Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3e3a_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 3.A N LEU 16.A O no hydrogen 2.960 N/A GLY 5.A N ILE 14.A O no hydrogen 2.784 N/A ALA 6.A N ASP 80.A OD1 no hydrogen 2.713 N/A ASP 8.A N ARG 12.A O no hydrogen 3.198 N/A GLU 10.A N ASP 8.A OD1 no hydrogen 3.072 N/A PHE 11.A N ASP 8.A O no hydrogen 2.694 N/A ARG 12.A N ASP 8.A OD1 no hydrogen 3.104 N/A LEU 16.A N PHE 3.A O no hydrogen 2.907 N/A TYR 18.A N LEU 1.A O no hydrogen 3.076 N/A ASP 19.A N THR 57.A O no hydrogen 2.780 N/A ASN 21.A N CYS 55.A O no hydrogen 3.197 N/A VAL 27.A N ARG 54.A O no hydrogen 2.574 N/A VAL 28.A N ARG 94.A O no hydrogen 2.859 N/A PHE 29.A N ILE 56.A O no hydrogen 2.936 N/A ILE 30.A N VAL 96.A O no hydrogen 2.753 N/A ARG 33.A NE LEU 192.A O no hydrogen 3.104 N/A ARG 33.A NH1 GLU 139.A OE2 no hydrogen 3.137 N/A GLY 35.A N GLY 32.A O no hydrogen 2.799 N/A GLY 37.A N ASP 59.A OD1 no hydrogen 2.789 N/A THR 39.A N ALA 36.A O no hydrogen 3.042 N/A THR 39.A OG1 ALA 36.A O no hydrogen 3.030 N/A TRP 40.A N GLY 37.A O no hydrogen 3.301 N/A HIS 41.A N ARG 38.A O no hydrogen 2.978 N/A HIS 41.A NE2 THR 57.A OG1 no hydrogen 2.946 N/A GLN 44.A N TRP 40.A O no hydrogen 2.984 N/A GLN 44.A NE2 PHE 254.A O no hydrogen 3.173 N/A GLN 44.A NE2 ASN 262.A OD1 no hydrogen 2.908 N/A VAL 45.A N TRP 40.A O no hydrogen 2.902 N/A PHE 48.A N GLN 44.A O no hydrogen 2.924 N/A LEU 49.A N VAL 45.A O no hydrogen 2.681 N/A ALA 50.A N PRO 46.A O no hydrogen 3.054 N/A ALA 51.A N ALA 47.A O no hydrogen 2.995 N/A GLY 52.A N LEU 49.A O no hydrogen 2.815 N/A TYR 53.A N PHE 48.A O no hydrogen 2.979 N/A ARG 54.A N ASP 25.A O no hydrogen 2.738 N/A ARG 54.A NE ASP 20.A OD1 no hydrogen 2.921 N/A ARG 54.A NH2 ASP 20.A OD1 no hydrogen 3.566 N/A ARG 54.A NH2 ASP 20.A OD2 no hydrogen 2.625 N/A CYS 55.A N ASN 21.A O no hydrogen 3.198 N/A ILE 56.A N VAL 27.A O no hydrogen 2.762 N/A THR 57.A N ASP 19.A O no hydrogen 3.071 N/A THR 57.A OG1 HIS 41.A NE2 no hydrogen 2.946 N/A ASP 59.A N ALA 17.A O no hydrogen 2.999 N/A ASN 60.A ND2 ALA 31.A O no hydrogen 2.998 N/A ARG 61.A NE ASP 80.A OD2 no hydrogen 2.735 N/A ARG 61.A NH2 ALA 6.A O no hydrogen 2.796 N/A ARG 61.A NH2 ASP 80.A OD1 no hydrogen 2.702 N/A ARG 61.A NH2 ASP 80.A OD2 no hydrogen 3.174 N/A GLY 62.A N THR 66.A OG1 no hydrogen 2.775 N/A ILE 63.A N ASN 60.A O no hydrogen 3.080 N/A THR 66.A N ILE 63.A O no hydrogen 3.011 N/A THR 66.A OG1 ILE 63.A O no hydrogen 3.385 N/A GLU 67.A N GLY 64.A O no hydrogen 2.874 N/A ALA 69.A N THR 66.A O no hydrogen 2.958 N/A THR 73.A N THR 76.A OG1 no hydrogen 2.993 N/A THR 73.A OG1 THR 76.A OG1 no hydrogen 3.097 N/A THR 76.A N THR 73.A OG1 no hydrogen 3.326 N/A THR 76.A OG1 THR 73.A O no hydrogen 3.224 N/A THR 76.A OG1 THR 73.A OG1 no hydrogen 3.097 N/A MET 77.A N THR 73.A O no hydrogen 3.131 N/A VAL 78.A N THR 74.A O no hydrogen 2.825 N/A ALA 79.A N GLN 75.A O no hydrogen 2.875 N/A ASP 80.A N THR 76.A O no hydrogen 2.983 N/A THR 81.A N MET 77.A O no hydrogen 2.991 N/A THR 81.A OG1 MET 77.A O no hydrogen 2.693 N/A ALA 82.A N VAL 78.A O no hydrogen 2.840 N/A ALA 83.A N ALA 79.A O no hydrogen 2.779 N/A LEU 84.A N ASP 80.A O no hydrogen 3.124 N/A ILE 85.A N THR 81.A O no hydrogen 3.230 N/A GLU 86.A N ALA 82.A O no hydrogen 2.877 N/A THR 87.A N ALA 83.A O no hydrogen 2.683 N/A THR 87.A OG1 ALA 83.A O no hydrogen 2.559 N/A LEU 88.A N LEU 84.A O no hydrogen 2.936 N/A ASP 89.A N GLU 86.A O no hydrogen 2.724 N/A ILE 90.A N ILE 85.A O no hydrogen 3.250 N/A ALA 93.A N LEU 115.A O no hydrogen 2.890 N/A ARG 94.A N PRO 26.A O no hydrogen 3.168 N/A ARG 94.A NH1 ASP 25.A OD2 no hydrogen 2.783 N/A ARG 94.A NH2 PHE 269.A O no hydrogen 2.766 N/A VAL 95.A N SER 118.A O no hydrogen 2.991 N/A VAL 96.A N VAL 28.A O no hydrogen 2.846 N/A GLY 97.A N VAL 120.A O no hydrogen 3.113 N/A VAL 98.A N ILE 30.A O no hydrogen 3.301 N/A SER 99.A N MET 122.A O no hydrogen 2.806 N/A SER 99.A OG ALA 123.A O no hydrogen 2.756 N/A GLY 101.A N VAL 98.A O no hydrogen 2.850 N/A PHE 103.A N SER 99.A O no hydrogen 2.953 N/A ILE 104.A N MET 100.A O no hydrogen 3.076 N/A ALA 105.A N GLY 101.A O no hydrogen 3.072 N/A GLN 106.A N ALA 102.A O no hydrogen 2.929 N/A GLU 107.A N PHE 103.A O no hydrogen 2.849 N/A LEU 108.A N ILE 104.A O no hydrogen 2.684 N/A MET 109.A N ALA 105.A O no hydrogen 2.823 N/A VAL 110.A N GLN 106.A O no hydrogen 3.087 N/A VAL 111.A N GLU 107.A O no hydrogen 3.353 N/A ALA 112.A N LEU 108.A O no hydrogen 2.837 N/A GLU 114.A N GLU 114.A OE1 no hydrogen 2.765 N/A LEU 115.A N ALA 112.A O no hydrogen 2.821 N/A VAL 116.A N PRO 113.A O no hydrogen 3.128 N/A SER 117.A N ALA 93.A O no hydrogen 3.031 N/A SER 117.A OG SER 118.A OG no hydrogen 3.361 N/A SER 118.A OG SER 117.A OG no hydrogen 3.361 N/A ALA 119.A N PRO 214.A O no hydrogen 3.225 N/A VAL 120.A N VAL 95.A O no hydrogen 2.807 N/A LEU 121.A N LEU 216.A O no hydrogen 2.751 N/A MET 122.A N GLY 97.A O no hydrogen 2.958 N/A ALA 123.A N ILE 218.A O no hydrogen 2.977 N/A THR 124.A OG1 ARG 125.A O no hydrogen 3.552 N/A ARG 125.A N THR 124.A OG1 no hydrogen 2.739 N/A ARG 127.A NE GLU 233.A OE1 no hydrogen 2.631 N/A ARG 127.A NH2 GLU 233.A OE1 no hydrogen 3.361 N/A ARG 127.A NH2 GLU 233.A OE2 no hydrogen 2.721 N/A ARG 132.A N ASP 129.A OD1 no hydrogen 3.051 N/A ARG 132.A NE ASP 129.A OD1 no hydrogen 2.742 N/A ARG 132.A NH1 VAL 224.A O no hydrogen 2.815 N/A ARG 132.A NH2 ASP 129.A OD1 no hydrogen 3.493 N/A ARG 132.A NH2 ASP 129.A OD2 no hydrogen 2.727 N/A GLN 133.A N ASP 129.A O no hydrogen 2.954 N/A GLN 133.A NE2 GLN 133.A O no hydrogen 3.639 N/A PHE 134.A N ARG 130.A O no hydrogen 3.160 N/A PHE 135.A N ALA 131.A O no hydrogen 2.810 N/A ASN 136.A N ARG 132.A O no hydrogen 2.997 N/A ASN 136.A ND2 LEU 196.A O no hydrogen 3.236 N/A LYS 137.A N GLN 133.A O no hydrogen 2.996 N/A ALA 138.A N PHE 134.A O no hydrogen 2.872 N/A GLU 139.A N PHE 135.A O no hydrogen 2.853 N/A ALA 140.A N ASN 136.A O no hydrogen 3.143 N/A GLU 141.A N LYS 137.A O no hydrogen 3.113 N/A LEU 142.A N ALA 138.A O no hydrogen 2.990 N/A TYR 143.A N GLU 139.A O no hydrogen 3.112 N/A ASP 144.A N ALA 140.A O no hydrogen 2.907 N/A SER 145.A N LEU 142.A O no hydrogen 3.178 N/A SER 145.A OG GLU 141.A O no hydrogen 3.151 N/A SER 145.A OG LEU 142.A O no hydrogen 2.893 N/A GLY 146.A N TYR 143.A O no hydrogen 2.988 N/A ASP 154.A N PRO 150.A O no hydrogen 2.972 N/A ALA 155.A N PRO 151.A O no hydrogen 2.970 N/A ARG 156.A N THR 152.A O no hydrogen 2.750 N/A ALA 157.A N TYR 153.A O no hydrogen 2.980 N/A ARG 158.A N ASP 154.A O no hydrogen 3.114 N/A ARG 158.A NH1 PHE 181.A O no hydrogen 3.558 N/A ARG 158.A NH1 TRP 184.A O no hydrogen 3.356 N/A ARG 158.A NH2 TRP 184.A O no hydrogen 2.862 N/A LEU 159.A N ALA 155.A O no hydrogen 2.892 N/A LEU 160.A N ARG 156.A O no hydrogen 2.964 N/A GLU 161.A N ALA 157.A O no hydrogen 2.987 N/A ASN 162.A ND2 ARG 158.A O no hydrogen 2.824 N/A SER 164.A N GLU 256.A OE1 no hydrogen 2.916 N/A SER 164.A OG THR 167.A OG1 no hydrogen 3.203 N/A SER 164.A OG ASP 248.A O no hydrogen 3.180 N/A SER 164.A OG GLU 256.A OE1 no hydrogen 2.710 N/A ARG 165.A N ASP 222.A OD2 no hydrogen 3.064 N/A THR 167.A N SER 164.A OG no hydrogen 3.142 N/A THR 167.A OG1 SER 164.A OG no hydrogen 3.203 N/A THR 167.A OG1 GLU 256.A OE1 no hydrogen 2.559 N/A LEU 168.A N SER 164.A O no hydrogen 3.022 N/A ASN 169.A N ARG 165.A O no hydrogen 2.899 N/A ASP 170.A N THR 167.A O no hydrogen 3.092 N/A ALA 173.A N ASP 170.A OD1 no hydrogen 2.973 N/A VAL 174.A N ASP 170.A O no hydrogen 2.850 N/A GLY 175.A N ASP 171.A O no hydrogen 3.033 N/A ASP 176.A N VAL 172.A O no hydrogen 3.094 N/A TRP 177.A N ALA 173.A O no hydrogen 2.830 N/A ILE 178.A N VAL 174.A O no hydrogen 2.994 N/A ALA 179.A N GLY 175.A O no hydrogen 3.085 N/A MET 180.A N ASP 176.A O no hydrogen 2.812 N/A PHE 181.A N TRP 177.A O no hydrogen 2.889 N/A PHE 181.A N ILE 178.A O no hydrogen 3.112 N/A SER 182.A N ALA 179.A O no hydrogen 2.844 N/A MET 183.A N MET 180.A O no hydrogen 3.166 N/A TRP 184.A N PHE 181.A O no hydrogen 3.185 N/A LYS 187.A NZ GLU 67.A OE2 no hydrogen 2.735 N/A THR 189.A OG1 GLU 67.A O no hydrogen 3.294 N/A GLY 191.A N GLU 67.A O no hydrogen 2.817 N/A LEU 192.A N THR 189.A OG1 no hydrogen 2.875 N/A ARG 193.A N THR 189.A O no hydrogen 3.112 N/A ARG 193.A NE ASP 144.A OD1 no hydrogen 2.852 N/A ARG 193.A NE ASP 144.A OD2 no hydrogen 3.510 N/A ARG 193.A NH1 ARG 193.A O no hydrogen 3.150 N/A ARG 193.A NH1 ASP 197.A OD2 no hydrogen 2.882 N/A ARG 193.A NH2 ASP 144.A OD2 no hydrogen 3.113 N/A CYS 194.A N PRO 190.A O no hydrogen 2.864 N/A CYS 194.A SG PHE 72.A O no hydrogen 3.262 N/A GLN 195.A N GLY 191.A O no hydrogen 3.015 N/A LEU 196.A N LEU 192.A O no hydrogen 3.373 N/A LEU 196.A N ARG 193.A O no hydrogen 3.209 N/A ASP 197.A N CYS 194.A O no hydrogen 2.951 N/A CYS 198.A N GLN 195.A O no hydrogen 3.055 N/A CYS 198.A SG CYS 194.A O no hydrogen 3.779 N/A ARG 204.A N GLY 126.A O no hydrogen 2.918 N/A ARG 204.A NE GLU 107.A OE1 no hydrogen 3.182 N/A ARG 204.A NE GLU 107.A OE2 no hydrogen 2.875 N/A ARG 204.A NH2 GLU 107.A OE1 no hydrogen 2.805 N/A LEU 205.A N ASN 203.A OD1 no hydrogen 2.853 N/A ALA 207.A N ARG 204.A O no hydrogen 3.206 N/A TYR 208.A N LEU 205.A O no hydrogen 2.942 N/A TYR 208.A OH GLN 106.A OE1 no hydrogen 3.078 N/A TYR 208.A OH GLU 107.A OE2 no hydrogen 2.472 N/A ARG 209.A N PRO 206.A O no hydrogen 2.972 N/A ASN 210.A N ALA 207.A O no hydrogen 3.402 N/A ILE 211.A N TYR 208.A O no hydrogen 3.175 N/A VAL 215.A N ASN 240.A O no hydrogen 3.118 N/A LEU 216.A N ALA 119.A O no hydrogen 2.947 N/A VAL 217.A N ARG 242.A O no hydrogen 2.974 N/A ILE 218.A N LEU 121.A O no hydrogen 2.725 N/A GLY 219.A N LEU 244.A O no hydrogen 2.899 N/A ALA 221.A N ILE 246.A O no hydrogen 2.998 N/A ASP 222.A N ALA 249.A O no hydrogen 2.761 N/A ASP 223.A N PHE 220.A O no hydrogen 2.927 N/A VAL 225.A N ASP 223.A OD1 no hydrogen 2.949 N/A THR 226.A N ASP 223.A OD1 no hydrogen 2.876 N/A THR 226.A OG1 ASP 223.A OD1 no hydrogen 3.459 N/A THR 226.A OG1 ASP 223.A OD2 no hydrogen 2.900 N/A THR 226.A OG1 THR 226.A O no hydrogen 2.592 N/A THR 226.A OG1 HIS 251.A ND1 no hydrogen 3.225 N/A TYR 229.A OH ASP 129.A OD2 no hydrogen 2.803 N/A LEU 230.A N PRO 227.A O no hydrogen 3.111 N/A ARG 232.A N PRO 228.A O no hydrogen 2.804 N/A GLU 233.A N TYR 229.A O no hydrogen 3.193 N/A VAL 234.A N LEU 230.A O no hydrogen 3.301 N/A ALA 235.A N GLY 231.A O no hydrogen 3.149 N/A ASP 236.A N ARG 232.A O no hydrogen 2.980 N/A ASP 236.A N GLU 233.A O no hydrogen 3.200 N/A ALA 237.A N GLU 233.A O no hydrogen 3.234 N/A LEU 238.A N VAL 234.A O no hydrogen 3.065 N/A ASN 240.A ND2 ALA 212.A O no hydrogen 2.621 N/A GLY 241.A N LEU 238.A O no hydrogen 3.114 N/A ARG 242.A N VAL 215.A O no hydrogen 2.853 N/A LEU 244.A N VAL 217.A O no hydrogen 3.014 N/A GLN 245.A NE2 TYR 243.A OH no hydrogen 2.667 N/A ILE 246.A N GLY 219.A O no hydrogen 2.881 N/A GLY 250.A N GLU 256.A OE2 no hydrogen 2.807 N/A HIS 251.A ND1 ASP 223.A OD1 no hydrogen 3.044 N/A HIS 251.A ND1 ASP 223.A OD2 no hydrogen 3.029 N/A LEU 252.A N ASN 162.A O no hydrogen 3.053 N/A PHE 255.A N LEU 252.A O no hydrogen 2.979 N/A GLU 256.A N LEU 252.A O no hydrogen 3.076 N/A GLU 256.A N GLY 253.A O no hydrogen 3.180 N/A ARG 257.A N GLY 253.A O no hydrogen 2.684 N/A ARG 257.A NE ASP 248.A O no hydrogen 2.989 N/A ARG 257.A NH1 SER 164.A OG no hydrogen 3.406 N/A ARG 257.A NH1 ASP 248.A O no hydrogen 3.309 N/A VAL 261.A N ARG 257.A O no hydrogen 3.125 N/A ASN 262.A N PRO 258.A O no hydrogen 2.933 N/A ASN 262.A ND2 HIS 43.A O no hydrogen 2.929 N/A THR 263.A N GLU 259.A O no hydrogen 2.970 N/A THR 263.A OG1 GLU 259.A O no hydrogen 2.844 N/A ALA 264.A N ALA 260.A O no hydrogen 3.216 N/A MET 265.A N VAL 261.A O no hydrogen 2.970 N/A LEU 266.A N ASN 262.A O no hydrogen 2.844 N/A LYS 267.A N THR 263.A O no hydrogen 2.970 N/A PHE 268.A N ALA 264.A O no hydrogen 2.962 N/A PHE 269.A N MET 265.A O no hydrogen 2.860 N/A ALA 270.A N LEU 266.A O no hydrogen 2.814 N/A SER 271.A N PHE 268.A O no hydrogen 2.935 N/A SER 271.A OG PHE 268.A O no hydrogen 2.587 N/A