Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3nic_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A NZ ASN 2.A OD1 no hydrogen 2.818 N/A SER 8.A OG ASP 6.A OD1 no hydrogen 2.738 N/A SER 8.A OG ASP 6.A OD2 no hydrogen 3.339 N/A GLU 9.A N ASP 6.A O no hydrogen 3.407 N/A GLU 9.A N ASP 6.A OD1 no hydrogen 3.078 N/A HIS 10.A N ARG 7.A O no hydrogen 2.982 N/A ASN 14.A ND2 TYR 12.A OH no hydrogen 3.473 N/A SER 16.A N ASN 14.A OD1 no hydrogen 3.051 N/A LEU 18.A N ASP 15.A O no hydrogen 3.203 N/A ILE 21.A N PHE 17.A O no hydrogen 2.997 N/A LYS 22.A N LEU 18.A O no hydrogen 3.022 N/A ASP 23.A N GLU 19.A O no hydrogen 3.036 N/A ALA 24.A N LEU 20.A O no hydrogen 3.230 N/A VAL 25.A N ILE 21.A O no hydrogen 3.011 N/A ARG 26.A N LYS 22.A O no hydrogen 2.932 N/A PHE 27.A N ASP 23.A O no hydrogen 3.065 N/A PHE 28.A N ALA 24.A O no hydrogen 2.780 N/A SER 29.A N VAL 25.A O no hydrogen 3.118 N/A SER 29.A N ARG 26.A O no hydrogen 3.233 N/A GLY 30.A N PHE 27.A O no hydrogen 3.192 N/A THR 31.A N PHE 28.A O no hydrogen 3.166 N/A THR 31.A OG1 PHE 28.A O no hydrogen 2.509 N/A HIS 34.A N CYS 124.A O no hydrogen 2.864 N/A SER 35.A OG PRO 37.A O no hydrogen 3.484 N/A GLY 44.A N GLY 97.A O no hydrogen 3.031 N/A GLY 46.A N ALA 79.A O no hydrogen 2.835 N/A VAL 47.A N VAL 127.A O no hydrogen 2.903 N/A PHE 48.A N GLY 77.A O no hydrogen 3.340 N/A ALA 49.A N ARG 125.A O no hydrogen 2.796 N/A LEU 50.A N TYR 75.A O no hydrogen 2.735 N/A TYR 51.A N SER 123.A O no hydrogen 2.760 N/A THR 53.A N ASP 121.A O no hydrogen 2.810 N/A THR 53.A OG1 ASP 121.A O no hydrogen 3.428 N/A HIS 55.A ND1 ASP 60.A OD2 no hydrogen 2.703 N/A TYR 56.A N TYR 52.A OH no hydrogen 3.131 N/A TYR 59.A N TYR 56.A O no hydrogen 2.818 N/A TYR 59.A OH HIS 180.A NE2 no hydrogen 2.812 N/A ASP 60.A N SER 57.A O no hydrogen 3.387 N/A TYR 62.A N TYR 59.A O no hydrogen 2.996 N/A SER 63.A N ASP 60.A O no hydrogen 2.859 N/A SER 63.A OG ASP 60.A O no hydrogen 2.742 N/A SER 63.A OG ASP 60.A OD2 no hydrogen 3.108 N/A ARG 64.A N GLU 61.A O no hydrogen 2.673 N/A ARG 64.A NE GLU 61.A OE2 no hydrogen 3.010 N/A ILE 65.A N GLU 61.A O no hydrogen 2.710 N/A ASN 66.A N TYR 62.A O no hydrogen 2.649 N/A ASN 66.A ND2 ALA 69.A O no hydrogen 3.567 N/A ARG 67.A N ARG 64.A O no hydrogen 3.231 N/A ASN 71.A ND2 ILE 65.A O no hydrogen 3.219 N/A ILE 74.A N LEU 50.A O no hydrogen 2.733 N/A GLY 77.A N PHE 48.A O no hydrogen 3.152 N/A ALA 79.A N GLY 46.A O no hydrogen 2.823 N/A ALA 82.A N GLU 99.A OE1 no hydrogen 3.168 N/A GLU 99.A N GLU 99.A OE2 no hydrogen 2.752 N/A LEU 100.A N GLY 44.A O no hydrogen 3.063 N/A ASN 102.A N SER 98.A O no hydrogen 3.301 N/A ARG 103.A N GLU 99.A O no hydrogen 2.890 N/A ARG 103.A NH2 GLU 106.A OE2 no hydrogen 3.031 N/A ILE 104.A N LEU 100.A O no hydrogen 2.905 N/A ARG 105.A N SER 101.A O no hydrogen 2.950 N/A GLU 106.A N ASN 102.A O no hydrogen 2.817 N/A HIS 107.A N ARG 103.A O no hydrogen 2.698 N/A GLY 108.A N ILE 104.A O no hydrogen 2.990 N/A ARG 109.A N ARG 105.A O no hydrogen 2.949 N/A ASN 110.A N GLU 106.A O no hydrogen 3.052 N/A ILE 111.A N HIS 107.A O no hydrogen 3.105 N/A ALA 112.A N GLY 108.A O no hydrogen 3.059 N/A LYS 113.A N ARG 109.A O no hydrogen 3.165 N/A LYS 113.A N ASN 110.A O no hydrogen 3.127 N/A LYS 113.A NZ GLU 184.A OE2 no hydrogen 2.659 N/A THR 114.A N ILE 111.A O no hydrogen 2.759 N/A THR 114.A OG1 ILE 111.A O no hydrogen 2.659 N/A SER 115.A N PRO 181.A O no hydrogen 3.184 N/A ASN 116.A ND2 ILE 179.A O no hydrogen 2.997 N/A LEU 117.A N THR 114.A OG1 no hydrogen 3.179 N/A CYS 120.A N ASP 118.A OD2 no hydrogen 3.127 N/A ASP 121.A N ASP 118.A O no hydrogen 2.688 N/A PHE 122.A N LEU 119.A O no hydrogen 3.019 N/A SER 123.A N TYR 51.A O no hydrogen 2.940 N/A CYS 124.A N HIS 34.A O no hydrogen 2.693 N/A CYS 124.A SG SER 35.A O no hydrogen 3.515 N/A ARG 125.A N ALA 49.A O no hydrogen 3.093 N/A ARG 125.A NE THR 31.A O no hydrogen 2.929 N/A ARG 125.A NH1 TYR 51.A OH no hydrogen 2.818 N/A ARG 125.A NH1 TYR 70.A O no hydrogen 3.378 N/A VAL 127.A N VAL 47.A O no hydrogen 2.692 N/A PHE 129.A N ALA 45.A O no hydrogen 3.030 N/A SER 134.A N GLU 130.A O no hydrogen 2.894 N/A SER 134.A OG ALA 131.A O no hydrogen 3.125 N/A ASP 135.A N THR 132.A O no hydrogen 3.195 N/A MET 136.A N GLY 133.A O no hydrogen 2.678 N/A ILE 137.A N SER 134.A O no hydrogen 3.156 N/A VAL 140.A N MET 136.A O no hydrogen 3.007 N/A GLU 141.A N ILE 137.A O no hydrogen 3.024 N/A ALA 142.A N SER 138.A O no hydrogen 2.885 N/A ALA 143.A N THR 139.A O no hydrogen 3.095 N/A LEU 144.A N VAL 140.A O no hydrogen 2.868 N/A ILE 145.A N GLU 141.A O no hydrogen 3.070 N/A LYS 146.A N ALA 142.A O no hydrogen 2.728 N/A ILE 147.A N ALA 143.A O no hydrogen 2.846 N/A TYR 148.A N LEU 144.A O no hydrogen 2.936 N/A LYS 149.A N ILE 145.A O no hydrogen 2.852 N/A TRP 152.A N ILE 74.A O no hydrogen 3.075 N/A TRP 152.A NE1 TYR 59.A OH no hydrogen 2.912 N/A ASN 153.A N PRO 150.A O no hydrogen 2.664 N/A ASN 153.A ND2 VAL 76.A O no hydrogen 3.345 N/A THR 154.A N LEU 151.A O no hydrogen 3.380 N/A THR 154.A OG1 LYS 149.A O no hydrogen 3.076 N/A THR 154.A OG1 PRO 150.A O no hydrogen 3.080 N/A VAL 155.A N LEU 151.A O no hydrogen 3.068 N/A VAL 156.A N LEU 151.A O no hydrogen 2.897 N/A ASN 161.A N GLY 158.A O no hydrogen 3.360 N/A ARG 168.A N GLY 165.A O no hydrogen 3.018 N/A GLN 171.A N ARG 168.A O no hydrogen 3.096 N/A LYS 173.A NZ GLU 187.A OE2 no hydrogen 3.164 N/A SER 174.A OG ASP 177.A OD2 no hydrogen 2.428 N/A TRP 176.A N ASP 157.A O no hydrogen 2.982 N/A ASP 177.A N SER 174.A OG no hydrogen 3.253 N/A VAL 178.A N SER 174.A O no hydrogen 2.921 N/A ILE 179.A N ASP 175.A O no hydrogen 3.161 N/A HIS 180.A N TRP 176.A O no hydrogen 3.001 N/A HIS 180.A ND1 ASN 116.A OD1 no hydrogen 2.742 N/A HIS 180.A NE2 TYR 59.A OH no hydrogen 2.812 N/A ARG 183.A NH1 GLY 158.A O no hydrogen 3.498 N/A ARG 183.A NH1 ASP 177.A OD1 no hydrogen 2.774 N/A ARG 183.A NH2 GLY 158.A O no hydrogen 3.215 N/A ALA 186.A N ARG 183.A O no hydrogen 2.853 N/A GLU 187.A N ARG 183.A O no hydrogen 3.356 N/A GLU 187.A N GLU 184.A O no hydrogen 2.600 N/A LYS 188.A N TRP 185.A O no hydrogen 3.140 N/A CYS 189.A SG TRP 185.A O no hydrogen 3.456 N/A THR 190.A N PHE 169.A O no hydrogen 3.015 N/A GLY 191.A N GLN 171.A O no hydrogen 2.776 N/A HIS 193.A ND1 SER 194.A O no hydrogen 2.858 N/A SER 194.A OG ASP 175.A OD2 no hydrogen 2.347 N/A PHE 198.A N GLU 195.A O no hydrogen 2.858 N/A GLU 200.A N PRO 196.A O no hydrogen 3.049 N/A GLU 201.A N TYR 197.A O no hydrogen 2.918 N/A ARG 202.A N PHE 198.A O no hydrogen 2.910 N/A ILE 203.A N ILE 199.A O no hydrogen 2.906 N/A LYS 204.A N GLU 200.A O no hydrogen 3.014 N/A GLN 205.A N GLU 201.A O no hydrogen 3.044 N/A TYR 206.A N ARG 202.A O no hydrogen 3.155 N/A TYR 206.A OH LYS 149.A O no hydrogen 2.786 N/A PHE 207.A N ILE 203.A O no hydrogen 3.346 N/A PHE 207.A N LYS 204.A O no hydrogen 3.071 N/A SER 208.A N GLN 205.A O no hydrogen 2.988 N/A SER 208.A OG GLN 205.A O no hydrogen 2.778 N/A