Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4p4k_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N SER 22.A O no hydrogen 2.987 N/A THR 3.A OG1 SER 22.A O no hydrogen 3.491 N/A GLN 4.A NE2 TYR 87.A O no hydrogen 2.657 N/A THR 5.A N SER 20.A O no hydrogen 3.200 N/A LEU 9.A N ARG 107.A O no hydrogen 2.857 N/A LYS 11.A N LEU 109.A O no hydrogen 2.803 N/A THR 12.A N GLN 15.A OE1 no hydrogen 2.695 N/A THR 12.A OG1 GLN 15.A OE1 no hydrogen 3.403 N/A ARG 13.A N LEU 111.A O no hydrogen 2.762 N/A GLY 14.A N LEU 79.A O no hydrogen 2.757 N/A GLN 15.A N THR 12.A O no hydrogen 3.107 N/A VAL 17.A N VAL 76.A O no hydrogen 3.140 N/A THR 18.A OG1 ASN 75.A OD1 no hydrogen 2.822 N/A LEU 19.A N MET 74.A O no hydrogen 2.834 N/A SER 20.A N THR 5.A O no hydrogen 3.011 N/A SER 20.A OG GLU 73.A OE2 no hydrogen 3.003 N/A CYS 21.A N SER 72.A O no hydrogen 2.784 N/A CYS 21.A SG THR 3.A O no hydrogen 3.699 N/A SER 22.A N THR 3.A O no hydrogen 2.860 N/A HIS 27.A N ILE 24.A O no hydrogen 2.775 N/A ARG 28.A NH2 GLN 95.A OE1 no hydrogen 2.693 N/A SER 29.A OG GLU 46.A OE1 no hydrogen 2.717 N/A VAL 30.A N TYR 47.A O no hydrogen 2.800 N/A SER 31.A N ALA 90.A O no hydrogen 2.698 N/A TRP 32.A N PHE 45.A O no hydrogen 2.934 N/A TRP 32.A NE1 SER 72.A OG no hydrogen 2.792 N/A TYR 33.A N LEU 88.A O no hydrogen 2.804 N/A TYR 33.A OH GLN 100.A OE1 no hydrogen 2.585 N/A GLN 34.A N GLN 42.A O no hydrogen 2.779 N/A GLN 34.A NE2 TYR 87.A OH no hydrogen 2.841 N/A GLN 35.A N LEU 86.A O no hydrogen 2.670 N/A THR 36.A N GLY 40.A O no hydrogen 3.124 N/A GLY 40.A N THR 36.A O no hydrogen 2.797 N/A GLN 42.A N GLN 34.A O no hydrogen 2.849 N/A GLN 42.A NE2 GLN 39.A O no hydrogen 3.106 N/A LEU 44.A N TRP 32.A O no hydrogen 2.825 N/A GLU 46.A N ASN 54.A O no hydrogen 3.013 N/A TYR 47.A N VAL 30.A O no hydrogen 2.813 N/A PHE 48.A N THR 51.A O no hydrogen 3.081 N/A GLU 50.A N GLN 66.A OE1 no hydrogen 3.156 N/A THR 51.A N PHE 48.A O no hydrogen 3.212 N/A GLN 52.A NE2 TYR 47.A OH no hydrogen 2.771 N/A ARG 53.A NH1 GLU 46.A OE2 no hydrogen 2.443 N/A ARG 53.A NH2 GLN 95.A O no hydrogen 2.354 N/A ASN 54.A N GLU 46.A O no hydrogen 3.386 N/A GLY 56.A N LEU 44.A O no hydrogen 2.752 N/A ASN 57.A ND2 ASN 57.A O no hydrogen 3.001 N/A ARG 61.A NH1 SER 77.A O no hydrogen 3.318 N/A ARG 61.A NH1 ASP 83.A OD2 no hydrogen 2.654 N/A ARG 61.A NH2 ASP 83.A OD1 no hydrogen 3.061 N/A PHE 62.A N PRO 59.A O no hydrogen 2.853 N/A SER 63.A N ASN 75.A O no hydrogen 2.917 N/A ARG 65.A N GLU 73.A O no hydrogen 2.808 N/A GLN 66.A NE2 ARG 28.A O no hydrogen 3.072 N/A GLN 66.A NE2 SER 70.A O no hydrogen 2.853 N/A PHE 67.A N ARG 71.A O no hydrogen 2.813 N/A SER 68.A OG GLU 50.A OE2 no hydrogen 2.806 N/A SER 70.A N PHE 67.A O no hydrogen 3.027 N/A ARG 71.A N ASN 69.A OD1 no hydrogen 3.207 N/A ARG 71.A NH1 SER 22.A OG no hydrogen 3.093 N/A SER 72.A N CYS 21.A O no hydrogen 3.057 N/A SER 72.A OG ARG 65.A O no hydrogen 2.799 N/A GLU 73.A N ARG 65.A O no hydrogen 2.921 N/A MET 74.A N LEU 19.A O no hydrogen 2.840 N/A ASN 75.A N SER 63.A O no hydrogen 2.666 N/A ASN 75.A ND2 GLN 16.A OE1 no hydrogen 3.517 N/A VAL 76.A N VAL 17.A O no hydrogen 3.067 N/A SER 77.A N ARG 61.A O no hydrogen 3.016 N/A LEU 79.A N GLN 15.A O no hydrogen 3.108 N/A GLU 80.A N ASP 83.A OD2 no hydrogen 3.083 N/A ASP 83.A N GLU 80.A O no hydrogen 3.087 N/A SER 84.A N LEU 81.A O no hydrogen 3.192 N/A SER 84.A OG LEU 81.A O no hydrogen 3.070 N/A SER 84.A OG VAL 110.A O no hydrogen 3.502 N/A ALA 85.A N LEU 108.A O no hydrogen 3.064 N/A LEU 86.A N GLN 35.A O no hydrogen 2.918 N/A TYR 87.A N THR 106.A O no hydrogen 2.906 N/A TYR 87.A OH ASP 83.A O no hydrogen 2.588 N/A LEU 88.A N TYR 33.A O no hydrogen 2.860 N/A CYS 89.A N GLN 4.A OE1 no hydrogen 3.143 N/A CYS 89.A SG SER 31.A O no hydrogen 3.941 N/A ALA 90.A N SER 31.A O no hydrogen 2.741 N/A SER 91.A N TYR 101.A O no hydrogen 2.821 N/A SER 91.A OG HIS 27.A ND1 no hydrogen 2.712 N/A SER 92.A N SER 29.A O no hydrogen 2.900 N/A SER 92.A OG ALA 94.A O no hydrogen 2.694 N/A SER 92.A OG THR 99.A O no hydrogen 3.127 N/A GLY 97.A N ALA 94.A O no hydrogen 2.870 N/A GLN 100.A NE2 GLY 97.A O no hydrogen 2.649 N/A TYR 101.A N SER 91.A O no hydrogen 2.738 N/A GLY 103.A N CYS 89.A O no hydrogen 2.657 N/A THR 106.A N TYR 87.A O no hydrogen 3.009 N/A THR 106.A OG1 PRO 6.A O no hydrogen 2.766 N/A ARG 107.A N ARG 7.A O no hydrogen 2.904 N/A LEU 108.A N ALA 85.A O no hydrogen 2.803 N/A LEU 109.A N LEU 9.A O no hydrogen 2.756 N/A VAL 110.A N SER 84.A OG no hydrogen 2.576 N/A LEU 111.A N LYS 11.A O no hydrogen 2.668 N/A VAL 117.A N LEU 114.A O no hydrogen 3.370 N/A PHE 118.A N TYR 148.A O no hydrogen 2.966 N/A GLU 121.A N THR 145.A O no hydrogen 2.821 N/A ALA 123.A N LEU 143.A O no hydrogen 2.938 N/A PHE 125.A N VAL 141.A O no hydrogen 2.792 N/A ILE 132.A N SER 128.A O no hydrogen 3.131 N/A SER 133.A N GLU 129.A O no hydrogen 2.807 N/A HIS 134.A N ALA 130.A O no hydrogen 2.891 N/A THR 135.A N GLU 131.A O no hydrogen 2.711 N/A THR 135.A OG1 GLU 131.A O no hydrogen 2.560 N/A THR 135.A OG1 LYS 137.A O no hydrogen 3.322 N/A GLN 136.A N ILE 132.A O no hydrogen 2.852 N/A GLN 136.A NE2 SER 133.A O no hydrogen 3.629 N/A ALA 138.A N VAL 193.A O no hydrogen 2.628 N/A THR 139.A N GLU 131.A OE1 no hydrogen 3.160 N/A THR 139.A OG1 GLU 131.A OE2 no hydrogen 2.573 N/A LEU 140.A N LEU 191.A O no hydrogen 2.763 N/A VAL 141.A N PHE 125.A O no hydrogen 3.065 N/A CYS 142.A N SER 189.A O no hydrogen 2.803 N/A CYS 142.A SG ALA 123.A O no hydrogen 3.829 N/A LEU 143.A N ALA 123.A O no hydrogen 2.874 N/A ALA 144.A N LEU 187.A O no hydrogen 2.805 N/A THR 145.A N GLU 121.A O no hydrogen 2.857 N/A THR 145.A OG1 GLU 121.A O no hydrogen 3.401 N/A GLY 146.A N GLU 176.A OE2 no hydrogen 2.962 N/A PHE 147.A N TYR 185.A O no hydrogen 3.200 N/A TYR 148.A N PHE 118.A O no hydrogen 2.891 N/A GLU 153.A N GLN 210.A O no hydrogen 2.882 N/A SER 155.A N GLN 208.A O no hydrogen 2.773 N/A SER 155.A OG GLN 208.A O no hydrogen 3.541 N/A TRP 156.A NE1 SER 189.A OG no hydrogen 2.673 N/A TRP 157.A N ARG 206.A O no hydrogen 2.764 N/A TRP 157.A NE1 SER 155.A OG no hydrogen 3.112 N/A VAL 158.A N LYS 161.A O no hydrogen 2.871 N/A ASN 159.A N HIS 204.A O no hydrogen 2.990 N/A ASN 159.A ND2 ARG 202.A O no hydrogen 3.228 N/A LYS 161.A N VAL 158.A O no hydrogen 3.214 N/A VAL 163.A N TRP 156.A O no hydrogen 2.922 N/A CYS 168.A N ARG 190.A O no hydrogen 3.285 N/A THR 169.A OG1 SER 189.A OG no hydrogen 2.901 N/A ASP 170.A N SER 188.A O no hydrogen 3.027 N/A LEU 174.A N SER 186.A O no hydrogen 2.733 N/A GLU 176.A N ARG 184.A O no hydrogen 2.971 N/A GLN 177.A N SER 183.A OG no hydrogen 2.991 N/A GLN 177.A NE2 GLU 176.A O no hydrogen 3.611 N/A LEU 180.A N PRO 178.A O no hydrogen 3.027 N/A SER 183.A N LEU 180.A O no hydrogen 3.443 N/A SER 183.A OG GLN 177.A O no hydrogen 3.275 N/A SER 183.A OG ARG 184.A O no hydrogen 2.990 N/A ARG 184.A NH1 GLY 146.A O no hydrogen 3.106 N/A TYR 185.A N PHE 147.A O no hydrogen 2.652 N/A SER 186.A N LEU 174.A O no hydrogen 2.953 N/A LEU 187.A N ALA 144.A O no hydrogen 2.766 N/A SER 188.A N ASP 170.A OD2 no hydrogen 2.732 N/A SER 188.A OG ASP 170.A OD1 no hydrogen 3.070 N/A SER 188.A OG ASP 170.A OD2 no hydrogen 2.762 N/A SER 189.A N CYS 142.A O no hydrogen 3.032 N/A SER 189.A OG CYS 168.A O no hydrogen 3.322 N/A SER 189.A OG THR 169.A OG1 no hydrogen 2.901 N/A ARG 190.A N CYS 168.A O no hydrogen 2.880 N/A ARG 190.A NE CYS 168.A O no hydrogen 3.582 N/A ARG 190.A NH2 ASP 170.A OD1 no hydrogen 2.537 N/A LEU 191.A N LEU 140.A O no hydrogen 2.820 N/A ARG 192.A N GLY 166.A O no hydrogen 2.529 N/A VAL 193.A N ALA 138.A O no hydrogen 2.821 N/A SER 194.A OG THR 196.A OG1 no hydrogen 2.893 N/A ALA 195.A N GLN 136.A O no hydrogen 3.086 N/A THR 196.A OG1 SER 194.A OG no hydrogen 2.893 N/A PHE 197.A N SER 194.A O no hydrogen 3.151 N/A PHE 197.A N SER 194.A OG no hydrogen 3.204 N/A TRP 198.A N SER 194.A O no hydrogen 3.100 N/A GLN 199.A N ALA 195.A O no hydrogen 2.765 N/A ASN 203.A N ASN 200.A O no hydrogen 3.247 N/A ASN 203.A ND2 ASN 159.A OD1 no hydrogen 2.727 N/A HIS 204.A NE2 GLU 235.A OE2 no hydrogen 2.894 N/A PHE 205.A N ALA 236.A O no hydrogen 2.872 N/A ARG 206.A N TRP 157.A O no hydrogen 2.795 N/A ARG 206.A NE GLN 208.A OE1 no hydrogen 2.651 N/A CYS 207.A N ALA 234.A O no hydrogen 2.812 N/A GLN 208.A N SER 155.A O no hydrogen 2.765 N/A VAL 209.A N VAL 232.A O no hydrogen 2.988 N/A GLN 210.A N GLU 153.A O no hydrogen 2.926 N/A GLN 210.A NE2 PHE 211.A O no hydrogen 2.862 N/A PHE 211.A N GLN 230.A O no hydrogen 2.777 N/A TYR 212.A N HIS 151.A O no hydrogen 2.817 N/A TYR 212.A OH GLU 153.A OE1 no hydrogen 2.997 N/A GLY 213.A N THR 229.A OG1 no hydrogen 2.652 N/A LEU 214.A N PRO 227.A O no hydrogen 2.994 N/A SER 215.A N ASP 218.A OD2 no hydrogen 2.796 N/A SER 215.A OG ASP 218.A OD2 no hydrogen 3.366 N/A ASP 218.A N SER 215.A O no hydrogen 3.387 N/A TRP 220.A NE1 ARG 224.A O no hydrogen 2.762 N/A ARG 224.A NH1 VAL 117.A O no hydrogen 2.801 N/A ARG 224.A NH2 LYS 115.A O no hydrogen 2.683 N/A ARG 224.A NH2 VAL 117.A O no hydrogen 2.905 N/A LYS 226.A NZ SER 215.A O no hydrogen 3.037 N/A LYS 226.A NZ ASP 218.A O no hydrogen 3.103 N/A VAL 228.A N LYS 226.A O no hydrogen 2.689 N/A THR 229.A N LEU 214.A O no hydrogen 3.233 N/A THR 229.A OG1 GLY 213.A O no hydrogen 3.207 N/A GLN 230.A N PHE 211.A O no hydrogen 3.122 N/A VAL 232.A N VAL 209.A O no hydrogen 2.970 N/A ALA 234.A N CYS 207.A O no hydrogen 3.157 N/A ALA 236.A N PHE 205.A O no hydrogen 2.869 N/A GLY 238.A N ASN 203.A O no hydrogen 2.822 N/A