Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4wvl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 4.A N TYR 17.A O no hydrogen 2.706 N/A LEU 6.A N ALA 15.A O no hydrogen 2.802 N/A LYS 7.A N ASN 71.A OD1 no hydrogen 2.843 N/A LYS 7.A NZ ASP 75.A OD1 no hydrogen 2.719 N/A LYS 7.A NZ ASP 75.A OD2 no hydrogen 3.452 N/A SER 8.A OG TRP 192.A O no hydrogen 2.770 N/A VAL 10.A N SER 8.A OG no hydrogen 3.085 N/A GLY 11.A N SER 8.A O no hydrogen 3.291 N/A ALA 12.A N SER 8.A OG no hydrogen 3.128 N/A ALA 15.A N LEU 6.A O no hydrogen 2.778 N/A TYR 17.A N LEU 4.A O no hydrogen 2.704 N/A TYR 17.A OH GLU 33.A OE2 no hydrogen 2.715 N/A TRP 19.A N LEU 2.A O no hydrogen 2.996 N/A TYR 24.A N HIS 28.A O no hydrogen 2.859 N/A TYR 24.A OH GLU 33.A OE1 no hydrogen 3.284 N/A ASP 25.A N HIS 28.A O no hydrogen 3.091 N/A HIS 27.A N ASP 25.A OD1 no hydrogen 2.871 N/A HIS 28.A N ASP 25.A O no hydrogen 3.316 N/A HIS 28.A ND1 ASP 25.A OD1 no hydrogen 3.056 N/A ALA 30.A N PRO 22.A O no hydrogen 2.881 N/A HIS 32.A N ASP 29.A OD1 no hydrogen 3.022 N/A HIS 32.A ND1 ASP 29.A OD1 no hydrogen 2.705 N/A GLU 33.A N ASP 29.A O no hydrogen 3.171 N/A ILE 34.A N ALA 30.A O no hydrogen 2.834 N/A ILE 35.A N ALA 31.A O no hydrogen 3.143 N/A GLU 36.A N HIS 32.A O no hydrogen 2.811 N/A THR 37.A N GLU 33.A O no hydrogen 2.831 N/A THR 37.A OG1 GLU 33.A O no hydrogen 2.643 N/A THR 37.A OG1 HIS 101.A NE2 no hydrogen 2.954 N/A ILE 38.A N ILE 34.A O no hydrogen 2.993 N/A ARG 39.A N ILE 35.A O no hydrogen 3.098 N/A TRP 40.A N GLU 36.A O no hydrogen 2.920 N/A VAL 41.A N THR 37.A O no hydrogen 2.953 N/A CYS 42.A N ILE 38.A O no hydrogen 3.117 N/A CYS 42.A SG ILE 38.A O no hydrogen 3.337 N/A GLU 43.A N ARG 39.A O no hydrogen 3.285 N/A GLU 44.A N TRP 40.A O no hydrogen 2.998 N/A ILE 45.A N VAL 41.A O no hydrogen 2.981 N/A LYS 49.A N ILE 45.A O no hydrogen 3.041 N/A LYS 49.A NZ GLU 43.A OE1 no hydrogen 3.298 N/A LYS 49.A NZ GLU 43.A OE2 no hydrogen 3.038 N/A LEU 50.A N PRO 46.A O no hydrogen 2.786 N/A ALA 51.A N ASP 47.A O no hydrogen 3.022 N/A ALA 51.A N LEU 48.A O no hydrogen 3.148 N/A MET 52.A N LEU 48.A O no hydrogen 2.889 N/A GLU 53.A N LYS 49.A O no hydrogen 3.369 N/A ASP 56.A N SER 62.A OG no hydrogen 3.241 N/A LYS 58.A N ASP 56.A OD1 no hydrogen 2.902 N/A SER 59.A N ASP 56.A O no hydrogen 3.422 N/A SER 62.A N SER 59.A OG no hydrogen 3.223 N/A SER 62.A OG ASP 56.A O no hydrogen 3.343 N/A MET 63.A N SER 59.A O no hydrogen 3.036 N/A GLN 64.A N PHE 60.A O no hydrogen 2.771 N/A ARG 65.A N GLU 61.A O no hydrogen 3.027 N/A LEU 66.A N SER 62.A O no hydrogen 3.220 N/A CYS 67.A N MET 63.A O no hydrogen 2.987 N/A CYS 67.A SG MET 63.A O no hydrogen 3.400 N/A ASP 68.A N GLN 64.A O no hydrogen 2.830 N/A LYS 69.A N ARG 65.A O no hydrogen 3.027 N/A TYR 70.A N LEU 66.A O no hydrogen 3.070 N/A TYR 70.A OH LYS 7.A O no hydrogen 2.768 N/A ASN 71.A N CYS 67.A O no hydrogen 2.801 N/A ASN 71.A ND2 ARG 5.A O no hydrogen 2.866 N/A ARG 72.A N ASP 68.A O no hydrogen 2.896 N/A ALA 73.A N LYS 69.A O no hydrogen 3.070 N/A ILE 74.A N TYR 70.A O no hydrogen 2.864 N/A ASP 75.A N ASN 71.A O no hydrogen 3.003 N/A SER 76.A N ARG 72.A O no hydrogen 3.105 N/A SER 76.A OG ALA 73.A O no hydrogen 2.687 N/A ILE 77.A N ALA 73.A O no hydrogen 2.948 N/A HIS 78.A N ILE 74.A O no hydrogen 2.928 N/A HIS 78.A NE2 PRO 9.A O no hydrogen 2.979 N/A GLN 79.A N ASP 75.A O no hydrogen 3.005 N/A LEU 80.A N SER 76.A O no hydrogen 2.853 N/A TRP 81.A N ILE 77.A O no hydrogen 2.974 N/A LYS 82.A N HIS 78.A O no hydrogen 3.133 N/A GLY 83.A N GLN 79.A O no hydrogen 3.229 N/A GLY 83.A N LEU 80.A O no hydrogen 3.254 N/A LYS 89.A NZ GLU 44.A O no hydrogen 3.550 N/A ARG 93.A NH1 ALA 159.A O no hydrogen 2.954 N/A ARG 93.A NH1 THR 161.A O no hydrogen 2.682 N/A ARG 93.A NH2 THR 161.A O no hydrogen 2.952 N/A LEU 98.A N SER 95.A OG no hydrogen 3.232 N/A LEU 99.A N SER 95.A O no hydrogen 2.765 N/A ARG 100.A N THR 96.A O no hydrogen 2.983 N/A HIS 101.A N GLY 97.A O no hydrogen 3.391 N/A HIS 101.A NE2 THR 37.A OG1 no hydrogen 2.954 N/A ILE 102.A N LEU 98.A O no hydrogen 2.883 N/A LEU 103.A N LEU 99.A O no hydrogen 2.947 N/A GLN 104.A N ARG 100.A O no hydrogen 3.045 N/A GLN 104.A NE2 ASN 108.A OD1 no hydrogen 2.990 N/A GLN 105.A N HIS 101.A O no hydrogen 2.828 N/A GLN 105.A NE2 TYR 17.A OH no hydrogen 3.506 N/A GLN 105.A NE2 GLU 33.A OE2 no hydrogen 3.103 N/A VAL 106.A N ILE 102.A O no hydrogen 2.703 N/A TYR 107.A N LEU 103.A O no hydrogen 2.810 N/A ASN 108.A N GLN 104.A O no hydrogen 2.862 N/A ASN 108.A ND2 GLU 33.A OE1 no hydrogen 3.100 N/A HIS 109.A N GLN 105.A O no hydrogen 3.209 N/A HIS 109.A N VAL 106.A O no hydrogen 3.295 N/A HIS 109.A NE2 GLU 33.A OE2 no hydrogen 2.739 N/A SER 110.A N TYR 107.A O no hydrogen 3.191 N/A SER 110.A OG VAL 106.A O no hydrogen 2.903 N/A VAL 111.A N TYR 107.A O no hydrogen 2.991 N/A GLU 115.A N ASP 113.A OD1 no hydrogen 3.135 N/A LYS 116.A N ASP 113.A O no hydrogen 3.440 N/A PHE 125.A N GLU 122.A O no hydrogen 3.263 N/A VAL 128.A N SER 124.A O no hydrogen 2.923 N/A ALA 129.A N PHE 125.A O no hydrogen 2.819 N/A GLN 130.A N ASP 126.A O no hydrogen 2.957 N/A GLN 130.A NE2 GLU 134.A OE2 no hydrogen 2.892 N/A GLN 130.A NE2 SER 281.A O no hydrogen 2.520 N/A MET 131.A N LEU 127.A O no hydrogen 3.122 N/A ILE 132.A N VAL 128.A O no hydrogen 2.841 N/A ASP 133.A N ALA 129.A O no hydrogen 3.080 N/A GLU 134.A N GLN 130.A O no hydrogen 3.113 N/A GLU 134.A N MET 131.A O no hydrogen 3.171 N/A ILE 135.A N MET 131.A O no hydrogen 2.797 N/A THR 138.A N ASP 141.A OD2 no hydrogen 2.809 N/A ASP 141.A N THR 138.A O no hydrogen 3.065 N/A LEU 142.A N SER 220.A OG no hydrogen 2.854 N/A PHE 143.A N HIS 165.A O no hydrogen 2.994 N/A VAL 144.A N VAL 221.A O no hydrogen 2.980 N/A ASP 145.A N TYR 167.A O no hydrogen 2.886 N/A LEU 146.A N PHE 223.A O no hydrogen 3.022 N/A GLY 147.A N VAL 169.A O no hydrogen 3.043 N/A SER 148.A N VAL 169.A O no hydrogen 3.020 N/A GLY 149.A N GLU 170.A OE1 no hydrogen 2.814 N/A GLY 151.A N SER 148.A O no hydrogen 2.878 N/A GLN 152.A N GLN 152.A OE1 no hydrogen 2.565 N/A LEU 155.A N GLY 151.A O no hydrogen 3.017 N/A GLN 156.A N GLN 152.A O no hydrogen 2.973 N/A GLN 156.A NE2 PHE 125.A O no hydrogen 2.996 N/A VAL 157.A N VAL 153.A O no hydrogen 3.036 N/A ALA 158.A N VAL 154.A O no hydrogen 2.841 N/A ALA 159.A N LEU 155.A O no hydrogen 2.944 N/A ALA 160.A N VAL 157.A O no hydrogen 3.039 N/A THR 161.A N VAL 157.A O no hydrogen 2.844 N/A THR 161.A OG1 VAL 157.A O no hydrogen 3.376 N/A THR 161.A OG1 HIS 166.A NE2 no hydrogen 2.813 N/A CYS 163.A N THR 161.A OG1 no hydrogen 3.310 N/A CYS 163.A SG THR 161.A OG1 no hydrogen 3.541 N/A LYS 164.A N ASP 141.A O no hydrogen 2.930 N/A HIS 165.A NE2 THR 201.A OG1 no hydrogen 2.705 N/A HIS 166.A N GLU 199.A O no hydrogen 3.006 N/A HIS 166.A ND1 GLU 199.A O no hydrogen 2.960 N/A HIS 166.A NE2 THR 161.A OG1 no hydrogen 2.813 N/A TYR 167.A N PHE 143.A O no hydrogen 2.721 N/A GLY 168.A N THR 201.A O no hydrogen 2.968 N/A VAL 169.A N ASP 145.A O no hydrogen 3.497 N/A GLU 170.A N GLU 203.A O no hydrogen 3.070 N/A LYS 171.A NZ ASP 206.A OD2 no hydrogen 2.883 N/A ALA 172.A N GLU 170.A OE2 no hydrogen 2.868 N/A ALA 176.A N ALA 172.A O no hydrogen 3.327 N/A LYS 177.A N ASP 173.A O no hydrogen 2.867 N/A TYR 178.A N ILE 174.A O no hydrogen 3.057 N/A ALA 179.A N PRO 175.A O no hydrogen 2.883 N/A GLU 180.A N LYS 177.A O no hydrogen 3.117 N/A MET 182.A N TYR 178.A O no hydrogen 2.811 N/A ASP 183.A N ALA 179.A O no hydrogen 2.916 N/A ARG 184.A N GLU 180.A O no hydrogen 3.254 N/A GLU 185.A N THR 181.A O no hydrogen 2.857 N/A PHE 186.A N MET 182.A O no hydrogen 2.869 N/A ARG 187.A N ASP 183.A O no hydrogen 3.177 N/A ARG 187.A NE ASP 183.A OD1 no hydrogen 2.771 N/A ARG 187.A NH2 TYR 200.A O no hydrogen 3.337 N/A LYS 188.A N ARG 184.A O no hydrogen 3.188 N/A LYS 188.A NZ GLU 185.A OE1 no hydrogen 3.246 N/A LYS 188.A NZ GLU 185.A OE2 no hydrogen 3.342 N/A TRP 189.A N GLU 185.A O no hydrogen 2.862 N/A MET 190.A N PHE 186.A O no hydrogen 2.877 N/A LYS 191.A N ARG 187.A O no hydrogen 3.183 N/A TRP 192.A N LYS 188.A O no hydrogen 3.012 N/A TYR 193.A N TRP 189.A O no hydrogen 3.065 N/A TYR 193.A OH GLN 105.A OE1 no hydrogen 2.875 N/A GLY 194.A N LYS 191.A O no hydrogen 2.982 N/A LYS 195.A N MET 190.A O no hydrogen 2.774 N/A LYS 195.A NZ THR 92.A OG1 no hydrogen 2.838 N/A LYS 195.A NZ ARG 93.A O no hydrogen 3.450 N/A LYS 196.A N THR 92.A O no hydrogen 2.941 N/A HIS 197.A ND1 ALA 198.A O no hydrogen 2.748 N/A ALA 198.A N ALA 158.A O no hydrogen 2.805 N/A TYR 200.A OH ASP 183.A OD1 no hydrogen 2.480 N/A THR 201.A N HIS 166.A O no hydrogen 2.810 N/A THR 201.A OG1 HIS 165.A NE2 no hydrogen 2.705 N/A GLU 203.A N GLY 168.A O no hydrogen 2.683 N/A GLY 205.A N GLU 170.A O no hydrogen 2.713 N/A LEU 208.A N ASP 206.A OD1 no hydrogen 2.800 N/A SER 209.A N ASP 206.A O no hydrogen 2.968 N/A SER 209.A OG ASP 206.A O no hydrogen 3.081 N/A TRP 212.A N SER 209.A O no hydrogen 3.206 N/A TRP 212.A N SER 209.A OG no hydrogen 3.321 N/A ARG 213.A N GLU 210.A O no hydrogen 3.273 N/A ARG 215.A NH1 GLU 203.A OE1 no hydrogen 3.488 N/A ARG 215.A NH1 GLU 203.A OE2 no hydrogen 2.977 N/A ARG 215.A NH2 GLU 203.A OE1 no hydrogen 2.733 N/A ARG 215.A NH2 GLU 211.A OE2 no hydrogen 3.115 N/A ILE 216.A N TRP 212.A O no hydrogen 2.841 N/A ALA 217.A N ARG 213.A O no hydrogen 3.143 N/A ASN 218.A N GLU 214.A O no hydrogen 3.045 N/A ASN 218.A N ARG 215.A O no hydrogen 3.270 N/A THR 219.A N ILE 216.A O no hydrogen 3.004 N/A THR 219.A OG1 ARG 215.A O no hydrogen 2.634 N/A SER 220.A N LEU 142.A O no hydrogen 3.227 N/A SER 220.A OG ASP 141.A OD1 no hydrogen 2.788 N/A SER 220.A OG LEU 142.A O no hydrogen 3.322 N/A VAL 221.A N LEU 142.A O no hydrogen 2.990 N/A ILE 222.A N ARG 249.A O no hydrogen 2.867 N/A PHE 223.A N VAL 144.A O no hydrogen 2.929 N/A VAL 224.A N VAL 251.A O no hydrogen 2.992 N/A ASN 226.A ND2 ASP 234.A OD1 no hydrogen 3.297 N/A ASN 226.A ND2 LYS 254.A O no hydrogen 3.032 N/A PHE 227.A N SER 253.A OG no hydrogen 3.209 N/A PHE 229.A N ASN 226.A O no hydrogen 2.871 N/A ASP 234.A N GLY 230.A O no hydrogen 3.176 N/A HIS 235.A N PRO 231.A O no hydrogen 3.014 N/A GLN 236.A N GLU 232.A O no hydrogen 3.007 N/A GLN 236.A NE2 GLU 232.A OE2 no hydrogen 3.464 N/A LEU 237.A N VAL 233.A O no hydrogen 2.984 N/A LYS 238.A N ASP 234.A O no hydrogen 2.976 N/A GLU 239.A N HIS 235.A O no hydrogen 3.107 N/A ARG 240.A N GLN 236.A O no hydrogen 3.114 N/A ARG 240.A NH1 GLN 236.A OE1 no hydrogen 2.721 N/A ARG 240.A NH2 LEU 208.A O no hydrogen 2.866 N/A ARG 240.A NH2 GLN 236.A OE1 no hydrogen 3.249 N/A PHE 241.A N LEU 237.A O no hydrogen 2.836 N/A ALA 242.A N LYS 238.A O no hydrogen 3.149 N/A ASN 243.A N ARG 240.A O no hydrogen 3.214 N/A MET 244.A N PHE 241.A O no hydrogen 2.979 N/A GLY 247.A N ILE 301.A O no hydrogen 2.945 N/A GLY 248.A N LYS 245.A O no hydrogen 2.926 N/A ARG 249.A N SER 220.A O no hydrogen 2.826 N/A ARG 249.A NH1 LYS 136.A O no hydrogen 2.886 N/A ARG 249.A NH2 LYS 136.A O no hydrogen 2.800 N/A ILE 250.A N HIS 299.A O no hydrogen 2.841 N/A VAL 251.A N ILE 222.A O no hydrogen 2.767 N/A SER 252.A N TYR 297.A O no hydrogen 2.960 N/A SER 252.A OG LYS 254.A O no hydrogen 2.729 N/A SER 253.A OG ASN 225.A OD1 no hydrogen 2.667 N/A LYS 254.A NZ ASN 226.A O no hydrogen 3.134 N/A LYS 254.A NZ PHE 227.A O no hydrogen 3.016 N/A LYS 254.A NZ ASP 234.A OD2 no hydrogen 2.934 N/A PHE 256.A N HIS 299.A NE2 no hydrogen 2.919 N/A ASN 260.A N ASN 260.A OD1 no hydrogen 2.503 N/A ASN 264.A N ASN 267.A OD1 no hydrogen 2.710 N/A ARG 266.A N ASN 264.A OD1 no hydrogen 3.069 N/A ASN 267.A N ASN 264.A O no hydrogen 3.100 N/A ASN 267.A ND2 ARG 262.A O no hydrogen 3.014 N/A ASP 270.A N ASN 267.A O no hydrogen 3.050 N/A THR 273.A N ASP 270.A O no hydrogen 3.051 N/A THR 273.A OG1 ASP 270.A O no hydrogen 2.686 N/A ILE 274.A N ILE 271.A O no hydrogen 3.082 N/A ARG 276.A N THR 300.A O no hydrogen 2.905 N/A ARG 276.A NH2 ASP 302.A OD2 no hydrogen 3.104 N/A VAL 278.A N LEU 298.A O no hydrogen 3.007 N/A LEU 280.A N TYR 296.A O no hydrogen 2.876 N/A SER 286.A OG LEU 283.A O no hydrogen 2.619 N/A SER 288.A N LYS 292.A O no hydrogen 2.786 N/A SER 288.A OG LYS 292.A O no hydrogen 3.475 N/A THR 290.A OG1 SER 288.A OG no hydrogen 3.198 N/A GLY 291.A N SER 288.A O no hydrogen 2.885 N/A SER 295.A OG TYR 297.A OH no hydrogen 2.934 N/A TYR 296.A OH GLN 130.A OE1 no hydrogen 2.977 N/A TYR 297.A N SER 252.A O no hydrogen 2.825 N/A TYR 297.A OH SER 295.A OG no hydrogen 2.934 N/A LEU 298.A N VAL 278.A O no hydrogen 2.888 N/A HIS 299.A N ILE 250.A O no hydrogen 2.716 N/A HIS 299.A ND1 ILE 250.A O no hydrogen 2.935 N/A THR 300.A N ARG 276.A O no hydrogen 2.850 N/A ILE 301.A N GLY 248.A O no hydrogen 2.822 N/A ASP 302.A N ILE 274.A O no hydrogen 2.720 N/A ARG 303.A N GLU 246.A OE1 no hydrogen 3.131 N/A ARG 303.A N GLU 246.A OE2 no hydrogen 3.131 N/A ARG 303.A NH1 MET 244.A O no hydrogen 3.059 N/A ARG 303.A NH2 ALA 242.A O no hydrogen 2.920 N/A ARG 303.A NH2 MET 244.A O no hydrogen 2.845 N/A THR 304.A N ASP 302.A OD1 no hydrogen 3.222 N/A THR 304.A OG1 ASP 302.A OD1 no hydrogen 2.590 N/A THR 304.A OG1 ASP 302.A OD2 no hydrogen 3.327 N/A ILE 305.A N ASP 302.A O no hydrogen 3.465 N/A GLU 307.A N ARG 303.A O no hydrogen 3.129 N/A ASN 308.A N THR 304.A O no hydrogen 2.922 N/A TYR 309.A N ILE 305.A O no hydrogen 3.262 N/A PHE 310.A N LEU 306.A O no hydrogen 3.099 N/A SER 311.A N GLU 307.A O no hydrogen 3.012 N/A SER 312.A N ASN 308.A O no hydrogen 3.004 N/A SER 312.A OG TYR 309.A O no hydrogen 2.600 N/A LEU 313.A N TYR 309.A O no hydrogen 3.168 N/A LYS 314.A N SER 311.A O no hydrogen 3.050 N/A ASN 315.A N SER 312.A O no hydrogen 3.109 N/A LYS 317.A N ASN 315.A OD1 no hydrogen 2.860 N/A LEU 318.A N ASN 315.A OD1 no hydrogen 3.334 N/A ARG 319.A N ASN 315.A O no hydrogen 2.799 N/A ARG 319.A NE LEU 313.A O no hydrogen 2.781 N/A GLU 320.A N PRO 316.A O no hydrogen 3.052 N/A GLU 321.A N LYS 317.A O no hydrogen 3.204 N/A GLN 322.A N LEU 318.A O no hydrogen 2.922 N/A GLN 322.A NE2 SER 312.A OG no hydrogen 2.818 N/A GLU 323.A N ARG 319.A O no hydrogen 3.044 N/A ALA 324.A N GLU 320.A O no hydrogen 2.941 N/A ALA 325.A N GLU 321.A O no hydrogen 3.005 N/A ARG 326.A N GLN 322.A O no hydrogen 3.088 N/A ARG 327.A N GLU 323.A O no hydrogen 3.412 N/A ARG 328.A N ALA 324.A O no hydrogen 3.220 N/A GLN 329.A N ALA 325.A O no hydrogen 2.839 N/A GLN 330.A N ARG 326.A O no hydrogen 3.183 N/A ARG 331.A N GLN 329.A O no hydrogen 2.623 N/A