Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7a7g_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 4.A N SER 3.A OG no hydrogen 2.737 N/A CYS 4.A SG ARG 47.A O no hydrogen 3.414 N/A SER 7.A N ASN 5.A OD1 no hydrogen 3.347 N/A ASP 8.A N ASN 5.A O no hydrogen 2.958 N/A MET 9.A N PRO 6.A O no hydrogen 3.184 N/A HIS 11.A ND1 HIS 23.A NE2 no hydrogen 2.643 N/A HIS 11.A NE2 PRO 6.A O no hydrogen 3.067 N/A GLY 12.A N PHE 24.A O no hydrogen 2.710 N/A TYR 13.A OH GLU 70.A OE1 no hydrogen 2.232 N/A VAL 14.A N LEU 22.A O no hydrogen 2.947 N/A VAL 16.A N VAL 20.A O no hydrogen 2.936 N/A LYS 17.A NZ GLU 79.A OE1 no hydrogen 3.040 N/A LYS 17.A NZ GLU 79.A OE2 no hydrogen 3.547 N/A LYS 17.A NZ GLU 88.A OE1 no hydrogen 2.745 N/A VAL 20.A N LYS 17.A O no hydrogen 2.879 N/A ARG 21.A N SER 72.A OG no hydrogen 2.971 N/A ARG 21.A NH2 GLU 70.A O no hydrogen 2.220 N/A LEU 22.A N VAL 14.A O no hydrogen 2.634 N/A HIS 23.A N SER 71.A OG no hydrogen 2.869 N/A HIS 23.A ND1 ASP 64.A OD2 no hydrogen 2.676 N/A HIS 23.A NE2 HIS 11.A ND1 no hydrogen 2.643 N/A PHE 24.A N GLY 12.A O no hydrogen 2.828 N/A VAL 25.A N ALA 62.A O no hydrogen 2.821 N/A GLU 26.A N SER 10.A O no hydrogen 3.102 N/A LEU 27.A N VAL 60.A O no hydrogen 3.029 N/A VAL 33.A N ARG 59.A O no hydrogen 2.720 N/A CYS 34.A N VAL 102.A O no hydrogen 2.687 N/A LEU 35.A N LEU 61.A O no hydrogen 2.906 N/A CYS 36.A N ILE 104.A O no hydrogen 2.874 N/A HIS 37.A ND1 GLY 38.A O no hydrogen 2.697 N/A PHE 39.A N ASP 107.A OD2 no hydrogen 2.860 N/A GLU 41.A N GLY 38.A O no hydrogen 3.103 N/A TRP 43.A N ASP 64.A OD1 no hydrogen 3.259 N/A TYR 44.A N SER 42.A OG no hydrogen 2.979 N/A SER 45.A N SER 42.A O no hydrogen 3.182 N/A SER 45.A OG GLU 41.A OE1 no hydrogen 2.603 N/A SER 45.A OG TYR 220.A OH no hydrogen 2.775 N/A TRP 46.A N TRP 43.A O no hydrogen 2.802 N/A ARG 47.A N TYR 44.A O no hydrogen 2.814 N/A ARG 47.A NE GLU 216.A OE2 no hydrogen 2.767 N/A ARG 47.A NH1 TYR 44.A O no hydrogen 2.952 N/A GLN 49.A N TRP 46.A O no hydrogen 2.849 N/A GLN 49.A NE2 GLN 297.A O no hydrogen 3.670 N/A GLN 49.A NE2 PRO 301.A O no hydrogen 3.466 N/A GLN 49.A NE2 ASN 305.A OD1 no hydrogen 2.852 N/A ILE 50.A N TRP 46.A O no hydrogen 2.923 N/A LEU 53.A N GLN 49.A O no hydrogen 2.844 N/A ALA 54.A N ILE 50.A O no hydrogen 3.126 N/A GLN 55.A N PRO 51.A O no hydrogen 3.003 N/A ALA 56.A N ALA 52.A O no hydrogen 2.891 N/A ALA 56.A N LEU 53.A O no hydrogen 3.133 N/A GLY 57.A N LEU 53.A O no hydrogen 3.204 N/A GLY 57.A N ALA 54.A O no hydrogen 2.916 N/A TYR 58.A OH ASP 313.A OD1 no hydrogen 2.370 N/A ARG 59.A N PRO 31.A O no hydrogen 3.072 N/A ARG 59.A NE GLU 26.A OE2 no hydrogen 2.791 N/A ARG 59.A NH2 GLU 26.A OE2 no hydrogen 2.878 N/A VAL 60.A N LEU 27.A O no hydrogen 2.774 N/A LEU 61.A N VAL 33.A O no hydrogen 2.782 N/A ALA 62.A N VAL 25.A O no hydrogen 2.722 N/A MET 63.A N LEU 35.A O no hydrogen 3.152 N/A ASP 64.A N HIS 23.A O no hydrogen 2.976 N/A MET 65.A N HIS 37.A NE2 no hydrogen 3.129 N/A LYS 66.A NZ GLU 79.A O no hydrogen 2.589 N/A LYS 66.A NZ GLU 79.A OE1 no hydrogen 3.082 N/A LYS 66.A NZ GLU 88.A OE1 no hydrogen 2.940 N/A LYS 66.A NZ GLU 88.A OE2 no hydrogen 2.787 N/A GLY 67.A N SER 72.A O no hydrogen 2.948 N/A TYR 68.A N MET 65.A O no hydrogen 3.165 N/A GLU 70.A N ASP 64.A OD2 no hydrogen 3.027 N/A SER 71.A OG ASP 64.A O no hydrogen 2.346 N/A SER 72.A N ARG 21.A O no hydrogen 2.947 N/A SER 72.A OG ARG 19.A O no hydrogen 3.513 N/A SER 72.A OG ARG 21.A O no hydrogen 3.503 N/A GLU 76.A N GLU 76.A OE1 no hydrogen 2.787 N/A GLU 78.A N GLU 78.A OE2 no hydrogen 3.047 N/A GLU 79.A N GLU 76.A O no hydrogen 3.269 N/A TYR 80.A N ILE 77.A O no hydrogen 3.156 N/A TYR 80.A OH PRO 74.A O no hydrogen 2.580 N/A CYS 81.A N GLU 78.A O no hydrogen 3.510 N/A CYS 81.A SG GLU 78.A O no hydrogen 3.399 N/A MET 82.A N ASN 242.A OD1 no hydrogen 2.733 N/A LEU 85.A N CYS 81.A O no hydrogen 3.167 N/A CYS 86.A N MET 82.A O no hydrogen 2.725 N/A CYS 86.A SG LEU 112.A O no hydrogen 3.686 N/A LYS 87.A N GLU 83.A O no hydrogen 3.089 N/A GLU 88.A N VAL 84.A O no hydrogen 2.946 N/A MET 89.A N LEU 85.A O no hydrogen 3.223 N/A VAL 90.A N CYS 86.A O no hydrogen 3.009 N/A THR 91.A N LYS 87.A O no hydrogen 2.909 N/A THR 91.A OG1 LYS 87.A O no hydrogen 3.048 N/A PHE 92.A N GLU 88.A O no hydrogen 2.925 N/A LEU 93.A N MET 89.A O no hydrogen 2.940 N/A ASP 94.A N VAL 90.A O no hydrogen 2.898 N/A LYS 95.A N THR 91.A O no hydrogen 3.031 N/A LYS 95.A NZ THR 15.A O no hydrogen 3.451 N/A LEU 96.A N PHE 92.A O no hydrogen 3.305 N/A LEU 96.A N LEU 93.A O no hydrogen 3.069 N/A GLY 97.A N ASP 94.A O no hydrogen 3.084 N/A LEU 98.A N LEU 93.A O no hydrogen 3.068 N/A ALA 101.A N ARG 123.A O no hydrogen 3.025 N/A VAL 102.A N ALA 32.A O no hydrogen 2.829 N/A PHE 103.A N ALA 126.A O no hydrogen 3.066 N/A ILE 104.A N CYS 34.A O no hydrogen 2.897 N/A GLY 105.A N ALA 128.A O no hydrogen 2.911 N/A HIS 106.A N CYS 36.A O no hydrogen 3.152 N/A HIS 106.A NE2 HIS 294.A O no hydrogen 2.743 N/A ASP 107.A N LEU 130.A O no hydrogen 3.450 N/A MET 111.A N ASP 107.A O no hydrogen 3.193 N/A LEU 112.A N TRP 108.A O no hydrogen 3.045 N/A VAL 113.A N GLY 109.A O no hydrogen 3.140 N/A TRP 114.A N GLY 110.A O no hydrogen 3.155 N/A TRP 114.A NE1 THR 132.A O no hydrogen 2.908 N/A TYR 115.A N MET 111.A O no hydrogen 3.137 N/A MET 116.A N LEU 112.A O no hydrogen 2.782 N/A ALA 117.A N VAL 113.A O no hydrogen 3.015 N/A LEU 118.A N TRP 114.A O no hydrogen 2.916 N/A PHE 119.A N TYR 115.A O no hydrogen 2.952 N/A TYR 120.A N MET 116.A O no hydrogen 2.678 N/A GLU 122.A N GLU 122.A OE1 no hydrogen 2.655 N/A ARG 123.A N TYR 120.A O no hydrogen 2.840 N/A ARG 123.A NE SER 99.A O no hydrogen 2.938 N/A ARG 123.A NH1 ASP 94.A OD1 no hydrogen 2.834 N/A ARG 123.A NH2 ASP 94.A OD1 no hydrogen 2.954 N/A ARG 123.A NH2 LEU 98.A O no hydrogen 2.874 N/A VAL 124.A N PRO 121.A O no hydrogen 3.028 N/A ARG 125.A N ALA 101.A O no hydrogen 2.872 N/A ARG 125.A NE ALA 316.A O no hydrogen 2.415 N/A ARG 125.A NH2 ARG 317.A O no hydrogen 2.928 N/A VAL 127.A N PRO 257.A O no hydrogen 2.969 N/A ALA 128.A N PHE 103.A O no hydrogen 2.962 N/A SER 129.A N LEU 259.A O no hydrogen 2.932 N/A SER 129.A OG LEU 130.A O no hydrogen 3.544 N/A SER 129.A OG THR 132.A O no hydrogen 2.556 N/A LEU 130.A N GLY 105.A O no hydrogen 2.783 N/A ASN 131.A N VAL 261.A O no hydrogen 2.699 N/A ASN 131.A ND2 ASP 266.A OD2 no hydrogen 2.722 N/A ASN 131.A ND2 GLY 293.A O no hydrogen 3.462 N/A THR 132.A N LEU 130.A O no hydrogen 2.776 N/A THR 132.A OG1 ASP 107.A O no hydrogen 2.691 N/A THR 132.A OG1 LEU 130.A O no hydrogen 3.530 N/A MET 141.A N ASN 138.A O no hydrogen 2.984 N/A GLU 145.A N SER 142.A OG no hydrogen 3.296 N/A SER 146.A N SER 142.A O no hydrogen 3.259 N/A ILE 147.A N PRO 143.A O no hydrogen 3.220 N/A PHE 151.A N ASN 148.A O no hydrogen 2.913 N/A ASP 152.A N PRO 149.A O no hydrogen 2.998 N/A GLN 154.A N PHE 151.A O no hydrogen 3.114 N/A LEU 155.A N ASP 152.A O no hydrogen 2.851 N/A TYR 156.A OH GLU 166.A OE1 no hydrogen 3.091 N/A PHE 157.A N TYR 153.A O no hydrogen 3.225 N/A PHE 157.A N GLN 154.A O no hydrogen 3.190 N/A GLN 158.A N LEU 155.A O no hydrogen 3.088 N/A GLN 158.A NE2 GLN 154.A O no hydrogen 2.979 N/A GLN 158.A NE2 TYR 236.A O no hydrogen 2.890 N/A GLY 161.A N GLU 164.A OE1 no hydrogen 2.843 N/A VAL 162.A N GLU 159.A O no hydrogen 3.305 N/A GLU 164.A N GLU 164.A OE1 no hydrogen 2.996 N/A ALA 165.A N GLY 161.A O no hydrogen 3.212 N/A ALA 165.A N VAL 162.A O no hydrogen 3.166 N/A LEU 167.A N ALA 163.A O no hydrogen 3.050 N/A GLU 168.A N GLU 164.A O no hydrogen 2.895 N/A GLN 169.A N ALA 165.A O no hydrogen 2.907 N/A GLN 169.A N GLU 166.A O no hydrogen 3.255 N/A ARG 173.A N ASN 170.A OD1 no hydrogen 3.210 N/A ARG 173.A NE PRO 203.A O no hydrogen 3.073 N/A ARG 173.A NH2 PHE 199.A O no hydrogen 2.766 N/A ARG 173.A NH2 SER 202.A O no hydrogen 2.863 N/A ARG 173.A NH2 PRO 203.A O no hydrogen 3.053 N/A THR 174.A N ASN 170.A O no hydrogen 2.934 N/A THR 174.A OG1 LEU 167.A O no hydrogen 2.568 N/A THR 174.A OG1 ASN 170.A O no hydrogen 3.215 N/A PHE 175.A N LEU 171.A O no hydrogen 3.116 N/A LYS 176.A N SER 172.A O no hydrogen 2.999 N/A LYS 176.A NZ GLU 214.A OE1 no hydrogen 2.874 N/A LYS 176.A NZ GLU 214.A OE2 no hydrogen 2.880 N/A SER 177.A N ARG 173.A O no hydrogen 2.894 N/A SER 177.A OG ARG 173.A O no hydrogen 2.803 N/A LEU 178.A N THR 174.A O no hydrogen 3.042 N/A PHE 179.A N PHE 175.A O no hydrogen 2.896 N/A ARG 180.A N LEU 178.A O no hydrogen 2.730 N/A ARG 180.A NE GLU 184.A O no hydrogen 2.699 N/A ARG 180.A NH1 LYS 176.A O no hydrogen 3.028 N/A ARG 180.A NH1 SER 207.A O no hydrogen 2.648 N/A ARG 180.A NH2 SER 207.A OG no hydrogen 3.296 N/A ALA 181.A N GLU 184.A OE2 no hydrogen 2.881 N/A SER 182.A OG LYS 265.A O no hydrogen 2.333 N/A GLU 184.A N ALA 181.A O no hydrogen 3.035 N/A SER 185.A N SER 182.A O no hydrogen 3.276 N/A SER 185.A OG LEU 187.A O no hydrogen 3.030 N/A LYS 191.A N SER 188.A O no hydrogen 3.191 N/A CYS 193.A N ASP 152.A OD2 no hydrogen 3.128 N/A GLU 194.A N LYS 191.A O no hydrogen 2.925 N/A ALA 195.A N LYS 191.A O no hydrogen 3.193 N/A GLY 196.A N VAL 192.A O no hydrogen 2.997 N/A GLY 197.A N VAL 192.A O no hydrogen 3.279 N/A LEU 198.A N GLU 166.A OE1 no hydrogen 2.844 N/A PHE 199.A N GLU 166.A OE2 no hydrogen 2.917 N/A SER 202.A N PHE 199.A O no hydrogen 3.005 N/A SER 202.A OG PHE 199.A O no hydrogen 3.267 N/A SER 209.A OG GLU 184.A OE2 no hydrogen 2.882 N/A ARG 210.A N GLU 184.A OE1 no hydrogen 2.850 N/A ARG 210.A NH1 ASP 183.A OD1 no hydrogen 2.956 N/A ARG 210.A NH1 ASP 183.A OD2 no hydrogen 3.372 N/A ARG 210.A NH2 ASP 183.A OD2 no hydrogen 2.736 N/A MET 211.A N SER 209.A OG no hydrogen 2.931 N/A VAL 212.A N SER 209.A O no hydrogen 3.236 N/A THR 213.A N GLU 216.A OE1 no hydrogen 3.157 N/A GLU 215.A N GLU 215.A OE1 no hydrogen 2.562 N/A GLU 216.A N THR 213.A OG1 no hydrogen 3.177 N/A ILE 217.A N THR 213.A O no hydrogen 3.167 N/A GLN 218.A N GLU 214.A O no hydrogen 2.949 N/A GLN 218.A N GLU 215.A O no hydrogen 2.982 N/A GLN 218.A NE2 SER 172.A OG no hydrogen 2.955 N/A GLN 218.A NE2 GLU 214.A OE2 no hydrogen 3.227 N/A PHE 219.A N GLU 215.A O no hydrogen 3.074 N/A TYR 220.A N GLU 216.A O no hydrogen 3.491 N/A TYR 220.A OH SER 45.A OG no hydrogen 2.775 N/A VAL 221.A N ILE 217.A O no hydrogen 2.997 N/A GLN 222.A N GLN 218.A O no hydrogen 2.835 N/A GLN 223.A N PHE 219.A O no hydrogen 2.943 N/A PHE 224.A N TYR 220.A O no hydrogen 3.055 N/A LYS 225.A N VAL 221.A O no hydrogen 3.293 N/A LYS 226.A N GLN 223.A O no hydrogen 2.955 N/A GLY 228.A N PHE 224.A O no hydrogen 2.919 N/A PHE 229.A N GLU 168.A OE2 no hydrogen 2.928 N/A ARG 230.A NH1 PRO 75.A O no hydrogen 2.828 N/A LEU 233.A N PHE 229.A O no hydrogen 2.740 N/A ASN 234.A N ARG 230.A O no hydrogen 2.891 N/A ASN 234.A N GLY 231.A O no hydrogen 2.845 N/A TRP 235.A NE1 LYS 66.A O no hydrogen 3.265 N/A TYR 236.A N LEU 233.A O no hydrogen 2.829 N/A ARG 237.A N ASN 234.A O no hydrogen 2.981 N/A ARG 237.A NE PHE 157.A O no hydrogen 2.752 N/A ARG 237.A NH1 GLU 164.A OE2 no hydrogen 2.837 N/A ARG 237.A NH1 ASN 234.A OD1 no hydrogen 2.892 N/A ARG 237.A NH2 PHE 157.A O no hydrogen 2.865 N/A ARG 237.A NH2 GLU 164.A OE1 no hydrogen 2.992 N/A ARG 237.A NH2 GLU 164.A OE2 no hydrogen 3.443 N/A ASN 238.A ND2 ILE 77.A O no hydrogen 3.034 N/A ASN 242.A N ASN 238.A O no hydrogen 2.856 N/A TRP 243.A N MET 239.A O no hydrogen 2.885 N/A TRP 243.A NE1 ASN 138.A O no hydrogen 3.092 N/A LYS 244.A N GLU 240.A O no hydrogen 2.965 N/A TRP 245.A N ARG 241.A O no hydrogen 2.905 N/A ALA 246.A N ASN 242.A O no hydrogen 2.850 N/A CYS 247.A N TRP 243.A O no hydrogen 2.983 N/A CYS 247.A SG TRP 243.A O no hydrogen 3.297 N/A LYS 248.A N TRP 245.A O no hydrogen 2.971 N/A SER 249.A N ALA 246.A O no hydrogen 3.093 N/A SER 249.A OG ALA 246.A O no hydrogen 2.772 N/A LEU 250.A N CYS 247.A O no hydrogen 2.924 N/A ARG 252.A N SER 249.A O no hydrogen 3.354 N/A ARG 252.A NE SER 249.A O no hydrogen 3.254 N/A LYS 253.A NZ ASP 279.A O no hydrogen 2.578 N/A ILE 254.A N TRP 280.A O no hydrogen 3.170 N/A LEU 259.A N VAL 127.A O no hydrogen 2.901 N/A MET 260.A N LYS 285.A O no hydrogen 3.113 N/A VAL 261.A N SER 129.A O no hydrogen 2.897 N/A THR 262.A N GLY 287.A O no hydrogen 3.115 N/A THR 262.A OG1 GLY 287.A O no hydrogen 3.287 N/A THR 262.A OG1 HIS 288.A ND1 no hydrogen 3.093 N/A GLU 264.A N ILE 289.A O no hydrogen 3.210 N/A LYS 265.A N CYS 292.A O no hydrogen 2.685 N/A ASP 266.A N ALA 263.A O no hydrogen 3.147 N/A VAL 268.A N ASP 266.A OD1 no hydrogen 3.009 N/A LEU 269.A N ASP 266.A OD1 no hydrogen 2.856 N/A MET 273.A N VAL 270.A O no hydrogen 3.189 N/A SER 274.A N PRO 271.A O no hydrogen 3.115 N/A SER 274.A OG PRO 271.A O no hydrogen 2.937 N/A GLU 278.A N GLU 278.A OE1 no hydrogen 2.929 N/A TRP 280.A N MET 277.A O no hydrogen 3.169 N/A ILE 281.A N GLU 278.A O no hydrogen 3.075 N/A LEU 284.A N ILE 281.A O no hydrogen 3.281 N/A LYS 285.A N ALA 258.A O no hydrogen 2.949 N/A ARG 286.A NE GLU 278.A OE2 no hydrogen 2.812 N/A ARG 286.A NH1 SER 274.A OG no hydrogen 2.890 N/A ARG 286.A NH2 SER 274.A O no hydrogen 2.727 N/A ARG 286.A NH2 GLU 278.A OE1 no hydrogen 2.963 N/A ARG 286.A NH2 GLU 278.A OE2 no hydrogen 3.345 N/A GLY 287.A N MET 260.A O no hydrogen 2.951 N/A HIS 288.A ND1 THR 262.A OG1 no hydrogen 3.093 N/A ILE 289.A N THR 262.A O no hydrogen 2.928 N/A ASP 291.A N GLU 264.A OE2 no hydrogen 2.890 N/A CYS 292.A SG GLY 293.A O no hydrogen 3.678 N/A CYS 292.A SG THR 296.A O no hydrogen 3.951 N/A GLY 293.A N ASP 299.A OD2 no hydrogen 2.884 N/A HIS 294.A ND1 ASP 266.A OD2 no hydrogen 2.641 N/A THR 296.A N HIS 294.A O no hydrogen 2.823 N/A THR 296.A OG1 ASN 131.A OD1 no hydrogen 2.453 N/A THR 296.A OG1 GLY 293.A O no hydrogen 3.454 N/A THR 296.A OG1 HIS 294.A O no hydrogen 3.056 N/A GLN 297.A N GLN 297.A OE1 no hydrogen 2.871 N/A MET 298.A N TRP 295.A O no hydrogen 3.169 N/A ASP 299.A N TRP 295.A O no hydrogen 3.067 N/A LYS 300.A N THR 296.A O no hydrogen 3.138 N/A LYS 300.A NZ ASP 291.A O no hydrogen 3.103 N/A LYS 300.A NZ ASP 291.A OD2 no hydrogen 3.337 N/A LYS 300.A NZ ASP 299.A OD1 no hydrogen 3.381 N/A GLU 303.A N GLU 303.A OE2 no hydrogen 2.550 N/A VAL 304.A N LYS 300.A O no hydrogen 3.090 N/A ASN 305.A N PRO 301.A O no hydrogen 2.940 N/A ASN 305.A ND2 TYR 48.A O no hydrogen 3.035 N/A GLN 306.A N THR 302.A O no hydrogen 3.092 N/A ILE 307.A N GLU 303.A O no hydrogen 2.967 N/A LEU 308.A N VAL 304.A O no hydrogen 2.893 N/A ILE 309.A N ASN 305.A O no hydrogen 3.014 N/A LYS 310.A N GLN 306.A O no hydrogen 3.124 N/A TRP 311.A N ILE 307.A O no hydrogen 3.088 N/A LEU 312.A N LEU 308.A O no hydrogen 2.696 N/A ASP 313.A N ILE 309.A O no hydrogen 2.884 N/A SER 314.A N TRP 311.A O no hydrogen 3.061 N/A SER 314.A OG TRP 311.A O no hydrogen 3.360 N/A SER 314.A OG ASP 315.A OD1 no hydrogen 2.691 N/A ALA 316.A N LEU 312.A O no hydrogen 2.996 N/A ARG 317.A N LEU 312.A O no hydrogen 3.019 N/A