Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3vkx_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N ASP 94.A OD2 no hydrogen 2.620 N/A GLU 3.A N ARG 61.A O no hydrogen 2.952 N/A ALA 4.A N LEU 90.A O no hydrogen 2.899 N/A ARG 5.A N THR 59.A O no hydrogen 2.993 N/A LEU 6.A N ILE 88.A O no hydrogen 2.778 N/A VAL 7.A N ASP 58.A OD2 no hydrogen 2.626 N/A GLY 9.A N ASP 86.A O no hydrogen 3.119 N/A ILE 11.A N GLN 8.A O no hydrogen 3.428 N/A LEU 12.A N GLY 9.A O no hydrogen 2.935 N/A LYS 13.A N GLY 9.A O no hydrogen 3.495 N/A LYS 13.A NZ LEU 79.A O no hydrogen 2.986 N/A LYS 13.A NZ ALA 82.A O no hydrogen 2.725 N/A LYS 14.A N SER 10.A O no hydrogen 3.016 N/A VAL 15.A N ILE 11.A O no hydrogen 2.889 N/A LEU 16.A N LEU 12.A O no hydrogen 3.045 N/A GLU 17.A N LYS 13.A O no hydrogen 3.076 N/A ALA 18.A N LYS 14.A O no hydrogen 2.966 N/A ALA 18.A N VAL 15.A O no hydrogen 3.174 N/A LEU 19.A N LEU 16.A O no hydrogen 3.143 N/A LYS 20.A N LEU 16.A O no hydrogen 2.962 N/A LYS 20.A NZ ASP 21.A OD1 no hydrogen 3.400 N/A LEU 22.A N LEU 19.A O no hydrogen 2.992 N/A ILE 23.A N LEU 19.A O no hydrogen 3.054 N/A ALA 26.A N VAL 70.A O no hydrogen 3.118 N/A TRP 28.A N MET 68.A O no hydrogen 2.855 N/A ASP 29.A N ASN 36.A O no hydrogen 2.687 N/A ILE 30.A N LEU 66.A O no hydrogen 2.831 N/A SER 31.A N GLY 34.A O no hydrogen 3.091 N/A SER 31.A OG SER 33.A OG no hydrogen 2.809 N/A SER 33.A OG SER 31.A OG no hydrogen 2.809 N/A GLY 34.A N SER 31.A O no hydrogen 3.148 N/A VAL 35.A N LEU 52.A O no hydrogen 2.721 N/A ASN 36.A N ASP 29.A O no hydrogen 2.908 N/A LEU 37.A N LEU 50.A O no hydrogen 3.018 N/A GLN 38.A NE2 LEU 126.A O no hydrogen 2.568 N/A SER 39.A N VAL 48.A O no hydrogen 3.046 N/A SER 39.A OG MET 40.A O no hydrogen 2.528 N/A ASP 41.A N SER 46.A O no hydrogen 2.917 N/A SER 42.A N LEU 22.A O no hydrogen 2.882 N/A SER 43.A N ASP 41.A OD1 no hydrogen 2.922 N/A HIS 44.A N ASP 41.A O no hydrogen 2.906 N/A VAL 45.A N ASP 41.A OD1 no hydrogen 3.007 N/A SER 46.A N ASP 41.A OD2 no hydrogen 2.872 N/A SER 46.A OG ASP 41.A OD2 no hydrogen 2.570 N/A LEU 47.A N TYR 243.A O no hydrogen 3.170 N/A VAL 48.A N SER 39.A O no hydrogen 2.865 N/A GLN 49.A N LYS 241.A O no hydrogen 2.839 N/A GLN 49.A NE2 THR 51.A OG1 no hydrogen 2.710 N/A LEU 50.A N LEU 37.A O no hydrogen 2.871 N/A THR 51.A N HIS 239.A O no hydrogen 2.789 N/A THR 51.A OG1 ASN 36.A OD1 no hydrogen 2.994 N/A THR 51.A OG1 HIS 239.A NE2 no hydrogen 3.187 N/A LEU 52.A N VAL 35.A O no hydrogen 2.842 N/A ARG 53.A N MET 237.A O no hydrogen 2.753 N/A SER 54.A N SER 33.A O no hydrogen 2.698 N/A SER 54.A OG SER 32.A O no hydrogen 3.148 N/A SER 54.A OG SER 33.A O no hydrogen 2.831 N/A SER 54.A OG GLU 55.A OE1 no hydrogen 3.536 N/A GLU 55.A N GLU 55.A OE1 no hydrogen 2.918 N/A GLY 56.A N ARG 53.A O no hydrogen 2.917 N/A PHE 57.A N SER 54.A O no hydrogen 3.205 N/A ASP 58.A N ARG 5.A O no hydrogen 2.856 N/A THR 59.A N ARG 5.A O no hydrogen 3.435 N/A TYR 60.A OH SER 31.A O no hydrogen 2.527 N/A ARG 61.A N GLU 3.A O no hydrogen 2.948 N/A CYS 62.A SG ARG 64.A O no hydrogen 3.268 N/A LEU 66.A N ILE 30.A O no hydrogen 2.984 N/A MET 68.A N TRP 28.A O no hydrogen 2.949 N/A VAL 70.A N ALA 26.A O no hydrogen 3.028 N/A LEU 72.A N ASN 24.A O no hydrogen 2.923 N/A SER 74.A N ASN 71.A OD1 no hydrogen 3.084 N/A MET 75.A N ASN 71.A O no hydrogen 3.157 N/A SER 76.A N LEU 72.A O no hydrogen 2.813 N/A LYS 77.A N THR 73.A O no hydrogen 2.904 N/A ILE 78.A N SER 74.A O no hydrogen 3.080 N/A LEU 79.A N MET 75.A O no hydrogen 2.894 N/A LYS 80.A N SER 76.A O no hydrogen 2.998 N/A CYS 81.A N ILE 78.A O no hydrogen 2.868 N/A CYS 81.A SG LYS 77.A O no hydrogen 3.558 N/A ALA 82.A N LEU 79.A O no hydrogen 3.046 N/A GLY 83.A N ASP 86.A OD1 no hydrogen 2.877 N/A ASP 86.A N GLY 83.A O no hydrogen 3.226 N/A ILE 87.A N GLU 104.A O no hydrogen 2.745 N/A ILE 88.A N LEU 6.A O no hydrogen 2.849 N/A THR 89.A N VAL 102.A O no hydrogen 3.009 N/A LEU 90.A N ALA 4.A O no hydrogen 2.793 N/A ARG 91.A N ALA 100.A O no hydrogen 3.087 N/A ARG 91.A NE GLU 93.A OE2 no hydrogen 3.545 N/A ARG 91.A NH1 GLU 3.A OE2 no hydrogen 3.196 N/A ARG 91.A NH2 GLU 93.A OE1 no hydrogen 3.555 N/A ALA 92.A N PHE 2.A O no hydrogen 3.038 N/A LEU 99.A N MET 116.A O no hydrogen 2.942 N/A ALA 100.A N ARG 91.A O no hydrogen 2.779 N/A LEU 101.A N TYR 114.A O no hydrogen 2.859 N/A VAL 102.A N THR 89.A O no hydrogen 2.953 N/A PHE 103.A N SER 112.A O no hydrogen 2.792 N/A GLU 104.A N ILE 87.A O no hydrogen 3.033 N/A GLN 108.A N ALA 105.A O no hydrogen 3.018 N/A GLN 108.A NE2 GLU 104.A OE2 no hydrogen 2.701 N/A GLN 108.A NE2 ALA 105.A O no hydrogen 2.917 N/A GLU 109.A N ASN 107.A OD1 no hydrogen 2.849 N/A SER 112.A N PHE 103.A O no hydrogen 2.955 N/A TYR 114.A N LEU 101.A O no hydrogen 2.769 N/A MET 116.A N LEU 99.A O no hydrogen 2.851 N/A LEU 118.A N ASP 97.A O no hydrogen 3.052 N/A MET 119.A N GLY 69.A O no hydrogen 2.709 N/A GLN 125.A N GLU 124.A OE2 no hydrogen 3.318 N/A GLN 125.A NE2 ASP 29.A OD2 no hydrogen 2.879 N/A LEU 126.A N GLN 38.A OE1 no hydrogen 2.838 N/A SER 134.A N SER 223.A OG no hydrogen 3.117 N/A SER 134.A OG SER 223.A OG no hydrogen 3.223 N/A VAL 136.A N GLU 191.A O no hydrogen 2.979 N/A VAL 137.A N LEU 220.A O no hydrogen 2.799 N/A LYS 138.A N THR 189.A O no hydrogen 2.784 N/A MET 139.A N VAL 218.A O no hydrogen 3.075 N/A SER 141.A N SER 216.A O no hydrogen 2.870 N/A SER 141.A OG SER 215.A O no hydrogen 2.589 N/A GLU 143.A N PRO 140.A O no hydrogen 3.054 N/A PHE 144.A N PRO 140.A O no hydrogen 3.186 N/A ALA 145.A N SER 141.A O no hydrogen 3.034 N/A ARG 146.A N GLY 142.A O no hydrogen 2.966 N/A ARG 146.A NE GLU 143.A OE2 no hydrogen 3.004 N/A ARG 146.A NH2 GLU 143.A OE2 no hydrogen 2.565 N/A ILE 147.A N GLU 143.A O no hydrogen 2.944 N/A CYS 148.A N PHE 144.A O no hydrogen 2.993 N/A CYS 148.A SG PHE 144.A O no hydrogen 3.468 N/A ARG 149.A N ALA 145.A O no hydrogen 3.015 N/A ARG 149.A NE ASP 150.A OD1 no hydrogen 3.376 N/A ARG 149.A NH2 ASP 150.A OD1 no hydrogen 3.121 N/A ASP 150.A N ARG 146.A O no hydrogen 2.838 N/A LEU 151.A N ILE 147.A O no hydrogen 2.929 N/A SER 152.A N CYS 148.A O no hydrogen 3.178 N/A SER 152.A N ARG 149.A O no hydrogen 3.298 N/A SER 152.A OG CYS 148.A O no hydrogen 3.511 N/A SER 152.A OG ARG 149.A O no hydrogen 2.861 N/A HIS 153.A N ASP 150.A O no hydrogen 3.072 N/A ILE 154.A N LEU 151.A O no hydrogen 2.908 N/A GLY 155.A N LEU 151.A O no hydrogen 3.101 N/A VAL 158.A N PHE 200.A O no hydrogen 2.852 N/A VAL 159.A N SER 170.A O no hydrogen 2.893 N/A ILE 160.A N LEU 198.A O no hydrogen 2.683 N/A SER 161.A N LYS 168.A O no hydrogen 2.949 N/A SER 161.A OG GLN 197.A OE1 no hydrogen 3.213 N/A CYS 162.A N VAL 196.A O no hydrogen 2.856 N/A CYS 162.A SG ALA 163.A O no hydrogen 4.015 N/A ALA 163.A N GLY 166.A O no hydrogen 3.020 N/A VAL 167.A N LEU 182.A O no hydrogen 2.953 N/A LYS 168.A N SER 161.A O no hydrogen 2.894 N/A PHE 169.A N ILE 180.A O no hydrogen 2.864 N/A SER 170.A N VAL 159.A O no hydrogen 2.939 N/A ALA 171.A N GLY 178.A O no hydrogen 2.899 N/A GLY 173.A N GLY 176.A O no hydrogen 2.841 N/A GLY 178.A N ALA 171.A O no hydrogen 2.950 N/A ILE 180.A N PHE 169.A O no hydrogen 2.807 N/A LEU 182.A N VAL 167.A O no hydrogen 2.839 N/A GLN 184.A N ASP 165.A O no hydrogen 3.064 N/A THR 185.A N VAL 188.A O no hydrogen 3.075 N/A VAL 188.A N THR 185.A OG1 no hydrogen 3.085 N/A THR 189.A N LYS 138.A O no hydrogen 2.822 N/A ILE 190.A N GLN 184.A OE1 no hydrogen 3.288 N/A GLU 191.A N VAL 136.A O no hydrogen 2.899 N/A ASN 193.A N SER 134.A O no hydrogen 2.855 N/A GLU 194.A N SER 134.A O no hydrogen 3.381 N/A LEU 198.A N ILE 160.A O no hydrogen 2.896 N/A PHE 200.A N VAL 158.A O no hydrogen 2.938 N/A LEU 202.A N ASP 156.A O no hydrogen 2.962 N/A TYR 204.A N ALA 201.A O no hydrogen 3.202 N/A LEU 205.A N ALA 201.A O no hydrogen 3.320 N/A ASN 206.A N LEU 202.A O no hydrogen 2.865 N/A ASN 206.A ND2 CYS 148.A O no hydrogen 3.620 N/A PHE 207.A N TYR 204.A O no hydrogen 2.939 N/A PHE 208.A N TYR 204.A O no hydrogen 3.035 N/A THR 209.A N LEU 205.A O no hydrogen 3.044 N/A THR 209.A OG1 ASN 206.A O no hydrogen 3.277 N/A LYS 210.A N PHE 207.A O no hydrogen 3.244 N/A ALA 211.A N PHE 208.A O no hydrogen 3.004 N/A THR 212.A N THR 209.A O no hydrogen 2.956 N/A THR 212.A OG1 THR 209.A O no hydrogen 2.493 N/A LEU 214.A N ALA 211.A O no hydrogen 2.925 N/A SER 215.A N THR 212.A O no hydrogen 3.192 N/A SER 215.A OG THR 217.A O no hydrogen 2.862 N/A SER 216.A OG GLU 186.A OE2 no hydrogen 3.541 N/A THR 217.A N SER 215.A OG no hydrogen 3.035 N/A VAL 218.A N MET 139.A O no hydrogen 2.943 N/A THR 219.A N GLU 231.A O no hydrogen 3.040 N/A LEU 220.A N VAL 137.A O no hydrogen 2.806 N/A SER 221.A N VAL 229.A O no hydrogen 2.936 N/A MET 222.A N CYS 135.A O no hydrogen 2.867 N/A SER 223.A OG GLU 132.A O no hydrogen 3.080 N/A SER 223.A OG SER 134.A OG no hydrogen 3.223 N/A LEU 228.A N LEU 244.A O no hydrogen 2.838 N/A VAL 229.A N SER 221.A O no hydrogen 2.977 N/A VAL 230.A N TYR 242.A O no hydrogen 2.858 N/A GLU 231.A N THR 219.A O no hydrogen 2.888 N/A TYR 232.A N LEU 240.A O no hydrogen 2.914 N/A ILE 234.A N GLY 238.A O no hydrogen 2.813 N/A GLY 238.A N ILE 234.A O no hydrogen 2.888 N/A HIS 239.A N THR 51.A O no hydrogen 2.865 N/A HIS 239.A NE2 GLN 49.A OE1 no hydrogen 2.934 N/A LEU 240.A N TYR 232.A O no hydrogen 3.002 N/A LYS 241.A N GLN 49.A O no hydrogen 2.763 N/A TYR 242.A N VAL 230.A O no hydrogen 2.881 N/A TYR 242.A OH ALA 18.A O no hydrogen 2.855 N/A TYR 243.A N LEU 47.A O no hydrogen 2.826 N/A LEU 244.A N LEU 228.A O no hydrogen 2.976 N/A LYS 247.A N THR 199.A O no hydrogen 2.709 N/A