Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3kvd_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 6.A N GLY 2.A O no hydrogen 2.904 N/A LEU 7.A N LEU 3.A O no hydrogen 3.226 N/A LEU 7.A N ALA 4.A O no hydrogen 3.066 N/A THR 8.A N ASP 5.A O no hydrogen 3.048 N/A THR 8.A OG1 ALA 4.A O no hydrogen 2.859 N/A ALA 9.A N ASP 5.A O no hydrogen 2.714 N/A LYS 14.A N ASP 12.A OD1 no hydrogen 2.770 N/A ASP 15.A N ASP 12.A O no hydrogen 2.903 N/A LEU 18.A N GLN 88.A O no hydrogen 2.907 N/A GLN 19.A NE2 HIS 13.A O no hydrogen 2.916 N/A GLN 19.A NE2 ASP 15.A O no hydrogen 3.107 N/A LEU 21.A N LEU 50.A O no hydrogen 2.961 N/A LEU 23.A N ASP 48.A O no hydrogen 2.845 N/A ASP 24.A N ASP 120.A OD1 no hydrogen 3.229 N/A GLN 25.A N ASP 120.A OD1 no hydrogen 2.539 N/A SER 26.A N ASP 120.A OD2 no hydrogen 2.730 N/A SER 26.A OG THR 94.A OG1 no hydrogen 2.690 N/A SER 26.A OG ASP 120.A OD2 no hydrogen 2.700 N/A GLU 31.A N ARG 28.A O no hydrogen 2.953 N/A LYS 32.A N GLN 68.A O no hydrogen 2.799 N/A LEU 33.A N TYR 44.A O no hydrogen 2.857 N/A LYS 34.A N ILE 66.A O no hydrogen 2.909 N/A LEU 35.A N LYS 42.A O no hydrogen 2.813 N/A ALA 36.A N ASP 64.A O no hydrogen 2.895 N/A ALA 37.A N ALA 40.A O no hydrogen 3.243 N/A ALA 40.A N ALA 37.A O no hydrogen 3.126 N/A LYS 42.A N LEU 35.A O no hydrogen 2.926 N/A LYS 42.A NZ LEU 7.A O no hydrogen 3.259 N/A TYR 44.A N LEU 33.A O no hydrogen 2.726 N/A GLY 45.A N ASP 48.A OD2 no hydrogen 2.791 N/A ASN 46.A ND2 ASP 24.A OD1 no hydrogen 2.859 N/A ASN 46.A ND2 VAL 27.A O no hydrogen 3.047 N/A GLY 47.A N LEU 23.A O no hydrogen 2.815 N/A ASP 48.A N GLY 45.A O no hydrogen 3.221 N/A LEU 50.A N LEU 21.A O no hydrogen 2.804 N/A ASN 51.A ND2 ALA 9.A O no hydrogen 3.004 N/A THR 52.A OG1 LEU 18.A O no hydrogen 2.712 N/A GLY 53.A N GLN 19.A O no hydrogen 2.889 N/A LYS 54.A N ASN 51.A O no hydrogen 3.296 N/A LYS 54.A NZ ASP 15.A OD1 no hydrogen 3.419 N/A LYS 54.A NZ ASP 15.A OD2 no hydrogen 2.866 N/A LEU 55.A N THR 52.A O no hydrogen 2.752 N/A ASP 58.A N LYS 87.A O no hydrogen 2.634 N/A SER 61.A N VAL 85.A O no hydrogen 2.667 N/A PHE 63.A N PHE 83.A O no hydrogen 2.745 N/A ASP 64.A N ALA 36.A O no hydrogen 2.918 N/A PHE 65.A N GLY 81.A O no hydrogen 2.827 N/A ILE 66.A N LYS 34.A O no hydrogen 2.841 N/A ARG 67.A N GLU 79.A O no hydrogen 2.706 N/A ARG 67.A NE GLU 79.A OE2 no hydrogen 2.817 N/A ARG 67.A NH1 SER 26.A O no hydrogen 3.564 N/A ARG 67.A NH1 GLU 31.A OE1 no hydrogen 3.278 N/A GLN 68.A N LYS 32.A O no hydrogen 2.780 N/A ILE 69.A N ILE 76.A O no hydrogen 3.075 N/A VAL 71.A N GLN 74.A O no hydrogen 2.715 N/A GLY 73.A N GLU 70.A OE1 no hydrogen 2.644 N/A GLN 74.A N VAL 71.A O no hydrogen 2.731 N/A ILE 76.A N ILE 69.A O no hydrogen 3.012 N/A LEU 78.A N ARG 67.A O no hydrogen 2.714 N/A GLU 79.A N ARG 67.A O no hydrogen 3.429 N/A SER 80.A N GLN 100.A O no hydrogen 3.021 N/A GLY 81.A N PHE 65.A O no hydrogen 3.125 N/A GLU 82.A N GLN 97.A O no hydrogen 2.799 N/A PHE 83.A N PHE 63.A O no hydrogen 2.519 N/A GLN 84.A N ALA 95.A O no hydrogen 2.768 N/A GLN 84.A NE2 GLU 82.A OE1 no hydrogen 2.843 N/A VAL 85.A N SER 61.A O no hydrogen 2.754 N/A TYR 86.A N LEU 93.A O no hydrogen 2.864 N/A TYR 86.A OH THR 142.A OG1 no hydrogen 2.760 N/A LYS 87.A NZ LYS 16.A O no hydrogen 3.114 N/A LYS 87.A NZ THR 52.A O no hydrogen 3.114 N/A LYS 87.A NZ GLY 53.A O no hydrogen 3.513 N/A LYS 87.A NZ LEU 55.A O no hydrogen 2.706 N/A LYS 87.A NZ ASN 57.A OD1 no hydrogen 2.848 N/A GLN 88.A N SER 91.A O no hydrogen 2.760 N/A SER 89.A N GLU 220.A OE2 no hydrogen 2.773 N/A HIS 90.A N GLU 220.A OE1 no hydrogen 2.711 N/A HIS 90.A ND1 GLU 124.A OE2 no hydrogen 2.822 N/A SER 91.A OG GLU 220.A OE1 no hydrogen 2.917 N/A ALA 92.A N ALA 122.A O no hydrogen 3.112 N/A LEU 93.A N TYR 86.A O no hydrogen 2.894 N/A THR 94.A N ASP 120.A O no hydrogen 2.896 N/A THR 94.A OG1 SER 26.A OG no hydrogen 2.690 N/A ALA 95.A N GLN 84.A O no hydrogen 2.728 N/A PHE 96.A N ARG 117.A O no hydrogen 2.654 N/A GLN 97.A N GLU 82.A O no hydrogen 2.636 N/A GLN 97.A NE2 SER 146.A OG no hydrogen 2.905 N/A THR 98.A N GLN 115.A O no hydrogen 2.814 N/A THR 98.A OG1 GLU 79.A OE1 no hydrogen 2.539 N/A THR 98.A OG1 GLN 115.A O no hydrogen 3.470 N/A GLU 99.A N SER 80.A O no hydrogen 2.930 N/A GLN 100.A N SER 80.A O no hydrogen 3.130 N/A ILE 101.A N VAL 111.A O no hydrogen 2.725 N/A GLN 102.A N LEU 78.A O no hydrogen 2.936 N/A ASP 103.A N LYS 109.A O no hydrogen 2.484 N/A GLU 105.A N ASP 103.A OD1 no hydrogen 3.323 N/A LYS 109.A N HIS 106.A O no hydrogen 3.066 N/A VAL 111.A N ILE 101.A O no hydrogen 2.718 N/A LYS 113.A N GLU 99.A O no hydrogen 2.868 N/A LYS 113.A NZ GLN 115.A OE1 no hydrogen 2.904 N/A ARG 114.A NE GLU 99.A OE1 no hydrogen 2.779 N/A ARG 114.A NE GLU 99.A OE2 no hydrogen 3.167 N/A ARG 114.A NH1 ASP 147.A OD2 no hydrogen 2.725 N/A ARG 114.A NH2 GLU 99.A OE2 no hydrogen 2.915 N/A ARG 114.A NH2 ASP 147.A OD1 no hydrogen 2.713 N/A ARG 114.A NH2 ASP 147.A OD2 no hydrogen 3.434 N/A ARG 117.A N PHE 96.A O no hydrogen 3.062 N/A ARG 117.A NH2 GLU 79.A OE1 no hydrogen 3.328 N/A ARG 117.A NH2 GLU 79.A OE2 no hydrogen 2.955 N/A GLY 119.A N THR 94.A O no hydrogen 2.677 N/A ASP 120.A N THR 94.A OG1 no hydrogen 2.850 N/A ALA 122.A N ALA 92.A O no hydrogen 3.080 N/A GLU 124.A N HIS 90.A O no hydrogen 2.731 N/A HIS 125.A N GLY 123.A O no hydrogen 3.012 N/A THR 126.A N ILE 213.A O no hydrogen 2.785 N/A THR 126.A OG1 GLY 215.A O no hydrogen 2.487 N/A PHE 128.A N ARG 191.A O no hydrogen 2.706 N/A ASP 129.A N SER 127.A OG no hydrogen 3.310 N/A LYS 130.A N SER 127.A O no hydrogen 2.916 N/A LEU 131.A N PHE 128.A O no hydrogen 3.247 N/A ALA 137.A N ILE 157.A O no hydrogen 2.826 N/A TYR 139.A N TYR 155.A O no hydrogen 2.510 N/A TYR 139.A OH ALA 218.A O no hydrogen 2.675 N/A ARG 140.A N LYS 241.A O no hydrogen 2.890 N/A GLY 141.A N LEU 153.A O no hydrogen 2.846 N/A THR 142.A N ALA 239.A O no hydrogen 2.720 N/A THR 142.A OG1 TYR 86.A OH no hydrogen 2.760 N/A ALA 143.A N GLY 151.A O no hydrogen 3.063 N/A PHE 144.A N GLY 237.A O no hydrogen 2.974 N/A GLY 145.A N ASP 148.A O no hydrogen 2.823 N/A ASP 148.A N GLY 145.A O no hydrogen 2.952 N/A GLY 150.A N ASP 148.A OD1 no hydrogen 3.092 N/A LYS 152.A N GLU 169.A O no hydrogen 2.609 N/A LEU 153.A N GLY 141.A O no hydrogen 2.878 N/A THR 154.A N LYS 167.A O no hydrogen 2.934 N/A TYR 155.A N TYR 139.A O no hydrogen 2.791 N/A TYR 155.A OH TYR 209.A OH no hydrogen 2.706 N/A THR 156.A N ASN 165.A O no hydrogen 2.833 N/A ILE 157.A N ALA 137.A O no hydrogen 2.817 N/A ASP 158.A N GLN 163.A O no hydrogen 2.736 N/A PHE 159.A N GLY 135.A O no hydrogen 2.818 N/A ALA 161.A N ASP 158.A OD1 no hydrogen 3.068 N/A GLN 163.A N ASP 158.A O no hydrogen 3.132 N/A GLY 164.A N ALA 183.A O no hydrogen 2.801 N/A ASN 165.A N THR 156.A O no hydrogen 2.978 N/A GLY 166.A N LEU 180.A O no hydrogen 2.789 N/A LYS 167.A N THR 154.A O no hydrogen 2.786 N/A LYS 167.A NZ ASP 179.A OD1 no hydrogen 2.802 N/A ILE 168.A N VAL 178.A O no hydrogen 2.892 N/A GLU 169.A N LYS 152.A O no hydrogen 2.809 N/A LEU 171.A N ASN 177.A OD1 no hydrogen 2.698 N/A LYS 172.A N ASP 148.A OD2 no hydrogen 2.641 N/A LEU 176.A N SER 173.A O no hydrogen 3.020 N/A ASN 177.A N PRO 174.A O no hydrogen 3.243 N/A ASN 177.A ND2 LEU 171.A O no hydrogen 3.012 N/A VAL 178.A N LEU 176.A O no hydrogen 2.824 N/A ASP 179.A N LEU 200.A O no hydrogen 2.617 N/A LEU 180.A N GLY 166.A O no hydrogen 2.793 N/A ALA 181.A N SER 198.A O no hydrogen 2.918 N/A ALA 183.A N GLY 164.A O no hydrogen 2.795 N/A ILE 185.A N LYS 162.A O no hydrogen 2.738 N/A LYS 186.A N VAL 194.A O no hydrogen 2.853 N/A ASP 188.A N HIS 192.A O no hydrogen 2.651 N/A GLY 189.A N ASP 188.A OD1 no hydrogen 2.751 N/A ARG 191.A N ASP 188.A O no hydrogen 2.847 N/A ARG 191.A NE ASP 129.A OD1 no hydrogen 3.048 N/A ARG 191.A NE ASP 129.A OD2 no hydrogen 2.561 N/A ARG 191.A NH2 ASP 129.A OD1 no hydrogen 2.499 N/A ALA 193.A N THR 126.A O no hydrogen 2.666 N/A VAL 194.A N LYS 186.A O no hydrogen 2.933 N/A ILE 195.A N LEU 211.A O no hydrogen 2.759 N/A GLY 197.A N TYR 209.A O no hydrogen 2.835 N/A VAL 199.A N GLY 207.A O no hydrogen 2.904 N/A LEU 200.A N ASP 179.A O no hydrogen 2.703 N/A TYR 201.A N ALA 204.A O no hydrogen 2.775 N/A ALA 204.A N TYR 201.A O no hydrogen 3.137 N/A LYS 206.A N VAL 199.A O no hydrogen 2.769 N/A GLY 207.A N GLU 205.A OE2 no hydrogen 2.654 N/A SER 208.A N GLU 226.A O no hydrogen 3.069 N/A TYR 209.A N GLY 197.A O no hydrogen 2.777 N/A TYR 209.A OH TYR 155.A OH no hydrogen 2.706 N/A TYR 209.A OH ALA 181.A O no hydrogen 2.727 N/A SER 210.A N SER 224.A O no hydrogen 2.895 N/A LEU 211.A N ILE 195.A O no hydrogen 2.760 N/A GLY 212.A N ALA 222.A O no hydrogen 2.691 N/A ILE 213.A N ALA 193.A O no hydrogen 2.884 N/A PHE 214.A N GLU 220.A O no hydrogen 2.774 N/A GLY 215.A N GLU 124.A O no hydrogen 2.677 N/A LYS 217.A N GLN 219.A OE1 no hydrogen 2.810 N/A ALA 218.A N GLY 215.A O no hydrogen 3.036 N/A GLN 219.A N GLN 219.A OE1 no hydrogen 2.876 N/A GLU 220.A N PHE 214.A O no hydrogen 2.967 N/A VAL 221.A N ALA 240.A O no hydrogen 2.826 N/A ALA 222.A N GLY 212.A O no hydrogen 3.074 N/A GLY 223.A N LEU 238.A O no hydrogen 2.926 N/A SER 224.A N SER 210.A O no hydrogen 3.029 N/A ALA 225.A N ILE 236.A O no hydrogen 2.967 N/A GLU 226.A N SER 208.A O no hydrogen 2.692 N/A VAL 227.A N ARG 234.A O no hydrogen 2.787 N/A LYS 228.A N LYS 206.A O no hydrogen 2.955 N/A THR 229.A N GLY 232.A O no hydrogen 3.060 N/A THR 229.A OG1 GLY 232.A O no hydrogen 2.590 N/A ASN 231.A N THR 229.A OG1 no hydrogen 3.179 N/A GLY 232.A N THR 229.A O no hydrogen 2.918 N/A ARG 234.A N VAL 227.A O no hydrogen 2.737 N/A ARG 234.A NH1 ASN 231.A O no hydrogen 3.256 N/A ARG 234.A NH1 ILE 233.A O no hydrogen 3.145 N/A ARG 234.A NH2 ASN 231.A O no hydrogen 3.410 N/A ILE 236.A N ALA 225.A O no hydrogen 3.004 N/A GLY 237.A N PHE 144.A O no hydrogen 2.633 N/A LEU 238.A N GLY 223.A O no hydrogen 2.823 N/A ALA 239.A N THR 142.A O no hydrogen 3.072 N/A ALA 240.A N VAL 221.A O no hydrogen 2.948 N/A LYS 241.A N ARG 140.A O no hydrogen 3.170 N/A LYS 241.A NZ ASP 58.A OD2 no hydrogen 2.814 N/A GLN 242.A N GLN 219.A O no hydrogen 2.952 N/A