Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5icp_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 5.A N LYS 2.A O no hydrogen 3.169 N/A ASN 7.A N MET 4.A O no hydrogen 2.984 N/A GLN 10.A N ASN 7.A O no hydrogen 2.907 N/A SER 11.A N PHE 8.A O no hydrogen 3.031 N/A SER 11.A OG PHE 8.A O no hydrogen 2.663 N/A TYR 14.A N SER 11.A OG no hydrogen 2.991 N/A LEU 15.A N SER 11.A O no hydrogen 2.961 N/A GLN 16.A N.A SER 12.A O no hydrogen 2.911 N/A GLN 16.A N.B SER 12.A O no hydrogen 2.915 N/A GLN 16.A NE2.A ASP 150.A OD2 no hydrogen 2.996 N/A GLN 16.A NE2.B ASP 150.A OD2 no hydrogen 3.277 N/A TRP 17.A N HIS 13.A O no hydrogen 2.913 N/A LEU 19.A N LEU 193.A O no hydrogen 2.745 N/A GLN 22.A N ASP 20.A OD1 no hydrogen 2.877 N/A LEU 24.A N ASP 20.A O no hydrogen 2.986 N/A LEU 25.A N LYS 21.A O no hydrogen 3.023 N/A LYS 26.A N GLN 22.A O no hydrogen 2.932 N/A GLU 27.A N ASP 23.A O no hydrogen 3.055 N/A ARG 28.A N LEU 24.A O no hydrogen 3.051 N/A ARG 28.A NH1 ASP 190.A OD2 no hydrogen 2.887 N/A ARG 28.A NH2 ASP 190.A OD1 no hydrogen 3.253 N/A ARG 28.A NH2 ASP 190.A OD2 no hydrogen 3.310 N/A GLN 29.A N LYS 26.A O no hydrogen 3.307 N/A GLN 29.A NE2 LEU 25.A O no hydrogen 2.770 N/A ASP 31.A N ARG 28.A O no hydrogen 3.028 N/A LEU 32.A N ARG 28.A O no hydrogen 3.198 N/A PHE 34.A N ASP 31.A O no hydrogen 3.194 N/A LEU 35.A N ASP 31.A O no hydrogen 3.181 N/A SER 36.A N GLU 39.A OE1 no hydrogen 2.766 N/A GLU 39.A N SER 36.A OG no hydrogen 2.948 N/A TYR 40.A N SER 36.A O no hydrogen 2.930 N/A TRP 41.A N GLU 37.A O no hydrogen 3.185 N/A TRP 41.A NE1 ARG 188.A O no hydrogen 2.891 N/A LYS 42.A N GLU 38.A O no hydrogen 2.936 N/A LYS 42.A NZ GLU 38.A OE2 no hydrogen 3.408 N/A LYS 42.A NZ GLU 252.A OE1 no hydrogen 2.655 N/A LEU 43.A N GLU 39.A O no hydrogen 2.933 N/A GLN 44.A N TYR 40.A O no hydrogen 2.949 N/A GLN 44.A NE2 ASP 190.A OD1 no hydrogen 2.931 N/A ILE 45.A N TRP 41.A O no hydrogen 2.918 N/A PHE 46.A N LYS 42.A O no hydrogen 2.917 N/A PHE 47.A N LEU 43.A O no hydrogen 3.095 N/A THR 48.A N GLN 44.A O no hydrogen 3.045 N/A THR 48.A OG1 GLN 44.A O no hydrogen 2.874 N/A THR 48.A OG1 TYR 187.A O no hydrogen 3.058 N/A ASN 49.A N ILE 45.A O no hydrogen 3.015 N/A ASN 49.A ND2 GLU 249.A OE2 no hydrogen 2.759 N/A VAL 50.A N PHE 46.A O no hydrogen 2.913 N/A ILE 51.A N PHE 47.A O no hydrogen 2.999 N/A GLN 52.A N THR 48.A O no hydrogen 3.006 N/A GLN 52.A NE2 GLU 56.A OE2 no hydrogen 2.765 N/A GLN 52.A NE2 GLN 62.A OE1 no hydrogen 3.275 N/A ALA 53.A N ASN 49.A O no hydrogen 3.026 N/A LEU 54.A N VAL 50.A O no hydrogen 2.920 N/A GLY 55.A N ILE 51.A O no hydrogen 2.976 N/A GLU 56.A N GLN 52.A O no hydrogen 2.903 N/A HIS 57.A N ALA 53.A O no hydrogen 3.009 N/A LEU 58.A N LEU 54.A O no hydrogen 3.007 N/A LYS 59.A N GLU 56.A O no hydrogen 3.061 N/A LEU 60.A N GLY 55.A O no hydrogen 2.942 N/A GLN 62.A NE2 GLN 52.A OE1 no hydrogen 2.841 N/A VAL 64.A N ARG 61.A O no hydrogen 3.038 N/A ILE 65.A N ARG 61.A O no hydrogen 3.308 N/A ALA 66.A N GLN 62.A O no hydrogen 2.821 N/A THR 67.A N GLN 63.A O no hydrogen 2.984 N/A THR 67.A OG1 GLN 63.A O no hydrogen 3.076 N/A THR 67.A OG1 HIS 157.A NE2 no hydrogen 2.769 N/A ALA 68.A N VAL 64.A O no hydrogen 2.930 N/A THR 69.A N ILE 65.A O no hydrogen 2.883 N/A THR 69.A OG1 ILE 65.A O no hydrogen 2.713 N/A VAL 70.A N.A ALA 66.A O no hydrogen 2.981 N/A VAL 70.A N.B ALA 66.A O no hydrogen 2.967 N/A TYR 71.A N THR 67.A O no hydrogen 2.991 N/A TYR 71.A OH LEU 153.A O no hydrogen 2.688 N/A PHE 72.A N ALA 68.A O no hydrogen 3.081 N/A LYS 73.A N THR 69.A O no hydrogen 3.007 N/A LYS 73.A NZ TYR 187.A O no hydrogen 2.767 N/A LYS 73.A NZ THR 189.A O no hydrogen 3.093 N/A ARG 74.A N VAL 70.A O.A no hydrogen 2.835 N/A ARG 74.A N VAL 70.A O.B no hydrogen 2.824 N/A PHE 75.A N TYR 71.A O no hydrogen 2.988 N/A TYR 76.A N PHE 72.A O no hydrogen 3.176 N/A TYR 76.A OH ILE 84.A O no hydrogen 2.708 N/A ALA 77.A N LYS 73.A O no hydrogen 2.746 N/A ARG 78.A N PHE 75.A O no hydrogen 3.366 N/A TYR 79.A N PHE 75.A O no hydrogen 2.946 N/A SER 80.A OG ASP 31.A OD1 no hydrogen 2.498 N/A SER 80.A OG ASP 31.A OD2 no hydrogen 3.533 N/A LEU 81.A N ASP 31.A OD2 no hydrogen 2.845 N/A LYS 82.A N SER 80.A OG no hydrogen 3.132 N/A SER 83.A N SER 80.A O no hydrogen 3.079 N/A SER 83.A OG SER 80.A O no hydrogen 2.712 N/A VAL 87.A N ASP 85.A OD1 no hydrogen 2.947 N/A LEU 88.A N ASP 85.A O no hydrogen 2.953 N/A MET 89.A N ASP 85.A O no hydrogen 2.965 N/A ALA 90.A N PRO 86.A O no hydrogen 3.035 N/A THR 92.A N LEU 88.A O no hydrogen 3.335 N/A THR 92.A OG1 LEU 88.A O no hydrogen 2.756 N/A CYS 93.A N MET 89.A O no hydrogen 2.812 N/A CYS 93.A SG MET 89.A O no hydrogen 3.246 N/A VAL 94.A N ALA 90.A O no hydrogen 3.168 N/A PHE 95.A N PRO 91.A O no hydrogen 2.896 N/A LEU 96.A N THR 92.A O no hydrogen 2.954 N/A ALA 97.A N CYS 93.A O no hydrogen 2.987 N/A SER 98.A N.A VAL 94.A O no hydrogen 2.981 N/A SER 98.A N.B VAL 94.A O no hydrogen 2.978 N/A SER 98.A OG.B PHE 95.A O no hydrogen 2.631 N/A LYS 99.A N PHE 95.A O no hydrogen 3.336 N/A LYS 99.A N LEU 96.A O no hydrogen 3.070 N/A LYS 99.A NZ GLU 142.A OE1 no hydrogen 3.452 N/A LYS 99.A NZ GLU 142.A OE2 no hydrogen 2.573 N/A VAL 100.A N LEU 96.A O no hydrogen 3.174 N/A GLY 104.A N GLU 102.A O no hydrogen 3.255 N/A ARG 110.A N SER 107.A OG no hydrogen 3.342 N/A LEU 111.A N SER 107.A O no hydrogen 2.998 N/A ILE 112.A N ASN 108.A O no hydrogen 3.146 N/A ALA 113.A N THR 109.A O no hydrogen 2.844 N/A ALA 114.A N ARG 110.A O no hydrogen 2.972 N/A ALA 115.A N LEU 111.A O no hydrogen 2.932 N/A THR 116.A N ILE 112.A O no hydrogen 2.995 N/A THR 116.A OG1 ILE 112.A O no hydrogen 2.951 N/A SER 117.A N ALA 113.A O no hydrogen 2.953 N/A VAL 118.A N ALA 114.A O no hydrogen 2.860 N/A LEU 119.A N ALA 115.A O no hydrogen 3.136 N/A LYS 120.A N THR 116.A O no hydrogen 3.166 N/A THR 121.A N SER 117.A O no hydrogen 2.872 N/A THR 121.A OG1 SER 117.A O no hydrogen 2.816 N/A ARG 122.A N VAL 118.A O no hydrogen 2.939 N/A ARG 122.A NH1 GLU 56.A OE1 no hydrogen 3.394 N/A ARG 122.A NH2 GLU 56.A OE1 no hydrogen 3.293 N/A PHE 123.A N LEU 119.A O no hydrogen 3.224 N/A ALA 126.A N PHE 123.A O no hydrogen 3.042 N/A PHE 127.A N PHE 123.A O no hydrogen 3.095 N/A TYR 133.A OH ASP 85.A OD2 no hydrogen 2.513 N/A ARG 134.A N HIS 137.A ND1 no hydrogen 3.150 N/A HIS 137.A N ARG 134.A O no hydrogen 3.104 N/A ILE 138.A N ARG 134.A O no hydrogen 3.453 N/A LEU 139.A N MET 135.A O no hydrogen 2.941 N/A GLU 140.A N ASN 136.A O no hydrogen 3.032 N/A CYS 141.A N HIS 137.A O no hydrogen 2.918 N/A CYS 141.A SG THR 92.A OG1 no hydrogen 3.506 N/A GLU 142.A N ILE 138.A O no hydrogen 2.805 N/A PHE 143.A N LEU 139.A O no hydrogen 3.412 N/A TYR 144.A N GLU 140.A O no hydrogen 3.428 N/A LEU 145.A N CYS 141.A O no hydrogen 2.895 N/A LEU 146.A N GLU 142.A O no hydrogen 2.930 N/A GLU 147.A N PHE 143.A O no hydrogen 3.104 N/A LEU 148.A N TYR 144.A O no hydrogen 2.887 N/A MET 149.A N LEU 145.A O no hydrogen 2.931 N/A ASP 150.A N GLU 147.A O no hydrogen 2.997 N/A CYS 151.A N LEU 146.A O no hydrogen 2.916 N/A CYS 151.A SG LEU 146.A O no hydrogen 4.031 N/A CYS 152.A N MET 149.A O no hydrogen 3.112 N/A CYS 152.A SG MET 149.A O no hydrogen 3.438 N/A CYS 152.A SG ASP 150.A O no hydrogen 3.733 N/A TYR 156.A N HIS 13.A ND1 no hydrogen 3.156 N/A TYR 156.A OH MET 4.A O no hydrogen 2.607 N/A HIS 157.A ND1 TYR 187.A OH no hydrogen 2.730 N/A HIS 157.A NE2 THR 67.A OG1 no hydrogen 2.769 N/A TYR 159.A OH ASN 184.A OD1 no hydrogen 2.640 N/A ARG 160.A NH2 ASP 1.A O no hydrogen 2.852 N/A LEU 162.A N PRO 158.A O no hydrogen 2.959 N/A LEU 163.A N TYR 159.A O no hydrogen 3.020 N/A GLN 164.A N ARG 160.A O no hydrogen 3.237 N/A TYR 165.A N PRO 161.A O no hydrogen 2.872 N/A VAL 166.A N LEU 162.A O no hydrogen 2.901 N/A GLN 167.A N LEU 163.A O no hydrogen 3.069 N/A ASP 168.A N GLN 164.A O no hydrogen 2.984 N/A MET 169.A N TYR 165.A O no hydrogen 2.853 N/A GLY 170.A N VAL 166.A O no hydrogen 3.088 N/A GLY 170.A N GLN 167.A O no hydrogen 3.053 N/A GLN 171.A N VAL 166.A O no hydrogen 3.172 N/A LEU 175.A N GLN 171.A O no hydrogen 2.941 N/A LEU 176.A N GLU 172.A O no hydrogen 3.212 N/A ALA 179.A N LEU 175.A O no hydrogen 2.909 N/A TRP 180.A N LEU 176.A O no hydrogen 2.823 N/A ARG 181.A N PRO 177.A O no hydrogen 3.135 N/A ARG 181.A NE ASP 185.A OD2 no hydrogen 2.731 N/A ARG 181.A NH2 ASP 185.A OD2 no hydrogen 3.208 N/A ILE 182.A N LEU 178.A O no hydrogen 2.977 N/A VAL 183.A N ALA 179.A O no hydrogen 2.906 N/A ASN 184.A N TRP 180.A O no hydrogen 2.985 N/A ASP 185.A N ARG 181.A O no hydrogen 3.057 N/A THR 186.A N ILE 182.A O no hydrogen 3.040 N/A THR 186.A N VAL 183.A O no hydrogen 3.053 N/A THR 186.A OG1 VAL 183.A O no hydrogen 2.600 N/A TYR 187.A N ASN 184.A O no hydrogen 3.221 N/A TYR 187.A OH HIS 157.A ND1 no hydrogen 2.730 N/A ARG 188.A N ASP 185.A O no hydrogen 2.970 N/A ARG 188.A NE ASN 49.A OD1 no hydrogen 2.984 N/A ARG 188.A NH1 ASN 184.A O no hydrogen 3.050 N/A ARG 188.A NH2 ASN 49.A OD1 no hydrogen 2.738 N/A THR 189.A N THR 186.A O no hydrogen 2.952 N/A THR 189.A OG1 THR 186.A O no hydrogen 2.708 N/A LEU 191.A N THR 189.A OG1 no hydrogen 3.152 N/A LEU 193.A N ASP 190.A O no hydrogen 2.867 N/A LEU 194.A N LEU 191.A O no hydrogen 2.992 N/A TYR 195.A N LEU 191.A O no hydrogen 2.989 N/A TYR 195.A OH GLU 232.A OE1 no hydrogen 2.723 N/A MET 199.A N PRO 196.A O no hydrogen 3.122 N/A ILE 200.A N PRO 196.A O no hydrogen 3.389 N/A ALA 201.A N PRO 197.A O no hydrogen 2.842 N/A LEU 202.A N PHE 198.A O no hydrogen 3.003 N/A ALA 203.A N MET 199.A O no hydrogen 3.101 N/A CYS 204.A N ILE 200.A O no hydrogen 2.974 N/A CYS 204.A SG ILE 200.A O no hydrogen 3.257 N/A LEU 205.A N ALA 201.A O no hydrogen 2.926 N/A HIS 206.A N LEU 202.A O no hydrogen 2.881 N/A VAL 207.A N ALA 203.A O no hydrogen 3.066 N/A ALA 208.A N CYS 204.A O no hydrogen 2.964 N/A CYS 209.A N LEU 205.A O no hydrogen 2.963 N/A CYS 209.A SG LEU 205.A O no hydrogen 3.308 N/A VAL 210.A N HIS 206.A O no hydrogen 3.044 N/A VAL 211.A N VAL 207.A O no hydrogen 2.949 N/A GLN 212.A N.A ALA 208.A O no hydrogen 3.052 N/A GLN 212.A N.B ALA 208.A O no hydrogen 3.047 N/A GLN 212.A NE2.A MET 174.A O no hydrogen 2.988 N/A GLN 213.A N VAL 210.A O no hydrogen 3.182 N/A LYS 214.A N CYS 209.A O no hydrogen 2.799 N/A LYS 214.A NZ ASP 215.A O no hydrogen 3.241 N/A ARG 217.A N ASP 215.A OD1 no hydrogen 3.339 N/A TRP 219.A NE1 ASP 168.A OD2 no hydrogen 2.881 N/A PHE 220.A N ALA 216.A O no hydrogen 2.949 N/A ALA 221.A N ARG 217.A O no hydrogen 2.829 N/A GLU 222.A N GLN 218.A O no hydrogen 2.987 N/A SER 224.A OG SER 224.A O no hydrogen 2.680 N/A GLU 228.A N ASP 226.A OD1 no hydrogen 3.231 N/A LYS 229.A NZ ASP 226.A OD2 no hydrogen 2.778 N/A ILE 230.A N ASP 226.A O no hydrogen 3.412 N/A LEU 231.A N MET 227.A O no hydrogen 2.916 N/A GLU 232.A N GLU 228.A O no hydrogen 3.010 N/A ILE 233.A N LYS 229.A O no hydrogen 3.102 N/A ILE 234.A N ILE 230.A O no hydrogen 2.912 N/A ARG 235.A N LEU 231.A O no hydrogen 2.930 N/A VAL 236.A N GLU 232.A O no hydrogen 3.262 N/A ILE 237.A N ILE 233.A O no hydrogen 3.063 N/A LEU 238.A N ILE 234.A O no hydrogen 2.875 N/A LYS 239.A N ARG 235.A O no hydrogen 2.904 N/A LEU 240.A N VAL 236.A O no hydrogen 2.830 N/A TYR 241.A N ILE 237.A O no hydrogen 3.187 N/A TYR 241.A OH ASP 185.A OD2 no hydrogen 2.556 N/A GLU 242.A N LEU 238.A O no hydrogen 3.331 N/A GLN 243.A N LYS 239.A O no hydrogen 2.997 N/A GLN 243.A NE2 GLN 243.A O no hydrogen 2.859 N/A TRP 244.A N LEU 240.A O no hydrogen 2.833 N/A LYS 245.A N TYR 241.A O no hydrogen 3.151 N/A ASN 246.A N GLU 242.A O no hydrogen 3.176 N/A PHE 247.A N TRP 244.A O no hydrogen 3.320 N/A ASP 248.A N GLU 252.A OE2 no hydrogen 3.076 N/A ARG 250.A N.A ASP 248.A OD1 no hydrogen 3.246 N/A LYS 251.A N ASP 248.A OD1 no hydrogen 3.457 N/A GLU 252.A N ASP 248.A O no hydrogen 3.033 N/A MET 253.A N GLU 249.A O no hydrogen 3.088 N/A ILE 256.A N GLU 252.A O no hydrogen 3.126 N/A LEU 257.A N MET 253.A O no hydrogen 2.739 N/A SER 258.A N ALA 254.A O no hydrogen 3.093 N/A SER 258.A OG THR 255.A O no hydrogen 2.682 N/A LYS 259.A N THR 255.A O no hydrogen 3.212 N/A LYS 259.A N ILE 256.A O no hydrogen 3.085 N/A LYS 259.A NZ GLU 39.A OE2 no hydrogen 2.874 N/A MET 260.A N ILE 256.A O no hydrogen 3.223 N/A MET 260.A N LEU 257.A O no hydrogen 3.294 N/A LYS 262.A NZ LEU 257.A O no hydrogen 2.836 N/A LYS 262.A NZ MET 260.A O no hydrogen 2.912 N/A