LEU 223.A N THR 222.A OG1 no hydrogen 2.863 N/A GLN 224.A N GLN 196.A OE1 no hydrogen 2.823 N/A ASP 226.A N LEU 223.A O no hydrogen 2.967 N/A GLY 229.A N ASP 226.A OD1 no hydrogen 2.816 N/A HIS 230.A N ASP 226.A O no hydrogen 3.111 N/A GLN 231.A N TYR 227.A O no hydrogen 2.787 N/A ARG 232.A N GLU 228.A O no hydrogen 3.010 N/A ILE 233.A N GLY 229.A O no hydrogen 3.078 N/A GLN 234.A N HIS 230.A O no hydrogen 2.856 N/A GLN 234.A NE2 GLN 234.A O no hydrogen 2.984 N/A GLN 234.A NE2 VAL 239.A O no hydrogen 3.187 N/A SER 235.A N GLN 231.A O no hydrogen 2.953 N/A SER 235.A OG GLN 231.A O no hydrogen 3.393 N/A SER 235.A OG ARG 232.A O no hydrogen 2.626 N/A LYS 236.A N ILE 233.A O no hydrogen 2.968 N/A LEU 237.A N GLN 234.A O no hydrogen 3.022 N/A ASN 238.A N GLN 211.A OE1 no hydrogen 2.887 N/A VAL 239.A N GLN 211.A OE1 no hydrogen 3.338 N/A VAL 241.A N GLN 234.A OE1 no hydrogen 2.843 N/A GLN 242.A N ILE 218.A O no hydrogen 2.687 N/A GLN 242.A NE2 MET 243.A O no hydrogen 3.219 N/A ASN 246.A ND2 GLU 220.A OE2 no hydrogen 2.693 N/A TRP 247.A N GLY 244.A O no hydrogen 3.106 N/A LEU 248.A N GLU 252.A OE1 no hydrogen 2.882 N/A GLY 249.A N LYS 271.A O no hydrogen 2.882 N/A GLU 251.A N GLU 251.A OE1 no hydrogen 2.766 N/A GLU 252.A N GLY 249.A O no hydrogen 3.133 N/A MET 253.A N GLY 249.A O no hydrogen 3.413 N/A PHE 254.A N PRO 250.A O no hydrogen 2.742 N/A LYS 255.A N GLU 251.A O no hydrogen 3.270 N/A ALA 256.A N GLU 252.A O no hydrogen 3.148 N/A LEU 257.A N MET 253.A O no hydrogen 2.833 N/A SER 258.A N PHE 254.A O no hydrogen 2.847 N/A SER 258.A OG PHE 254.A O no hydrogen 2.995 N/A GLY 260.A N LEU 257.A O no hydrogen 3.117 N/A ALA 261.A N ALA 256.A O no hydrogen 3.144 N/A CYS 262.A SG LEU 264.A O no hydrogen 3.337 N/A ARG 263.A N VAL 241.A O no hydrogen 3.265 N/A ARG 263.A NH2 LEU 237.A O no hydrogen 3.053 N/A ARG 263.A NH2 ASN 238.A O no hydrogen 2.774 N/A ALA 265.A N PRO 291.A O no hydrogen 3.115 N/A MET 266.A N MET 243.A O no hydrogen 3.059 N/A LYS 271.A N ASP 268.A OD1 no hydrogen 2.921 N/A LYS 271.A NZ ASN 246.A OD1 no hydrogen 2.917 N/A ILE 272.A N ASP 268.A O no hydrogen 2.807 N/A GLY 273.A N MET 270.A O no hydrogen 3.299 N/A GLY 274.A N ALA 269.A O no hydrogen 2.803 N/A THR 276.A N ASP 106.A OD2 no hydrogen 2.863 N/A THR 276.A OG1 ASP 106.A OD1 no hydrogen 2.662 N/A THR 276.A OG1 ASP 106.A OD2 no hydrogen 3.304 N/A GLY 277.A N GLY 273.A O no hydrogen 3.132 N/A TRP 278.A N GLY 274.A O no hydrogen 2.910 N/A TRP 278.A NE1 THR 308.A OG1 no hydrogen 2.904 N/A ILE 279.A N VAL 275.A O no hydrogen 2.952 N/A ARG 280.A N THR 276.A O no hydrogen 3.480 N/A ARG 280.A NH1 GLU 82.A OE1 no hydrogen 3.182 N/A ALA 281.A N GLY 277.A O no hydrogen 2.807 N/A SER 282.A N TRP 278.A O no hydrogen 2.789 N/A ALA 283.A N ILE 279.A O no hydrogen 3.243 N/A LEU 284.A N ARG 280.A O no hydrogen 3.305 N/A ALA 285.A N ALA 281.A O no hydrogen 2.855 N/A GLN 286.A N SER 282.A O no hydrogen 2.942 N/A GLN 287.A N ALA 283.A O no hydrogen 3.140 N/A PHE 288.A N LEU 284.A O no hydrogen 2.813 N/A GLY 289.A N GLN 286.A O no hydrogen 3.363 N/A ILE 290.A N ALA 285.A O no hydrogen 3.063 N/A MET 292.A N THR 310.A O no hydrogen 3.004 N/A SER 293.A N ALA 265.A O no hydrogen 2.978 N/A SER 294.A N TRP 313.A O no hydrogen 3.106 N/A HIS 295.A ND1 ASP 268.A OD2 no hydrogen 2.435 N/A LEU 296.A N GLU 315.A OE1 no hydrogen 2.955 N/A SER 301.A N PHE 297.A O no hydrogen 2.941 N/A SER 301.A OG LEU 296.A O no hydrogen 3.312 N/A SER 301.A OG PHE 297.A O no hydrogen 2.769 N/A ALA 302.A N GLN 298.A O no hydrogen 3.244 N/A HIS 303.A N ILE 300.A O no hydrogen 3.168 N/A LEU 304.A N ILE 300.A O no hydrogen 2.987 N/A LEU 305.A N SER 301.A O no hydrogen 2.776 N/A ALA 306.A N ALA 302.A O no hydrogen 3.394 N/A ALA 307.A N LEU 304.A O no hydrogen 3.176 N/A THR 308.A N LEU 305.A O no hydrogen 2.934 N/A THR 308.A OG1 LEU 304.A O no hydrogen 2.695 N/A THR 310.A OG1 ILE 290.A O no hydrogen 2.961 N/A ALA 311.A N THR 308.A O no hydrogen 3.035 N/A HIS 312.A N MET 292.A O no hydrogen 2.831 N/A TRP 313.A N SER 293.A OG no hydrogen 3.006 N/A LEU 314.A N GLN 133.A O no hydrogen 2.927 N/A GLU 315.A N SER 294.A OG no hydrogen 3.219 N/A ARG 316.A N TYR 135.A O no hydrogen 2.718 N/A LEU 317.A N GLN 298.A OE1 no hydrogen 2.997 N/A VAL 323.A N ALA 320.A O no hydrogen 2.902 N/A GLU 325.A N ILE 346.A O no hydrogen 2.822 N/A THR 327.A N GLU 325.A O no hydrogen 2.814 N/A THR 327.A OG1 GLY 344.A O no hydrogen 2.658 N/A GLU 331.A N ASN 334.A O no hydrogen 2.837 N/A ASN 334.A N GLU 331.A O no hydrogen 3.284 N/A ALA 335.A N VAL 132.A O no hydrogen 2.807 N/A VAL 336.A N THR 329.A O no hydrogen 2.816 N/A LEU 340.A N PRO 338.A O no hydrogen 3.020 N/A GLY 342.A N THR 119.A O no hydrogen 3.045 N/A VAL 343.A N ASP 111.A OD1 no hydrogen 2.808 N/A TRP 347.A NE1 ASP 36.A OD1 no hydrogen 2.760 N/A ARG 348.A N VAL 323.A O no hydrogen 3.075 N/A ILE 352.A N ARG 348.A O no hydrogen 3.182 N/A GLY 353.A N GLU 349.A O no hydrogen 3.386 N/A LYS 354.A N GLU 351.A O no hydrogen 2.897 N/A LYS 354.A NZ GLU 351.A OE1 no hydrogen 3.273 N/A TYR 355.A N ILE 352.A O no hydrogen 3.018 N/A VAL 357.A N ALA 11.A O no hydrogen 2.849 N/A