Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2w2i_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 6.A N LYS 35.A O no hydrogen 2.881 N/A THR 9.A N GLU 12.A OE2 no hydrogen 3.059 N/A GLU 12.A N THR 9.A OG1 no hydrogen 3.201 N/A PHE 13.A N THR 9.A O no hydrogen 2.764 N/A ALA 14.A N GLU 11.A O no hydrogen 3.395 N/A ASN 17.A ND2 GLY 143.A O no hydrogen 2.861 N/A THR 18.A N ASP 15.A OD1 no hydrogen 2.627 N/A THR 18.A OG1 ASP 15.A OD1 no hydrogen 2.556 N/A TYR 19.A N ASP 15.A O no hydrogen 3.142 N/A VAL 20.A N PHE 16.A O no hydrogen 2.966 N/A ALA 21.A N ASN 17.A O no hydrogen 3.175 N/A TYR 22.A N THR 18.A O no hydrogen 2.959 N/A MET 23.A N TYR 19.A O no hydrogen 2.845 N/A GLU 24.A N VAL 20.A O no hydrogen 3.032 N/A SER 25.A N ALA 21.A O no hydrogen 2.985 N/A SER 25.A OG TYR 22.A O no hydrogen 2.589 N/A GLN 26.A N TYR 22.A O no hydrogen 3.134 N/A GLN 26.A N MET 23.A O no hydrogen 3.152 N/A GLN 26.A NE2 SER 25.A OG no hydrogen 3.316 N/A GLY 27.A N GLU 24.A O no hydrogen 2.842 N/A ALA 28.A N MET 23.A O no hydrogen 3.027 N/A GLN 30.A N GLY 27.A O no hydrogen 2.986 N/A GLY 32.A N HIS 29.A O no hydrogen 3.121 N/A ALA 34.A N VAL 254.A O no hydrogen 2.966 N/A LYS 35.A N MET 4.A O no hydrogen 2.933 N/A LYS 35.A NZ THR 246.A O no hydrogen 2.814 N/A LYS 35.A NZ GLU 251.A OE1 no hydrogen 2.977 N/A VAL 36.A N PHE 252.A O no hydrogen 2.933 N/A ILE 37.A N PHE 6.A O no hydrogen 2.867 N/A TRP 42.A N PRO 39.A O no hydrogen 3.182 N/A TRP 42.A NE1 GLN 136.A O no hydrogen 2.784 N/A ARG 45.A NE LEU 129.A O no hydrogen 2.657 N/A ARG 45.A NH1 MET 47.A O no hydrogen 3.423 N/A ARG 45.A NH1 ASP 50.A OD2 no hydrogen 3.446 N/A ARG 45.A NH2 LEU 129.A O no hydrogen 3.199 N/A GLN 46.A N GLU 131.A OE2 no hydrogen 2.828 N/A TYR 48.A OH HIS 190.A ND1 no hydrogen 2.590 N/A ILE 54.A N ILE 51.A O no hydrogen 3.164 N/A ILE 56.A N MET 81.A O no hydrogen 2.821 N/A LEU 60.A N TYR 121.A O no hydrogen 2.836 N/A GLN 61.A N LYS 76.A O no hydrogen 2.684 N/A GLN 62.A N PRO 119.A O no hydrogen 2.965 N/A GLN 62.A NE2 HIS 75.A NE2 no hydrogen 2.960 N/A GLN 62.A NE2 THR 173.A O no hydrogen 2.827 N/A VAL 63.A N TYR 74.A O no hydrogen 2.690 N/A SER 65.A N THR 72.A O no hydrogen 2.986 N/A SER 65.A OG TYR 74.A OH no hydrogen 3.226 N/A GLN 67.A N VAL 70.A O no hydrogen 3.278 N/A VAL 70.A N GLN 67.A O no hydrogen 3.112 N/A PHE 71.A N LEU 229.A O no hydrogen 2.922 N/A THR 72.A N SER 65.A O no hydrogen 2.890 N/A GLN 73.A N VAL 227.A O no hydrogen 2.919 N/A GLN 73.A NE2 THR 173.A OG1 no hydrogen 3.018 N/A TYR 74.A N VAL 63.A O no hydrogen 2.719 N/A TYR 74.A OH SER 65.A OG no hydrogen 3.226 N/A LYS 76.A N GLN 61.A O no hydrogen 2.792 N/A LYS 78.A N PRO 59.A O no hydrogen 2.845 N/A MET 81.A N ILE 56.A O no hydrogen 3.203 N/A ARG 82.A N GLN 85.A OE1 no hydrogen 2.727 N/A ARG 82.A NE ASP 53.A O no hydrogen 2.905 N/A ARG 82.A NH2 ASP 53.A O no hydrogen 3.051 N/A VAL 83.A N ILE 54.A O no hydrogen 2.909 N/A GLY 84.A N GLU 52.A O no hydrogen 2.882 N/A TYR 86.A N ARG 82.A O no hydrogen 2.948 N/A TYR 86.A OH ILE 120.A O no hydrogen 2.573 N/A ARG 87.A N VAL 83.A O no hydrogen 2.734 N/A ARG 88.A N GLY 84.A O no hydrogen 3.066 N/A LEU 89.A N GLN 85.A O no hydrogen 2.870 N/A ALA 90.A N TYR 86.A O no hydrogen 2.745 N/A ASN 91.A N ARG 87.A O no hydrogen 3.044 N/A SER 92.A N LEU 89.A O no hydrogen 3.252 N/A SER 92.A OG LEU 89.A O no hydrogen 2.761 N/A TYR 95.A N SER 92.A O no hydrogen 3.154 N/A GLN 96.A N SER 92.A O no hydrogen 2.806 N/A GLN 96.A NE2 ASN 91.A OD1 no hydrogen 3.259 N/A THR 97.A N GLN 96.A OE1 no hydrogen 2.748 N/A THR 97.A OG1 GLN 96.A OE1 no hydrogen 3.284 N/A THR 97.A OG1 HIS 266.A O no hydrogen 2.650 N/A GLN 101.A N ASP 105.A OD2 no hydrogen 2.609 N/A ASP 105.A N ASN 102.A OD1 no hydrogen 2.823 N/A LEU 106.A N ASN 102.A O no hydrogen 2.938 N/A GLU 107.A N PHE 103.A O no hydrogen 2.667 N/A GLN 108.A N ALA 104.A O no hydrogen 2.977 N/A ARG 109.A N ASP 105.A O no hydrogen 2.990 N/A ARG 109.A NH1 ASP 105.A OD1 no hydrogen 2.880 N/A TYR 110.A N LEU 106.A O no hydrogen 2.802 N/A TRP 111.A N GLU 107.A O no hydrogen 3.022 N/A TRP 111.A NE1 TYR 198.A OH no hydrogen 2.908 N/A LYS 112.A N GLN 108.A O no hydrogen 2.795 N/A SER 113.A N TYR 110.A O no hydrogen 3.131 N/A SER 113.A OG TYR 110.A O no hydrogen 2.529 N/A TYR 121.A N LEU 60.A O no hydrogen 2.699 N/A GLY 122.A N PHE 167.A O no hydrogen 2.845 N/A ILE 125.A N LEU 165.A O no hydrogen 3.082 N/A SER 126.A OG GLU 158.A OE2 no hydrogen 2.897 N/A GLY 127.A N PRO 163.A O no hydrogen 3.136 N/A SER 128.A OG GLU 272.A OE1 no hydrogen 3.310 N/A SER 128.A OG GLU 272.A OE2 no hydrogen 2.456 N/A LEU 129.A N GLU 272.A OE1 no hydrogen 2.862 N/A PHE 130.A N SER 128.A OG no hydrogen 3.124 N/A GLU 131.A N ALA 44.A O no hydrogen 3.319 N/A SER 133.A OG GLU 131.A OE1 no hydrogen 3.084 N/A THR 134.A N GLU 131.A O no hydrogen 3.014 N/A THR 134.A OG1 LYS 43.A O no hydrogen 2.937 N/A THR 134.A OG1 ALA 44.A O no hydrogen 2.682 N/A LYS 135.A NZ GLU 132.A O no hydrogen 3.273 N/A ASN 138.A ND2 THR 134.A O no hydrogen 3.078 N/A GLY 140.A N ASN 138.A OD1 no hydrogen 2.959 N/A HIS 141.A N ASN 138.A O no hydrogen 2.754 N/A LEU 146.A N THR 144.A OG1 no hydrogen 3.218 N/A ASP 147.A N THR 144.A O no hydrogen 3.013 N/A LEU 148.A N ILE 145.A O no hydrogen 2.969 N/A LEU 149.A N LEU 146.A O no hydrogen 2.994 N/A GLN 151.A N ASP 147.A O no hydrogen 3.027 N/A GLU 152.A N LEU 148.A O no hydrogen 2.809 N/A CYS 153.A N LEU 149.A O no hydrogen 3.112 N/A GLY 154.A N GLU 150.A O no hydrogen 2.813 N/A VAL 155.A N LEU 149.A O no hydrogen 3.393 N/A ILE 157.A N ASN 161.A OD1 no hydrogen 2.749 N/A GLY 159.A N THR 162.A OG1 no hydrogen 3.136 N/A VAL 160.A N ILE 157.A O no hydrogen 2.931 N/A ASN 161.A N ILE 157.A O no hydrogen 3.050 N/A ASN 161.A ND2 VAL 155.A O no hydrogen 2.998 N/A TYR 164.A N ALA 273.A O no hydrogen 2.897 N/A LEU 165.A N ILE 125.A O no hydrogen 2.641 N/A TYR 166.A N ALA 271.A O no hydrogen 2.792 N/A TYR 166.A OH ASP 124.A OD1 no hydrogen 3.403 N/A PHE 167.A N GLY 122.A O no hydrogen 2.827 N/A GLY 168.A N ASN 269.A O no hydrogen 2.940 N/A MET 169.A N THR 172.A OG1 no hydrogen 3.261 N/A LYS 171.A N ASN 265.A O no hydrogen 3.060 N/A LYS 171.A NZ PRO 115.A O no hydrogen 2.771 N/A LYS 171.A NZ ASN 117.A O no hydrogen 2.857 N/A THR 172.A N MET 169.A O no hydrogen 3.045 N/A THR 172.A OG1 MET 169.A O no hydrogen 2.657 N/A THR 173.A N GLN 62.A OE1 no hydrogen 2.801 N/A THR 173.A OG1 GLN 73.A OE1 no hydrogen 3.080 N/A PHE 174.A N GLY 263.A O no hydrogen 3.064 N/A TRP 176.A N ALA 228.A O no hydrogen 3.045 N/A TRP 176.A NE1 ILE 230.A O no hydrogen 3.234 N/A HIS 177.A N HIS 261.A O no hydrogen 3.159 N/A HIS 177.A ND1 ALA 175.A O no hydrogen 2.936 N/A ASP 182.A N GLU 179.A O no hydrogen 3.035 N/A LEU 183.A N ASP 180.A O no hydrogen 3.065 N/A TYR 184.A N PHE 276.A O no hydrogen 3.131 N/A TYR 184.A OH GLU 24.A OE2 no hydrogen 2.633 N/A TYR 184.A OH THR 278.A OG1 no hydrogen 2.813 N/A SER 185.A N THR 255.A O no hydrogen 3.169 N/A SER 185.A OG THR 255.A OG1 no hydrogen 2.491 N/A ILE 186.A N ILE 274.A O no hydrogen 3.003 N/A ASN 187.A N MET 253.A O no hydrogen 2.847 N/A ASN 187.A ND2.B SER 185.A OG no hydrogen 3.289 N/A ASN 187.A ND2.B MET 253.A O no hydrogen 3.260 N/A TYR 188.A N GLU 272.A O no hydrogen 2.755 N/A LEU 189.A N GLU 251.A O no hydrogen 3.278 N/A HIS 190.A ND1 TYR 48.A OH no hydrogen 2.590 N/A HIS 190.A NE2 GLU 272.A OE1 no hydrogen 2.700 N/A GLU 193.A N PHE 268.A O no hydrogen 2.934 N/A LYS 195.A N GLN 247.A O no hydrogen 2.922 N/A LYS 195.A NZ ASN 265.A OD1 no hydrogen 2.830 N/A THR 196.A N PHE 264.A O no hydrogen 2.842 N/A THR 196.A OG1 THR 246.A OG1 no hydrogen 3.021 N/A THR 196.A OG1 HIS 266.A NE2 no hydrogen 2.589 N/A TRP 197.A N MET 245.A O no hydrogen 2.850 N/A TRP 197.A NE1 GLN 247.A OE1 no hydrogen 2.896 N/A TYR 198.A N ALA 262.A O no hydrogen 2.710 N/A TYR 198.A OH GLU 107.A OE2 no hydrogen 2.491 N/A VAL 199.A N ASN 243.A O no hydrogen 2.920 N/A VAL 200.A N TYR 260.A O no hydrogen 3.040 N/A HIS 204.A N PRO 201.A O no hydrogen 2.805 N/A GLY 205.A N PRO 202.A O no hydrogen 3.192 N/A LEU 208.A N HIS 204.A O no hydrogen 3.225 N/A GLU 209.A N GLY 205.A O no hydrogen 2.970 N/A ARG 210.A N GLN 206.A O no hydrogen 2.983 N/A LEU 211.A N HIS 207.A O no hydrogen 3.013 N/A ALA 212.A N LEU 208.A O no hydrogen 2.838 N/A ARG 213.A N GLU 209.A O no hydrogen 3.049 N/A GLU 214.A N ARG 210.A O no hydrogen 3.102 N/A LEU 215.A N LEU 211.A O no hydrogen 2.925 N/A PHE 216.A N ALA 212.A O no hydrogen 2.859 N/A SER 220.A N PHE 216.A O no hydrogen 3.153 N/A SER 220.A OG ARG 213.A O no hydrogen 3.390 N/A SER 220.A OG PHE 216.A O no hydrogen 2.940 N/A SER 220.A OG PRO 217.A O no hydrogen 3.017 N/A LYS 226.A N LEU 223.A O no hydrogen 2.405 N/A LEU 229.A N PHE 71.A O no hydrogen 2.850 N/A SER 231.A N GLY 69.A O no hydrogen 2.801 N/A VAL 234.A N SER 231.A OG no hydrogen 3.183 N/A LEU 235.A N SER 231.A O no hydrogen 3.047 N/A LYS 236.A N PRO 232.A O no hydrogen 2.810 N/A GLU 237.A N THR 233.A O no hydrogen 2.763 N/A ASN 238.A N VAL 234.A O no hydrogen 3.134 N/A ASN 238.A N LEU 235.A O no hydrogen 3.141 N/A ASN 238.A ND2 VAL 234.A O no hydrogen 2.710 N/A GLY 239.A N LYS 236.A O no hydrogen 2.939 N/A ILE 240.A N LEU 235.A O no hydrogen 2.950 N/A ASN 243.A N VAL 199.A O no hydrogen 2.814 N/A ASN 243.A ND2 HIS 1.A O no hydrogen 3.142 N/A CYS 244.A SG TRP 197.A O no hydrogen 3.700 N/A MET 245.A N TRP 197.A O no hydrogen 2.993 N/A THR 246.A OG1 THR 196.A OG1 no hydrogen 3.021 N/A GLN 247.A N LYS 195.A O no hydrogen 2.773 N/A GLN 247.A NE2 ASN 187.A O no hydrogen 3.207 N/A GLN 247.A NE2 ASN 187.A OD1.A no hydrogen 3.324 N/A GLN 247.A NE2 GLU 251.A O no hydrogen 2.908 N/A GLU 248.A N GLU 251.A OE1 no hydrogen 2.934 N/A GLY 250.A N LEU 189.A O no hydrogen 2.828 N/A GLU 251.A N GLU 248.A O no hydrogen 3.189 N/A PHE 252.A N VAL 36.A O no hydrogen 2.944 N/A MET 253.A N ASN 187.A O no hydrogen 2.780 N/A VAL 254.A N ALA 34.A O no hydrogen 2.859 N/A THR 255.A N SER 185.A O no hydrogen 2.870 N/A THR 255.A OG1 SER 185.A OG no hydrogen 2.491 N/A PHE 256.A N GLY 32.A O no hydrogen 3.123 N/A GLY 259.A N PHE 256.A O no hydrogen 2.932 N/A TYR 260.A OH GLU 209.A OE2 no hydrogen 2.586 N/A HIS 261.A N HIS 177.A O no hydrogen 2.968 N/A HIS 261.A ND1 GLY 259.A O no hydrogen 3.104 N/A ALA 262.A N TYR 198.A O no hydrogen 2.976 N/A GLY 263.A N PHE 174.A O no hydrogen 2.963 N/A PHE 264.A N THR 196.A O no hydrogen 3.028 N/A ASN 265.A N THR 172.A O no hydrogen 2.955 N/A ASN 265.A ND2 TYR 121.A OH no hydrogen 3.248 N/A ASN 265.A ND2 THR 172.A OG1 no hydrogen 2.759 N/A HIS 266.A N PRO 194.A O no hydrogen 2.915 N/A HIS 266.A NE2 THR 196.A OG1 no hydrogen 2.589 N/A ASN 269.A N GLY 168.A O no hydrogen 3.225 N/A ASN 269.A ND2 GLU 193.A O no hydrogen 2.970 N/A ASN 269.A ND2 PRO 194.A O no hydrogen 3.433 N/A ASN 269.A ND2 ASN 265.A OD1 no hydrogen 2.989 N/A CYS 270.A N PHE 191.A O no hydrogen 2.973 N/A ALA 271.A N TYR 166.A O no hydrogen 2.867 N/A GLU 272.A N TYR 188.A O no hydrogen 2.823 N/A ALA 273.A N TYR 164.A O no hydrogen 2.942 N/A ILE 274.A N ILE 186.A O no hydrogen 3.172 N/A ASN 275.A N VAL 160.A O no hydrogen 3.068 N/A ASN 275.A ND2 GLU 179.A OE1 no hydrogen 2.563 N/A ASN 275.A ND2 TYR 184.A O no hydrogen 2.907 N/A PHE 276.A N TYR 184.A O no hydrogen 3.150 N/A ALA 277.A N THR 144.A OG1 no hydrogen 3.256 N/A THR 278.A OG1 TYR 184.A OH no hydrogen 2.813 N/A ARG 280.A NE GLU 24.A OE1 no hydrogen 3.243 N/A ARG 280.A NH1 GLU 24.A OE2 no hydrogen 3.020 N/A TRP 281.A N THR 278.A O no hydrogen 2.927 N/A TRP 281.A N THR 278.A OG1 no hydrogen 3.372 N/A TRP 281.A NE1 MET 181.A O no hydrogen 2.720 N/A ILE 282.A N PRO 279.A O no hydrogen 3.139 N/A GLY 285.A N TRP 281.A O no hydrogen 2.892 N/A LYS 286.A N ILE 282.A O no hydrogen 2.855 N/A LYS 286.A NZ ASP 283.A OD1 no hydrogen 2.858 N/A LYS 286.A NZ GLN 301.A OE1 no hydrogen 2.662 N/A MET 287.A N TYR 284.A O no hydrogen 2.984 N/A ALA 288.A N TYR 284.A O no hydrogen 3.040 N/A ALA 288.A N GLY 285.A O no hydrogen 3.123 N/A ASP 294.A N SER 292.A OG no hydrogen 3.187 N/A VAL 297.A N MET 293.A O no hydrogen 3.049 N/A ARG 298.A N ASP 294.A O no hydrogen 2.902 N/A ARG 298.A NE ASP 294.A OD2 no hydrogen 3.238 N/A ARG 298.A NH2 GLU 152.A OE1 no hydrogen 3.245 N/A ILE 299.A N PRO 295.A O no hydrogen 2.996 N/A VAL 300.A N PHE 296.A O no hydrogen 2.817 N/A GLN 301.A N VAL 297.A O no hydrogen 2.921 N/A GLN 301.A NE2 ASP 283.A OD1 no hydrogen 3.350 N/A GLU 303.A N GLU 303.A OE1 no hydrogen 3.048 N/A SER 304.A N GLN 301.A O no hydrogen 2.785 N/A SER 304.A OG GLU 303.A OE2 no hydrogen 2.896 N/A TYR 305.A OH ASP 294.A OD1 no hydrogen 2.273 N/A