Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3wsw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A OG GLU 30.A OE1 no hydrogen 3.415 N/A ARG 4.A N ASN 29.A OD1 no hydrogen 2.980 N/A ARG 4.A NH1 ASN 247.A OD1 no hydrogen 2.966 N/A ARG 4.A NH2 ASN 247.A OD1 no hydrogen 3.479 N/A LYS 5.A N ASN 73.A OD1 no hydrogen 3.080 N/A LYS 5.A NZ GLU 68.A O no hydrogen 3.202 N/A LYS 5.A NZ GLU 68.A OE2 no hydrogen 2.803 N/A LYS 5.A NZ ASP 71.A OD2 no hydrogen 2.725 N/A VAL 6.A N GLU 30.A O no hydrogen 2.817 N/A VAL 7.A N LEU 74.A O no hydrogen 2.880 N/A ILE 8.A N VAL 32.A O no hydrogen 2.875 N/A VAL 9.A N ILE 76.A O no hydrogen 2.788 N/A GLY 10.A N ILE 34.A O no hydrogen 2.573 N/A THR 11.A N ASP 35.A OD2 no hydrogen 2.662 N/A THR 11.A OG1 ASP 35.A OD2 no hydrogen 2.929 N/A THR 16.A N GLY 12.A O no hydrogen 2.986 N/A THR 16.A OG1 GLY 12.A O no hydrogen 2.889 N/A THR 16.A OG1 PHE 13.A O no hydrogen 3.270 N/A SER 17.A N PHE 13.A O no hydrogen 2.987 N/A SER 17.A OG PHE 13.A O no hydrogen 2.522 N/A ILE 18.A N VAL 14.A O no hydrogen 2.938 N/A ALA 19.A N GLY 15.A O no hydrogen 3.094 N/A TYR 20.A N THR 16.A O no hydrogen 2.913 N/A ALA 21.A N SER 17.A O no hydrogen 2.993 N/A MET 22.A N ILE 18.A O no hydrogen 2.846 N/A ILE 23.A N ALA 19.A O no hydrogen 2.934 N/A ASN 24.A N TYR 20.A O no hydrogen 3.019 N/A ASN 24.A ND2 TYR 20.A O no hydrogen 2.782 N/A GLN 25.A N ALA 21.A O no hydrogen 3.022 N/A GLY 26.A N ILE 23.A O no hydrogen 3.114 N/A VAL 27.A N MET 22.A O no hydrogen 2.961 N/A ASN 29.A N ARG 4.A O no hydrogen 2.744 N/A GLU 30.A N ARG 4.A O no hydrogen 2.850 N/A LEU 31.A N SER 60.A O no hydrogen 2.673 N/A VAL 32.A N VAL 6.A O no hydrogen 2.996 N/A LEU 33.A N TRP 62.A O no hydrogen 2.835 N/A ILE 34.A N ILE 8.A O no hydrogen 3.013 N/A ASN 37.A N ASP 35.A OD1 no hydrogen 2.639 N/A LYS 40.A N ASN 37.A OD1 no hydrogen 3.100 N/A LYS 40.A NZ THR 11.A O no hydrogen 2.815 N/A LYS 40.A NZ GLU 44.A OE2 no hydrogen 2.848 N/A ALA 41.A N ASN 37.A O no hydrogen 3.151 N/A GLU 42.A N GLN 38.A O no hydrogen 3.258 N/A GLY 43.A N GLU 39.A O no hydrogen 2.872 N/A GLU 44.A N LYS 40.A O no hydrogen 2.991 N/A ALA 45.A N ALA 41.A O no hydrogen 3.066 N/A LEU 46.A N GLU 42.A O no hydrogen 2.851 N/A ASP 47.A N GLY 43.A O no hydrogen 3.039 N/A LEU 48.A N GLU 44.A O no hydrogen 2.779 N/A LEU 49.A N ALA 45.A O no hydrogen 2.940 N/A ASP 50.A N LEU 46.A O no hydrogen 3.090 N/A MET 52.A N LEU 49.A O no hydrogen 3.336 N/A TRP 54.A N GLY 51.A O no hydrogen 2.938 N/A GLY 55.A N MET 52.A O no hydrogen 3.102 N/A LYS 57.A NZ GLY 26.A O no hydrogen 2.974 N/A SER 60.A N ASN 29.A O no hydrogen 2.859 N/A TRP 62.A N LEU 31.A O no hydrogen 3.124 N/A TRP 62.A NE1 GLU 68.A OE1 no hydrogen 2.828 N/A SER 63.A OG GLU 42.A OE2 no hydrogen 2.905 N/A GLY 64.A N LEU 33.A O no hydrogen 3.129 N/A GLU 68.A N THR 65.A O no hydrogen 2.886 N/A CYS 69.A N TYR 66.A O no hydrogen 3.021 N/A GLN 70.A N GLU 67.A O no hydrogen 2.988 N/A ALA 72.A N CYS 69.A O no hydrogen 3.120 N/A ASN 73.A N LYS 5.A O no hydrogen 2.828 N/A VAL 75.A N ILE 115.A O no hydrogen 2.955 N/A ILE 76.A N VAL 7.A O no hydrogen 2.686 N/A LEU 77.A N VAL 117.A O no hydrogen 2.917 N/A THR 78.A N VAL 9.A O no hydrogen 3.081 N/A THR 78.A OG1 VAL 9.A O no hydrogen 3.011 N/A VAL 81.A N ASN 96.A OD1 no hydrogen 2.726 N/A LYS 84.A N GLN 87.A OE1 no hydrogen 3.209 N/A GLN 87.A N LYS 84.A O no hydrogen 2.991 N/A THR 88.A N ASP 91.A OD1 no hydrogen 2.953 N/A THR 88.A OG1 ASP 91.A OD1 no hydrogen 3.568 N/A LEU 92.A N THR 88.A O no hydrogen 3.081 N/A LYS 94.A N LEU 90.A O no hydrogen 3.142 N/A THR 95.A N ASP 91.A O no hydrogen 2.946 N/A THR 95.A OG1 ASP 91.A O no hydrogen 2.893 N/A ASN 96.A N LEU 92.A O no hydrogen 2.809 N/A ASN 96.A ND2 VAL 81.A O no hydrogen 3.691 N/A ALA 97.A N VAL 93.A O no hydrogen 2.841 N/A THR 98.A N LYS 94.A O no hydrogen 2.977 N/A THR 98.A OG1 THR 95.A O no hydrogen 2.801 N/A ILE 99.A N THR 95.A O no hydrogen 3.029 N/A THR 100.A N ASN 96.A O no hydrogen 2.905 N/A ARG 101.A N ALA 97.A O no hydrogen 3.145 N/A GLN 102.A N THR 98.A O no hydrogen 2.948 N/A ILE 103.A N ILE 99.A O no hydrogen 3.025 N/A VAL 104.A N THR 100.A O no hydrogen 2.876 N/A LYS 105.A N ARG 101.A O no hydrogen 3.179 N/A GLU 106.A N GLN 102.A O no hydrogen 3.135 N/A VAL 107.A N ILE 103.A O no hydrogen 2.929 N/A MET 108.A N VAL 104.A O no hydrogen 3.027 N/A ALA 109.A N LYS 105.A O no hydrogen 3.027 N/A SER 110.A N GLU 106.A O no hydrogen 3.112 N/A SER 110.A N VAL 107.A O no hydrogen 3.079 N/A SER 110.A OG VAL 107.A O no hydrogen 2.568 N/A GLY 111.A N MET 108.A O no hydrogen 3.146 N/A ILE 115.A N ASN 73.A O no hydrogen 2.910 N/A PHE 116.A N ARG 140.A O no hydrogen 2.983 N/A VAL 117.A N VAL 75.A O no hydrogen 2.972 N/A VAL 118.A N VAL 142.A O no hydrogen 2.838 N/A ALA 119.A N LEU 77.A O no hydrogen 2.859 N/A SER 120.A N LEU 77.A O no hydrogen 3.282 N/A VAL 123.A N ASN 121.A OD1 no hydrogen 2.902 N/A LEU 126.A N PRO 122.A O no hydrogen 2.917 N/A THR 127.A N VAL 123.A O no hydrogen 2.779 N/A THR 127.A OG1 VAL 123.A O no hydrogen 2.618 N/A TYR 128.A N ASP 124.A O no hydrogen 3.155 N/A LEU 129.A N ILE 125.A O no hydrogen 3.086 N/A THR 130.A N LEU 126.A O no hydrogen 2.875 N/A THR 130.A OG1 LEU 126.A O no hydrogen 2.878 N/A TRP 131.A N THR 127.A O no hydrogen 2.947 N/A GLN 132.A N TYR 128.A O no hydrogen 2.934 N/A GLN 132.A NE2 LEU 313.A O no hydrogen 2.752 N/A GLU 133.A N LEU 129.A O no hydrogen 2.813 N/A SER 134.A N THR 130.A O no hydrogen 2.823 N/A SER 134.A OG THR 130.A O no hydrogen 2.590 N/A SER 134.A OG TRP 131.A O no hydrogen 3.078 N/A GLY 135.A N TRP 131.A O no hydrogen 3.054 N/A LEU 136.A N SER 134.A OG no hydrogen 3.172 N/A ARG 140.A N PRO 137.A O no hydrogen 2.845 N/A ARG 140.A NH1 ASP 113.A O no hydrogen 2.582 N/A ARG 140.A NH2 ASP 113.A O no hydrogen 3.382 N/A ARG 140.A NH2 ASP 113.A OD2 no hydrogen 2.533 N/A VAL 141.A N ALA 138.A O no hydrogen 3.091 N/A VAL 142.A N PHE 116.A O no hydrogen 2.765 N/A THR 144.A N VAL 118.A O no hydrogen 3.005 N/A THR 144.A OG1 VAL 118.A O no hydrogen 3.511 N/A THR 146.A N PRO 254.A O no hydrogen 2.920 N/A THR 146.A OG1 ILE 172.A O no hydrogen 2.610 N/A THR 146.A OG1 PRO 254.A O no hydrogen 3.541 N/A THR 147.A N THR 144.A O no hydrogen 2.974 N/A THR 147.A OG1 THR 144.A O no hydrogen 2.833 N/A THR 150.A N THR 146.A O no hydrogen 2.738 N/A THR 150.A OG1 THR 146.A O no hydrogen 2.628 N/A THR 151.A N THR 147.A O no hydrogen 2.995 N/A ARG 152.A N LEU 148.A O no hydrogen 2.992 N/A PHE 153.A N ASP 149.A O no hydrogen 2.852 N/A ARG 154.A N THR 150.A O no hydrogen 2.921 N/A ARG 154.A NE GLY 170.A O no hydrogen 3.307 N/A ARG 154.A NH2 GLY 170.A O no hydrogen 3.255 N/A LYS 155.A N THR 151.A O no hydrogen 2.958 N/A GLU 156.A N ARG 152.A O no hydrogen 2.887 N/A ILE 157.A N PHE 153.A O no hydrogen 3.052 N/A ALA 158.A N ARG 154.A O no hydrogen 2.848 N/A LEU 159.A N LYS 155.A O no hydrogen 2.779 N/A LYS 160.A N GLU 156.A O no hydrogen 2.922 N/A LEU 161.A N ILE 157.A O no hydrogen 2.861 N/A VAL 163.A N ALA 158.A O no hydrogen 3.107 N/A ARG 166.A N ASP 164.A OD2 no hydrogen 2.974 N/A ARG 166.A NE ASP 164.A OD1 no hydrogen 3.149 N/A ARG 166.A NE ASP 164.A OD2 no hydrogen 3.171 N/A ARG 166.A NH2 ASP 164.A OD1 no hydrogen 2.788 N/A SER 167.A N ASP 164.A O no hydrogen 2.791 N/A VAL 168.A N PRO 165.A O no hydrogen 2.984 N/A HIS 169.A N THR 188.A O no hydrogen 2.780 N/A ILE 172.A N THR 150.A OG1 no hydrogen 3.372 N/A LEU 173.A N VAL 181.A O no hydrogen 2.769 N/A GLY 174.A N GLY 271.A O no hydrogen 2.872 N/A GLU 175.A N SER 300.A OG no hydrogen 3.027 N/A HIS 176.A ND1 ASP 149.A OD2 no hydrogen 2.484 N/A GLY 177.A N GLU 180.A OE1 no hydrogen 3.324 N/A SER 179.A OG GLU 303.A OE1 no hydrogen 3.080 N/A GLU 180.A N GLY 177.A O no hydrogen 3.043 N/A VAL 181.A N LEU 173.A O no hydrogen 2.881 N/A ALA 183.A N TYR 171.A O no hydrogen 3.164 N/A TRP 184.A N ALA 182.A O no hydrogen 2.687 N/A SER 185.A N GLU 293.A OE2 no hydrogen 2.953 N/A SER 185.A OG HIS 186.A ND1 no hydrogen 2.618 N/A SER 185.A OG GLU 293.A OE1 no hydrogen 2.472 N/A SER 185.A OG GLU 293.A OE2 no hydrogen 3.484 N/A HIS 186.A N ALA 183.A O no hydrogen 3.047 N/A HIS 186.A ND1 SER 185.A OG no hydrogen 2.618 N/A THR 187.A OG1 ALA 183.A O no hydrogen 3.049 N/A THR 188.A N HIS 169.A O no hydrogen 2.919 N/A VAL 189.A N LYS 192.A O no hydrogen 2.979 N/A LYS 192.A N VAL 189.A O no hydrogen 3.016 N/A LYS 192.A NZ GLU 196.A OE2 no hydrogen 2.374 N/A LYS 192.A NZ ASP 201.A OD1 no hydrogen 3.175 N/A ILE 194.A N THR 187.A O no hydrogen 2.935 N/A GLU 196.A N PRO 193.A O no hydrogen 2.875 N/A TYR 197.A N PRO 193.A O no hydrogen 3.063 N/A TYR 197.A OH VAL 189.A O no hydrogen 3.162 N/A VAL 198.A N ILE 194.A O no hydrogen 2.818 N/A GLU 199.A N MET 195.A O no hydrogen 2.774 N/A LYS 200.A N GLU 196.A O no hydrogen 2.978 N/A ASP 201.A N GLU 196.A O no hydrogen 2.977 N/A HIS 202.A N VAL 198.A O no hydrogen 3.022 N/A ARG 203.A N TYR 197.A O no hydrogen 3.025 N/A GLU 205.A N ASP 208.A OD2 no hydrogen 2.836 N/A ASP 208.A N GLU 205.A O no hydrogen 2.652 N/A THR 210.A N GLU 206.A O no hydrogen 3.290 N/A THR 210.A OG1 GLU 206.A OE1 no hydrogen 3.286 N/A VAL 211.A N ASN 207.A O no hydrogen 3.024 N/A LEU 212.A N ASP 208.A O no hydrogen 2.891 N/A ALA 213.A N LEU 209.A O no hydrogen 3.169 N/A ASP 214.A N THR 210.A O no hydrogen 3.086 N/A LYS 215.A N VAL 211.A O no hydrogen 3.068 N/A VAL 216.A N LEU 212.A O no hydrogen 3.204 N/A LYS 217.A N ALA 213.A O no hydrogen 3.155 N/A LYS 217.A NZ ASP 178.A O no hydrogen 3.518 N/A ASN 218.A N ASP 214.A O no hydrogen 2.707 N/A ALA 219.A N VAL 216.A O no hydrogen 3.300 N/A GLU 222.A N ASN 218.A O no hydrogen 2.943 N/A ILE 223.A N ALA 219.A O no hydrogen 2.930 N/A ILE 224.A N ALA 220.A O no hydrogen 2.808 N/A ASP 225.A N TYR 221.A O no hydrogen 3.042 N/A ARG 226.A N ILE 223.A O no hydrogen 2.830 N/A ARG 226.A NH1 GLU 222.A O no hydrogen 2.596 N/A ARG 226.A NH1 GLU 222.A OE2 no hydrogen 3.090 N/A ARG 226.A NH2 GLU 222.A OE2 no hydrogen 3.523 N/A LYS 227.A N ILE 223.A O no hydrogen 2.837 N/A ALA 229.A N LYS 227.A O no hydrogen 2.684 N/A GLY 235.A N TYR 231.A O no hydrogen 2.812 N/A MET 236.A N TYR 232.A O no hydrogen 2.991 N/A SER 237.A N GLY 233.A O no hydrogen 3.161 N/A SER 237.A OG GLY 233.A O no hydrogen 3.103 N/A THR 238.A N ILE 234.A O no hydrogen 2.944 N/A THR 238.A OG1 ILE 234.A O no hydrogen 2.944 N/A THR 239.A N GLY 235.A O no hydrogen 3.185 N/A THR 239.A OG1 GLY 235.A O no hydrogen 2.885 N/A ARG 240.A N MET 236.A O no hydrogen 3.177 N/A ARG 240.A NH1 ARG 240.A O no hydrogen 2.996 N/A ARG 240.A NH1 GLU 249.A OE2 no hydrogen 2.878 N/A ARG 240.A NH2 GLU 249.A OE2 no hydrogen 2.784 N/A ILE 241.A N SER 237.A O no hydrogen 3.134 N/A VAL 242.A N THR 238.A O no hydrogen 2.908 N/A LYS 243.A N THR 239.A O no hydrogen 2.764 N/A LYS 243.A NZ GLN 25.A OE1 no hydrogen 3.221 N/A ALA 244.A N ARG 240.A O no hydrogen 3.075 N/A ILE 245.A N ILE 241.A O no hydrogen 3.224 N/A LEU 246.A N VAL 242.A O no hydrogen 3.094 N/A ASN 247.A N LYS 243.A O no hydrogen 3.250 N/A ASN 247.A ND2 LYS 243.A O no hydrogen 2.824 N/A ASN 248.A N ILE 245.A O no hydrogen 3.104 N/A GLU 249.A N ALA 244.A O no hydrogen 3.037 N/A ALA 251.A N VAL 276.A O no hydrogen 3.213 N/A LEU 253.A N SER 274.A O no hydrogen 2.970 N/A VAL 255.A N LEU 253.A O no hydrogen 2.905 N/A SER 256.A N GLY 143.A O no hydrogen 2.603 N/A SER 256.A OG ASP 124.A OD1 no hydrogen 2.803 N/A ALA 257.A N THR 270.A O no hydrogen 3.175 N/A TYR 258.A OH ASP 267.A OD2 no hydrogen 3.107 N/A LEU 259.A N ILE 268.A O no hydrogen 3.067 N/A ASN 260.A N GLU 262.A OE1 no hydrogen 2.626 N/A GLY 261.A N GLU 265.A O no hydrogen 2.671 N/A GLU 262.A N GLU 262.A OE1 no hydrogen 2.743 N/A TYR 263.A N ASP 286.A OD1 no hydrogen 2.973 N/A TYR 263.A N ASP 286.A OD2 no hydrogen 3.378 N/A TYR 263.A OH ILE 285.A O no hydrogen 2.673 N/A GLY 264.A N GLY 261.A O no hydrogen 2.886 N/A GLU 265.A N GLU 262.A O no hydrogen 3.132 N/A ASP 267.A N LEU 259.A O no hydrogen 2.977 N/A THR 270.A N ALA 257.A O no hydrogen 3.236 N/A THR 270.A OG1 ASP 124.A OD2 no hydrogen 3.325 N/A GLY 271.A N GLY 174.A O no hydrogen 3.176 N/A VAL 272.A N VAL 255.A O no hydrogen 3.285 N/A SER 274.A N LEU 253.A O no hydrogen 2.913 N/A SER 274.A OG VAL 272.A O no hydrogen 2.833 N/A ILE 275.A N GLU 283.A O no hydrogen 2.916 N/A VAL 276.A N ALA 251.A O no hydrogen 2.802 N/A ASP 277.A N GLY 280.A O no hydrogen 2.831 N/A GLU 278.A N ASN 248.A OD1 no hydrogen 2.806 N/A ASN 279.A N ASP 277.A OD1 no hydrogen 2.824 N/A GLY 280.A N ASP 277.A O no hydrogen 3.058 N/A VAL 281.A N SER 139.A O no hydrogen 3.000 N/A ARG 282.A N ILE 275.A O no hydrogen 2.774 N/A ARG 282.A NE GLU 283.A OE2 no hydrogen 3.118 N/A ARG 282.A NH2 GLU 283.A OE2 no hydrogen 2.910 N/A ILE 285.A N PRO 273.A O no hydrogen 2.904 N/A LEU 287.A N TYR 263.A OH no hydrogen 2.963 N/A THR 290.A N GLU 293.A OE1 no hydrogen 3.036 N/A GLU 293.A N THR 290.A OG1 no hydrogen 3.049 N/A LYS 294.A N THR 290.A O no hydrogen 2.849 N/A ALA 295.A N PRO 291.A O no hydrogen 2.855 N/A MET 296.A N GLN 292.A O no hydrogen 3.266 N/A PHE 297.A N GLU 293.A O no hydrogen 3.007 N/A HIS 298.A N LYS 294.A O no hydrogen 2.933 N/A HIS 298.A ND1 GLU 265.A OE2 no hydrogen 2.930 N/A GLN 299.A N ALA 295.A O no hydrogen 3.073 N/A GLN 299.A NE2 GLU 303.A OE2 no hydrogen 3.088 N/A SER 300.A N MET 296.A O no hydrogen 2.927 N/A VAL 301.A N PHE 297.A O no hydrogen 2.861 N/A SER 302.A N HIS 298.A O no hydrogen 2.901 N/A SER 302.A OG HIS 298.A O no hydrogen 2.850 N/A GLU 303.A N GLN 299.A O no hydrogen 3.181 N/A LEU 304.A N SER 300.A O no hydrogen 3.130 N/A LYS 305.A N VAL 301.A O no hydrogen 2.987 N/A LYS 305.A NZ GLU 266.A O no hydrogen 3.097 N/A ALA 306.A N SER 302.A O no hydrogen 3.142 N/A VAL 307.A N GLU 303.A O no hydrogen 3.317 N/A LEU 308.A N LEU 304.A O no hydrogen 2.863 N/A ASP 309.A N LYS 305.A O no hydrogen 2.876 N/A THR 310.A N VAL 307.A O no hydrogen 2.991 N/A THR 310.A OG1 VAL 307.A O no hydrogen 2.760 N/A VAL 311.A N LEU 308.A O no hydrogen 3.089 N/A ARG 312.A N LEU 308.A O no hydrogen 2.722 N/A ARG 312.A NH2 TYR 128.A OH no hydrogen 3.043 N/A LEU 313.A N GLN 132.A OE1 no hydrogen 2.725 N/A