Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4q1i_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 4.A N LEU 13.A O no hydrogen 2.855 N/A MET 6.A N VAL 11.A O no hydrogen 2.848 N/A THR 7.A N GLN 44.A OE1 no hydrogen 2.904 N/A HIS 8.A N ASP 41.A OD1 no hydrogen 2.945 N/A HIS 8.A NE2 ASP 40.A OD2 no hydrogen 3.006 N/A SER 9.A N MET 6.A O no hydrogen 2.653 N/A VAL 10.A N ASP 41.A OD2 no hydrogen 2.853 N/A GLU 12.A N LYS 24.A O no hydrogen 3.016 N/A LEU 13.A N GLY 4.A O no hydrogen 2.674 N/A ILE 14.A N GLN 22.A O no hydrogen 2.928 N/A GLU 15.A N PHE 2.A O no hydrogen 2.949 N/A ILE 16.A N ILE 20.A O no hydrogen 2.889 N/A ILE 20.A N GLU 17.A O no hydrogen 3.166 N/A ILE 21.A N ALA 57.A O no hydrogen 3.030 N/A GLN 22.A N ILE 14.A O no hydrogen 2.771 N/A VAL 23.A N ILE 59.A O no hydrogen 2.910 N/A LYS 24.A N GLU 12.A O no hydrogen 2.920 N/A MET 25.A N THR 61.A O no hydrogen 2.829 N/A GLN 26.A N VAL 10.A O no hydrogen 2.597 N/A HIS 30.A N ASP 27.A O no hydrogen 3.203 N/A HIS 30.A N ASP 27.A OD1 no hydrogen 3.003 N/A ASN 32.A N ASP 27.A O no hydrogen 2.845 N/A ALA 33.A N HIS 30.A O no hydrogen 2.810 N/A PHE 34.A N GLY 70.A O no hydrogen 2.937 N/A SER 35.A N ALA 33.A O no hydrogen 2.709 N/A SER 35.A OG ASP 27.A OD2 no hydrogen 2.796 N/A LEU 38.A N SER 35.A OG no hydrogen 3.174 N/A THR 39.A N SER 35.A O no hydrogen 2.903 N/A THR 39.A OG1 SER 35.A O no hydrogen 2.770 N/A ASP 40.A N GLN 36.A O no hydrogen 2.737 N/A ASP 41.A N GLU 37.A O no hydrogen 2.771 N/A LEU 42.A N LEU 38.A O no hydrogen 2.968 N/A ILE 43.A N THR 39.A O no hydrogen 3.193 N/A GLN 44.A N ASP 40.A O no hydrogen 3.063 N/A ALA 45.A N ASP 41.A O no hydrogen 2.928 N/A PHE 46.A N LEU 42.A O no hydrogen 3.095 N/A GLU 47.A N ILE 43.A O no hydrogen 2.706 N/A TYR 48.A N GLN 44.A O no hydrogen 2.677 N/A ILE 49.A N ALA 45.A O no hydrogen 2.955 N/A ARG 50.A N PHE 46.A O no hydrogen 2.969 N/A ARG 50.A NH1 GLU 47.A OE1 no hydrogen 3.428 N/A GLN 51.A N GLU 47.A O no hydrogen 2.961 N/A GLN 51.A N TYR 48.A O no hydrogen 3.059 N/A ASN 52.A N ILE 49.A O no hydrogen 3.170 N/A ASN 52.A ND2 TYR 48.A OH no hydrogen 3.430 N/A LYS 54.A N ASN 52.A O no hydrogen 2.683 N/A LYS 54.A NZ GLU 15.A OE1 no hydrogen 3.115 N/A LYS 54.A NZ GLU 15.A OE2 no hydrogen 2.960 N/A TYR 55.A OH GLU 15.A OE2 no hydrogen 2.430 N/A LYS 56.A N ALA 19.A O no hydrogen 2.644 N/A LYS 56.A NZ ALA 188.A O no hydrogen 3.095 N/A LYS 56.A NZ LYS 190.A O no hydrogen 2.856 N/A ALA 57.A N ALA 19.A O no hydrogen 3.185 N/A VAL 58.A N PRO 87.A O no hydrogen 3.083 N/A ILE 59.A N ILE 21.A O no hydrogen 2.772 N/A LEU 60.A N ILE 89.A O no hydrogen 2.696 N/A THR 61.A N VAL 23.A O no hydrogen 2.786 N/A THR 61.A OG1 ALA 91.A O no hydrogen 3.054 N/A THR 61.A OG1 GLN 93.A OE1 no hydrogen 3.004 N/A GLY 62.A N GLN 93.A OE1 no hydrogen 3.186 N/A TYR 63.A N TYR 66.A O no hydrogen 3.006 N/A TYR 66.A N TYR 63.A O no hydrogen 2.815 N/A PHE 67.A N HIS 95.A O no hydrogen 2.909 N/A ALA 68.A N HIS 95.A O no hydrogen 3.031 N/A SER 69.A N ASN 32.A O no hydrogen 2.895 N/A SER 69.A OG LYS 31.A O no hydrogen 2.654 N/A GLY 75.A N THR 72.A OG1 no hydrogen 3.080 N/A ASN 76.A ND2 SER 79.A OG no hydrogen 3.199 N/A SER 79.A OG ASP 83.A OD2 no hydrogen 3.407 N/A LEU 80.A N LEU 77.A O no hydrogen 3.041 N/A ASP 83.A N SER 79.A O no hydrogen 2.727 N/A CYS 84.A N LEU 80.A O no hydrogen 2.974 N/A CYS 84.A SG ILE 86.A O no hydrogen 3.628 N/A VAL 88.A N ASP 108.A OD2 no hydrogen 2.764 N/A ILE 89.A N VAL 58.A O no hydrogen 2.744 N/A ALA 90.A N ILE 109.A O no hydrogen 2.777 N/A ALA 91.A N LEU 60.A O no hydrogen 3.014 N/A MET 92.A N ILE 111.A O no hydrogen 2.912 N/A GLN 93.A N ALA 91.A O no hydrogen 2.979 N/A GLN 93.A N GLN 93.A OE1 no hydrogen 2.874 N/A GLN 93.A NE2 ASP 64.A O no hydrogen 2.830 N/A GLN 93.A NE2 TYR 66.A O no hydrogen 2.981 N/A HIS 95.A N ASN 65.A O no hydrogen 2.852 N/A GLY 96.A N VAL 117.A O no hydrogen 2.941 N/A ILE 97.A N ALA 68.A O no hydrogen 2.949 N/A GLY 98.A N THR 119.A O no hydrogen 2.640 N/A GLY 100.A N ILE 97.A O no hydrogen 2.988 N/A PHE 101.A N GLY 98.A O no hydrogen 2.951 N/A VAL 102.A N GLY 98.A O no hydrogen 3.082 N/A MET 103.A N GLY 99.A O no hydrogen 2.950 N/A GLY 104.A N PHE 101.A O no hydrogen 3.084 N/A PHE 106.A N MET 103.A O no hydrogen 3.405 N/A ALA 107.A N GLY 104.A O no hydrogen 3.112 N/A ILE 109.A N VAL 88.A O no hydrogen 3.154 N/A ILE 111.A N ALA 90.A O no hydrogen 2.973 N/A LEU 112.A N LYS 169.A O no hydrogen 2.847 N/A SER 113.A N TYR 118.A OH no hydrogen 2.943 N/A SER 113.A OG MET 92.A O no hydrogen 3.149 N/A SER 113.A OG SER 116.A OG no hydrogen 2.829 N/A SER 113.A OG TYR 118.A OH no hydrogen 3.052 N/A ARG 114.A N LEU 171.A O no hydrogen 2.697 N/A ARG 114.A NE GLU 162.A OE1 no hydrogen 2.898 N/A ARG 114.A NH2 GLU 162.A OE1 no hydrogen 3.450 N/A ARG 114.A NH2 GLU 162.A OE2 no hydrogen 3.235 N/A GLU 115.A N GLU 115.A OE1 no hydrogen 2.678 N/A SER 116.A N SER 113.A O no hydrogen 3.364 N/A SER 116.A OG GLN 93.A O no hydrogen 3.414 N/A SER 116.A OG SER 113.A OG no hydrogen 2.829 N/A TYR 118.A N TYR 156.A O no hydrogen 2.639 N/A TYR 118.A OH MET 92.A O no hydrogen 2.683 N/A TYR 118.A OH SER 113.A OG no hydrogen 3.052 N/A THR 119.A N GLY 96.A O no hydrogen 3.045 N/A THR 119.A OG1 ALA 153.A O no hydrogen 3.329 N/A THR 119.A OG1 GLY 154.A O no hydrogen 2.877 N/A LYS 124.A N ASN 121.A O no hydrogen 2.917 N/A TYR 125.A N PHE 122.A O no hydrogen 2.894 N/A GLY 126.A N MET 123.A O no hydrogen 3.056 N/A THR 134.A N GLY 130.A O no hydrogen 3.239 N/A THR 134.A OG1 GLY 130.A O no hydrogen 3.035 N/A PHE 135.A N MET 131.A O no hydrogen 3.329 N/A ILE 136.A N GLY 132.A O no hydrogen 2.933 N/A VAL 137.A N ALA 133.A O no hydrogen 2.998 N/A LYS 140.A N ILE 136.A O no hydrogen 2.931 N/A LYS 140.A NZ ALA 107.A O no hydrogen 2.652 N/A LYS 140.A NZ ASP 108.A O no hydrogen 3.462 N/A LEU 141.A N VAL 137.A O no hydrogen 2.834 N/A ALA 146.A N GLY 142.A O no hydrogen 3.013 N/A GLN 147.A N PHE 143.A O no hydrogen 2.965 N/A GLU 148.A N SER 144.A O no hydrogen 3.430 N/A ILE 149.A N LEU 145.A O no hydrogen 2.942 N/A LEU 150.A N ALA 146.A O no hydrogen 2.881 N/A LEU 151.A N GLN 147.A O no hydrogen 2.925 N/A ASN 152.A N GLU 148.A O no hydrogen 3.063 N/A ALA 153.A N ILE 149.A O no hydrogen 3.136 N/A TYR 156.A N TYR 118.A O no hydrogen 2.778 N/A TYR 156.A OH GLU 148.A OE2 no hydrogen 2.574 N/A ARG 157.A N ASP 160.A OD2 no hydrogen 3.146 N/A ARG 157.A NH1 GLU 115.A O no hydrogen 2.883 N/A GLY 158.A N SER 116.A O no hydrogen 2.878 N/A ALA 159.A N ARG 114.A O no hydrogen 3.020 N/A ASP 160.A N ARG 157.A O no hydrogen 2.965 N/A LEU 161.A N ARG 157.A O no hydrogen 3.176 N/A GLU 162.A N GLY 158.A O no hydrogen 2.863 N/A LYS 163.A N ALA 159.A O no hydrogen 2.956 N/A ARG 164.A N ASP 160.A O no hydrogen 2.901 N/A ARG 164.A NH1 GLU 148.A OE1 no hydrogen 3.299 N/A ARG 164.A NH1 GLU 148.A OE2 no hydrogen 2.959 N/A ARG 164.A NH2 GLU 148.A OE1 no hydrogen 2.651 N/A GLY 165.A N GLU 162.A O no hydrogen 3.132 N/A LEU 171.A N LEU 112.A O no hydrogen 3.004 N/A ARG 173.A N GLU 115.A OE1 no hydrogen 2.728 N/A ARG 173.A NE GLN 93.A O no hydrogen 2.934 N/A ARG 173.A NH2 SER 116.A OG no hydrogen 2.760 N/A GLU 175.A N PRO 172.A O no hydrogen 2.843 N/A VAL 176.A N ARG 173.A O no hydrogen 2.959 N/A TYR 179.A N GLU 175.A O no hydrogen 2.991 N/A ALA 180.A N VAL 176.A O no hydrogen 2.825 N/A VAL 181.A N LEU 177.A O no hydrogen 2.878 N/A GLU 182.A N ASP 178.A O no hydrogen 3.025 N/A LEU 183.A N TYR 179.A O no hydrogen 2.863 N/A ALA 184.A N ALA 180.A O no hydrogen 2.784 N/A GLN 185.A N VAL 181.A O no hydrogen 2.709 N/A GLN 185.A NE2 GLU 17.A OE2 no hydrogen 2.960 N/A GLU 186.A N GLU 182.A O no hydrogen 3.056 N/A LEU 187.A N LEU 183.A O no hydrogen 2.973 N/A ALA 188.A N ALA 184.A O no hydrogen 2.872 N/A GLU 189.A N GLU 186.A O no hydrogen 3.173 N/A LYS 190.A N LEU 187.A O no hydrogen 2.979 N/A LYS 190.A NZ GLU 186.A O no hydrogen 2.828 N/A ARG 192.A NE TYR 55.A O no hydrogen 2.795 N/A ARG 192.A NH2 GLU 85.A OE2 no hydrogen 3.035 N/A SER 194.A N PRO 191.A O no hydrogen 3.130 N/A LEU 195.A N PRO 191.A O no hydrogen 3.295 N/A VAL 196.A N ARG 192.A O no hydrogen 3.170 N/A THR 197.A N ASN 193.A O no hydrogen 3.078 N/A THR 197.A OG1 ASN 193.A O no hydrogen 2.799 N/A LEU 198.A N SER 194.A O no hydrogen 2.973 N/A LYS 199.A N LEU 195.A O no hydrogen 2.851 N/A LYS 199.A NZ ALA 81.A O no hydrogen 2.852 N/A LYS 199.A NZ CYS 84.A O no hydrogen 3.038 N/A LYS 199.A NZ ILE 86.A O no hydrogen 2.914 N/A LYS 199.A NZ ASP 108.A OD2 no hydrogen 2.674 N/A ASP 200.A N VAL 196.A O no hydrogen 2.741 N/A HIS 201.A N THR 197.A O no hydrogen 2.978 N/A LEU 202.A N LEU 198.A O no hydrogen 2.920 N/A VAL 203.A N LYS 199.A O no hydrogen 2.841 N/A ARG 207.A N VAL 203.A O no hydrogen 2.995 N/A ARG 207.A NE LEU 82.A O no hydrogen 2.998 N/A ARG 207.A NH1 ASP 200.A OD1 no hydrogen 3.064 N/A ARG 207.A NH2 LEU 82.A O no hydrogen 2.953 N/A ASP 208.A N ALA 204.A O no hydrogen 2.753 N/A GLN 209.A N PRO 205.A O no hydrogen 2.845 N/A LEU 210.A N LEU 206.A O no hydrogen 2.808 N/A ARG 212.A NH1 GLU 215.A OE1 no hydrogen 2.508 N/A VAL 213.A N GLN 209.A O no hydrogen 3.016 N/A ILE 214.A N ARG 212.A O no hydrogen 2.319 N/A GLU 215.A N ARG 212.A O no hydrogen 3.326 N/A