Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2sec_E.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N THR 77.A O no hydrogen 2.921 N/A GLN 2.A NE2 ASP 75.A OD2 no hydrogen 2.944 N/A THR 3.A N GLY 79.A O no hydrogen 2.756 N/A TYR 6.A OH ALA 202.A O no hydrogen 2.612 N/A ILE 8.A N PRO 5.A O no hydrogen 3.082 N/A LEU 10.A N TYR 6.A O no hydrogen 3.122 N/A ILE 11.A N GLY 7.A O no hydrogen 3.211 N/A LYS 12.A N PRO 9.A O no hydrogen 2.927 N/A ALA 13.A N ILE 8.A O no hydrogen 3.029 N/A LYS 15.A N LYS 12.A O no hydrogen 3.278 N/A LYS 15.A NZ GLU 270.A OE1 no hydrogen 3.393 N/A GLN 17.A N ALA 13.A O no hydrogen 2.880 N/A GLN 17.A NE2 GLY 82.A O no hydrogen 3.081 N/A GLN 17.A NE2 VAL 83.A O no hydrogen 2.802 N/A ALA 18.A N ASP 14.A O no hydrogen 2.939 N/A GLN 19.A N LYS 15.A O no hydrogen 3.146 N/A GLN 19.A N VAL 16.A O no hydrogen 3.062 N/A GLY 20.A N GLN 17.A O no hydrogen 2.966 N/A PHE 21.A N VAL 16.A O no hydrogen 3.319 N/A GLY 23.A N SER 235.A OG no hydrogen 3.078 N/A VAL 26.A N GLY 23.A O no hydrogen 3.087 N/A LYS 27.A N ASP 119.A OD1 no hydrogen 2.815 N/A VAL 28.A N SER 88.A O no hydrogen 2.974 N/A ALA 29.A N VAL 120.A O no hydrogen 2.880 N/A VAL 30.A N TYR 90.A O no hydrogen 2.929 N/A LEU 31.A N ASN 122.A O no hydrogen 2.977 N/A ASP 32.A N VAL 92.A O no hydrogen 2.984 N/A THR 33.A N ASP 32.A OD2 no hydrogen 2.695 N/A THR 33.A OG1 ASP 32.A OD2 no hydrogen 3.479 N/A THR 33.A OG1 ASP 59.A OD1 no hydrogen 2.851 N/A ILE 35.A N TYR 56.A O no hydrogen 3.345 N/A GLN 36.A N THR 65.A OG1 no hydrogen 2.903 N/A GLN 36.A NE2 SER 38.A OG no hydrogen 2.946 N/A GLN 36.A NE2 ASN 211.A OD1 no hydrogen 2.746 N/A ALA 37.A N ASN 57.A O no hydrogen 3.410 N/A HIS 39.A N GLN 36.A O no hydrogen 2.977 N/A HIS 39.A NE2 THR 212.A O no hydrogen 2.803 N/A ASP 41.A N HIS 39.A ND1 no hydrogen 2.965 N/A LEU 42.A N HIS 39.A O no hydrogen 3.271 N/A VAL 45.A N LEU 89.A O no hydrogen 2.785 N/A ALA 48.A N ALA 91.A O no hydrogen 3.036 N/A SER 49.A OG VAL 51.A O no hydrogen 3.194 N/A SER 49.A OG GLU 54.A O no hydrogen 2.752 N/A PHE 50.A N LYS 93.A O no hydrogen 2.778 N/A VAL 51.A N SER 49.A OG no hydrogen 3.107 N/A GLU 54.A N VAL 51.A O no hydrogen 3.247 N/A ASN 61.A ND2 SER 97.A O no hydrogen 2.957 N/A GLY 62.A N ASP 59.A OD1 no hydrogen 2.829 N/A HIS 63.A N ASN 61.A OD1 no hydrogen 3.291 N/A HIS 63.A ND1 ASP 32.A OD2 no hydrogen 2.677 N/A HIS 63.A NE2 SER 220.A OG no hydrogen 2.683 N/A GLY 64.A N THR 33.A OG1 no hydrogen 2.944 N/A THR 65.A N ASP 59.A OD2 no hydrogen 2.909 N/A THR 65.A OG1 ASP 59.A OD2 no hydrogen 2.544 N/A HIS 66.A N GLY 62.A O no hydrogen 3.079 N/A HIS 66.A NE2 ALA 214.A O no hydrogen 2.932 N/A VAL 67.A N HIS 63.A O no hydrogen 2.945 N/A ALA 68.A N GLY 64.A O no hydrogen 2.892 N/A GLY 69.A N THR 65.A O no hydrogen 3.002 N/A THR 70.A N HIS 66.A O no hydrogen 3.151 N/A THR 70.A N VAL 67.A O no hydrogen 3.065 N/A THR 70.A OG1 HIS 66.A O no hydrogen 3.523 N/A VAL 71.A N VAL 67.A O no hydrogen 3.251 N/A ALA 72.A N ALA 68.A O no hydrogen 2.854 N/A ALA 73.A N GLY 69.A O no hydrogen 2.979 N/A LEU 74.A N ASP 41.A O no hydrogen 2.881 N/A ASN 76.A N GLN 2.A OE1 no hydrogen 2.794 N/A ASN 76.A ND2 GLN 2.A OE1 no hydrogen 2.877 N/A ASN 76.A ND2 ASP 41.A OD1 no hydrogen 3.024 N/A ASN 76.A ND2 THR 78.A O no hydrogen 2.944 N/A VAL 80.A N ASP 41.A OD2 no hydrogen 2.907 N/A GLY 82.A N ALA 73.A O no hydrogen 2.915 N/A VAL 83.A N THR 70.A O no hydrogen 2.933 N/A ALA 84.A N VAL 71.A O no hydrogen 2.812 N/A SER 86.A N LYS 22.A O no hydrogen 2.954 N/A VAL 87.A N ALA 84.A O no hydrogen 3.177 N/A SER 88.A N VAL 26.A O no hydrogen 2.902 N/A TYR 90.A N VAL 28.A O no hydrogen 2.867 N/A ALA 91.A N GLY 46.A O no hydrogen 3.020 N/A VAL 92.A N VAL 30.A O no hydrogen 2.960 N/A LYS 93.A N ALA 48.A O no hydrogen 2.884 N/A LYS 93.A NZ GLU 54.A OE1 no hydrogen 2.808 N/A LYS 93.A NZ ALA 55.A O no hydrogen 2.781 N/A LYS 93.A NZ THR 58.A O no hydrogen 2.882 N/A VAL 94.A N ASP 32.A O no hydrogen 2.893 N/A LEU 95.A N ASP 32.A O no hydrogen 3.090 N/A ASN 96.A N SER 100.A O no hydrogen 2.759 N/A SER 98.A N ASN 96.A OD1 no hydrogen 2.824 N/A SER 98.A OG ASN 96.A OD1 no hydrogen 2.678 N/A GLY 99.A N ASN 96.A O no hydrogen 2.839 N/A SER 100.A N ASN 96.A OD1 no hydrogen 3.334 N/A TYR 103.A OH SER 129.A O no hydrogen 3.172 N/A GLY 105.A N SER 102.A OG no hydrogen 3.147 N/A ILE 106.A N SER 102.A O no hydrogen 3.229 N/A VAL 107.A N TYR 103.A O no hydrogen 2.809 N/A SER 108.A N SER 104.A O no hydrogen 2.957 N/A SER 108.A OG SER 104.A O no hydrogen 3.112 N/A GLY 109.A N GLY 105.A O no hydrogen 3.043 N/A ILE 110.A N ILE 106.A O no hydrogen 2.998 N/A GLU 111.A N VAL 107.A O no hydrogen 2.809 N/A TRP 112.A N SER 108.A O no hydrogen 2.940 N/A ALA 113.A N GLY 109.A O no hydrogen 2.992 N/A THR 114.A N ILE 110.A O no hydrogen 3.018 N/A THR 114.A OG1 ILE 110.A O no hydrogen 2.824 N/A THR 115.A N GLU 111.A O no hydrogen 3.011 N/A THR 115.A OG1 GLU 111.A O no hydrogen 3.513 N/A ASN 116.A N TRP 112.A O no hydrogen 2.919 N/A ASN 116.A ND2 TRP 112.A O no hydrogen 2.838 N/A MET 118.A N ALA 113.A O no hydrogen 3.098 N/A ASP 119.A N LYS 27.A O no hydrogen 2.813 N/A VAL 120.A N LYS 27.A O no hydrogen 3.146 N/A ILE 121.A N VAL 147.A O no hydrogen 2.827 N/A ASN 122.A N ALA 29.A O no hydrogen 2.902 N/A ASN 122.A ND2 SER 124.A OG no hydrogen 3.118 N/A MET 123.A N VAL 149.A O no hydrogen 2.859 N/A SER 124.A OG SER 220.A O no hydrogen 2.680 N/A GLY 127.A N TYR 166.A O no hydrogen 2.734 N/A SER 131.A N TYR 170.A OH no hydrogen 3.128 N/A MET 134.A N SER 131.A OG no hydrogen 3.001 N/A LYS 135.A N SER 131.A O no hydrogen 2.991 N/A LYS 135.A NZ ASP 139.A OD2 no hydrogen 2.872 N/A GLN 136.A N THR 132.A O no hydrogen 2.934 N/A ALA 137.A N ALA 133.A O no hydrogen 2.933 N/A VAL 138.A N MET 134.A O no hydrogen 3.014 N/A ASP 139.A N LYS 135.A O no hydrogen 2.951 N/A ASN 140.A N GLN 136.A O no hydrogen 2.830 N/A ALA 141.A N ALA 137.A O no hydrogen 2.966 N/A TYR 142.A N VAL 138.A O no hydrogen 2.989 N/A ALA 143.A N ASP 139.A O no hydrogen 3.021 N/A ARG 144.A N ASN 140.A O no hydrogen 2.985 N/A ARG 144.A NE THR 114.A O no hydrogen 2.798 N/A ARG 144.A NH1 ARG 144.A O no hydrogen 3.213 N/A ARG 144.A NH2 ALA 113.A O no hydrogen 3.552 N/A ARG 144.A NH2 THR 114.A O no hydrogen 3.035 N/A ARG 144.A NH2 MET 118.A O no hydrogen 2.902 N/A GLY 145.A N TYR 142.A O no hydrogen 2.931 N/A VAL 146.A N ALA 141.A O no hydrogen 2.997 N/A VAL 147.A N ASP 119.A O no hydrogen 2.952 N/A VAL 149.A N ILE 121.A O no hydrogen 2.908 N/A ALA 150.A N ILE 174.A O no hydrogen 2.854 N/A ALA 151.A N MET 123.A O no hydrogen 3.165 N/A ALA 152.A N VAL 176.A O no hydrogen 2.848 N/A GLY 153.A N THR 219.A OG1 no hydrogen 3.205 N/A SER 155.A N SER 190.A OG no hydrogen 3.018 N/A GLY 156.A N PHE 188.A O no hydrogen 2.939 N/A THR 161.A N SER 158.A O no hydrogen 2.916 N/A THR 161.A OG1 SER 158.A O no hydrogen 2.936 N/A ASN 162.A ND2 GLU 194.A OE1 no hydrogen 2.616 N/A THR 163.A N VAL 191.A O no hydrogen 2.823 N/A THR 163.A OG1 GLY 156.A O no hydrogen 2.624 N/A THR 163.A OG1 VAL 191.A O no hydrogen 3.451 N/A ILE 164.A N ASN 162.A OD1 no hydrogen 3.125 N/A GLY 165.A N ALA 152.A O no hydrogen 3.171 N/A TYR 166.A N GLY 127.A O no hydrogen 2.806 N/A LYS 169.A N GLY 165.A O no hydrogen 2.880 N/A LYS 169.A NZ GLU 194.A OE2 no hydrogen 3.231 N/A TYR 170.A N PRO 167.A O no hydrogen 3.050 N/A SER 172.A OG ASP 139.A OD1 no hydrogen 2.767 N/A VAL 173.A N TYR 170.A O no hydrogen 3.028 N/A ILE 174.A N VAL 148.A O no hydrogen 2.879 N/A VAL 176.A N ALA 150.A O no hydrogen 2.855 N/A GLY 177.A N VAL 197.A O no hydrogen 2.936 N/A ALA 178.A N SER 189.A OG no hydrogen 2.990 N/A VAL 179.A N ALA 199.A O no hydrogen 2.961 N/A ASP 180.A N ASN 184.A O no hydrogen 2.900 N/A ASN 182.A N ASP 180.A OD1 no hydrogen 2.805 N/A SER 183.A N ASP 180.A O no hydrogen 3.027 N/A ASN 184.A N ASP 180.A OD1 no hydrogen 3.057 N/A ARG 185.A NH1 ASN 157.A OD1 no hydrogen 3.356 N/A ARG 185.A NH2 ASN 157.A OD1 no hydrogen 2.955 N/A ARG 185.A NH2 SER 189.A O no hydrogen 2.644 N/A ALA 186.A N ALA 178.A O no hydrogen 2.890 N/A SER 189.A N ALA 186.A O no hydrogen 2.983 N/A SER 190.A N GLY 153.A O no hydrogen 2.907 N/A SER 190.A OG THR 163.A O no hydrogen 2.841 N/A VAL 191.A N THR 163.A OG1 no hydrogen 2.957 N/A GLY 192.A N PHE 260.A O no hydrogen 3.041 N/A LEU 195.A N GLY 192.A O no hydrogen 3.176 N/A GLU 196.A N ALA 175.A O no hydrogen 3.092 N/A VAL 197.A N ALA 175.A O no hydrogen 3.430 N/A MET 198.A N GLY 265.A O no hydrogen 2.779 N/A ALA 199.A N GLY 177.A O no hydrogen 3.006 N/A GLY 201.A N VAL 179.A O no hydrogen 2.873 N/A GLY 203.A N ASN 217.A OD1 no hydrogen 2.727 N/A VAL 204.A N LEU 216.A O no hydrogen 3.006 N/A SER 206.A N ALA 214.A O no hydrogen 2.968 N/A SER 206.A OG HIS 66.A O no hydrogen 2.770 N/A THR 207.A OG1 THR 65.A O no hydrogen 2.661 N/A TYR 208.A N THR 212.A O no hydrogen 2.922 N/A ASN 211.A N GLN 36.A OE1 no hydrogen 2.995 N/A THR 212.A N TYR 208.A O no hydrogen 2.840 N/A ALA 214.A N SER 206.A O no hydrogen 2.949 N/A LEU 216.A N VAL 204.A O no hydrogen 2.962 N/A GLY 218.A N GLY 201.A O no hydrogen 2.824 N/A THR 219.A N ASN 154.A OD1 no hydrogen 2.911 N/A THR 219.A OG1 ASN 154.A OD1 no hydrogen 2.823 N/A SER 220.A OG HIS 63.A NE2 no hydrogen 2.683 N/A SER 220.A OG SER 124.A O no hydrogen 3.238 N/A MET 221.A N GLY 218.A O no hydrogen 3.079 N/A ALA 222.A N THR 219.A O no hydrogen 3.058 N/A SER 223.A N THR 219.A O no hydrogen 3.134 N/A SER 223.A OG ASN 122.A OD1 no hydrogen 2.707 N/A HIS 225.A N ALA 222.A O no hydrogen 2.957 N/A HIS 225.A ND1 MET 221.A O no hydrogen 2.914 N/A VAL 226.A N SER 223.A O no hydrogen 2.946 N/A ALA 227.A N SER 223.A O no hydrogen 3.027 N/A GLY 228.A N PRO 224.A O no hydrogen 2.859 N/A ALA 229.A N HIS 225.A O no hydrogen 2.909 N/A ALA 230.A N VAL 226.A O no hydrogen 2.871 N/A ALA 231.A N ALA 227.A O no hydrogen 3.184 N/A LEU 232.A N GLY 228.A O no hydrogen 3.001 N/A ILE 233.A N ALA 229.A O no hydrogen 3.032 N/A LEU 234.A N ALA 230.A O no hydrogen 3.016 N/A SER 235.A N ALA 231.A O no hydrogen 2.987 N/A SER 235.A OG ALA 231.A O no hydrogen 3.543 N/A SER 235.A OG LEU 232.A O no hydrogen 2.904 N/A LYS 236.A N LEU 232.A O no hydrogen 3.177 N/A LYS 236.A N ILE 233.A O no hydrogen 3.168 N/A LYS 236.A NZ GLN 19.A OE1 no hydrogen 2.844 N/A LYS 236.A NZ ALA 273.A O no hydrogen 2.982 N/A HIS 237.A N ILE 233.A O no hydrogen 2.865 N/A LEU 240.A N HIS 237.A O no hydrogen 3.350 N/A SER 241.A N GLN 244.A OE1 no hydrogen 3.096 N/A GLN 244.A N SER 241.A OG no hydrogen 3.221 N/A VAL 245.A N SER 241.A O no hydrogen 3.044 N/A ARG 246.A N ALA 242.A O no hydrogen 2.976 N/A ARG 246.A NE GLU 196.A OE1 no hydrogen 2.877 N/A ARG 246.A NH1 ASP 171.A O no hydrogen 2.941 N/A ARG 246.A NH1 GLU 196.A OE2 no hydrogen 2.903 N/A ARG 246.A NH2 TYR 142.A OH no hydrogen 3.474 N/A ARG 246.A NH2 ASP 171.A O no hydrogen 2.899 N/A ASN 247.A N SER 243.A O no hydrogen 2.851 N/A ASN 247.A ND2 SER 243.A O no hydrogen 2.720 N/A ARG 248.A N GLN 244.A O no hydrogen 2.915 N/A ARG 248.A NH1 GLN 274.A OXT no hydrogen 3.323 N/A ARG 248.A NH2 ALA 272.A O no hydrogen 2.893 N/A ARG 248.A NH2 GLN 274.A OXT no hydrogen 2.781 N/A LEU 249.A N VAL 245.A O no hydrogen 3.103 N/A SER 250.A N ARG 246.A O no hydrogen 3.218 N/A SER 250.A OG ARG 246.A O no hydrogen 3.543 N/A SER 250.A OG ASN 247.A O no hydrogen 3.545 N/A SER 251.A N ASN 247.A O no hydrogen 2.896 N/A SER 251.A OG ASN 247.A O no hydrogen 2.647 N/A THR 252.A N ARG 248.A O no hydrogen 3.403 N/A THR 252.A OG1 ARG 248.A O no hydrogen 2.616 N/A ALA 253.A N SER 250.A O no hydrogen 3.392 N/A THR 254.A N LEU 266.A O no hydrogen 2.758 N/A PHE 260.A N SER 258.A OG no hydrogen 3.379 N/A TYR 261.A N SER 258.A O no hydrogen 2.976 N/A TYR 262.A N SER 258.A O no hydrogen 2.917 N/A GLY 263.A N SER 259.A O no hydrogen 2.778 N/A LYS 264.A N GLU 196.A O no hydrogen 2.844 N/A GLY 265.A N TYR 262.A O no hydrogen 2.908 N/A LEU 266.A N THR 254.A O no hydrogen 2.917 N/A ILE 267.A N MET 198.A O no hydrogen 3.152 N/A VAL 269.A N ILE 11.A O no hydrogen 2.848 N/A ALA 271.A N ASN 268.A OD1 no hydrogen 3.054 N/A ALA 272.A N ASN 268.A O no hydrogen 2.986 N/A ALA 273.A N VAL 269.A O no hydrogen 2.953 N/A GLN 274.A N ALA 271.A O no hydrogen 3.147 N/A GLN 274.A NE2 ALA 271.A O no hydrogen 2.956 N/A