Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4dum_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 7.A N ASN 4.A O no hydrogen 3.192 N/A TYR 8.A N PRO 5.A O no hydrogen 2.900 N/A ILE 9.A N PRO 5.A O no hydrogen 2.853 N/A LYS 10.A NZ ASP 45.A OD1 no hydrogen 3.394 N/A LYS 10.A NZ ASP 45.A OD2 no hydrogen 3.136 N/A HIS 11.A N GLU 44.A OE1 no hydrogen 3.008 N/A HIS 11.A ND1 GLU 44.A OE2 no hydrogen 2.572 N/A LEU 13.A N ASP 41.A O no hydrogen 2.759 N/A ARG 16.A NH2 ASP 41.A OD1 no hydrogen 3.436 N/A TRP 17.A N PHE 40.A O no hydrogen 2.842 N/A ALA 18.A N PHE 68.A O no hydrogen 2.705 N/A LEU 19.A N SER 38.A O no hydrogen 2.926 N/A TRP 20.A N SER 66.A O no hydrogen 2.713 N/A PHE 21.A N ARG 35.A O no hydrogen 2.799 N/A PHE 22.A N ASP 64.A O no hydrogen 2.962 N/A SER 27.A OG ASP 25.A OD1 no hydrogen 2.668 N/A LYS 28.A N ASP 25.A O no hydrogen 3.119 N/A LYS 28.A NZ ASP 25.A OD2 no hydrogen 2.890 N/A ALA 32.A N THR 29.A O no hydrogen 2.843 N/A ASN 33.A N THR 29.A O no hydrogen 3.030 N/A ASN 33.A N TRP 30.A O no hydrogen 2.796 N/A ASN 33.A ND2 ASP 25.A O no hydrogen 3.183 N/A LEU 34.A N TRP 30.A O no hydrogen 3.235 N/A ARG 35.A N PHE 21.A O no hydrogen 2.847 N/A ILE 37.A N LEU 19.A O no hydrogen 2.951 N/A SER 38.A N LEU 19.A O no hydrogen 3.356 N/A LYS 39.A NZ ASP 70.A OD1 no hydrogen 3.511 N/A LYS 39.A NZ ASP 70.A OD2 no hydrogen 2.879 N/A PHE 40.A N TRP 17.A O no hydrogen 3.020 N/A THR 42.A OG1 ASP 45.A OD2 no hydrogen 2.656 N/A VAL 43.A N HIS 11.A O no hydrogen 2.851 N/A GLU 44.A N GLU 44.A OE1 no hydrogen 2.590 N/A ASP 45.A N THR 42.A OG1 no hydrogen 3.381 N/A PHE 46.A N THR 42.A O no hydrogen 2.977 N/A TRP 47.A N VAL 43.A O no hydrogen 3.155 N/A ALA 48.A N GLU 44.A O no hydrogen 3.078 N/A LEU 49.A N ASP 45.A O no hydrogen 2.975 N/A TYR 50.A N PHE 46.A O no hydrogen 2.758 N/A ASN 51.A N TRP 47.A O no hydrogen 2.941 N/A HIS 52.A N ALA 48.A O no hydrogen 3.123 N/A HIS 52.A N LEU 49.A O no hydrogen 3.136 N/A ILE 53.A N TYR 50.A O no hydrogen 3.265 N/A SER 57.A N ASP 101.A OD2 no hydrogen 2.954 N/A SER 57.A OG ASP 101.A OD1 no hydrogen 2.921 N/A ASN 58.A N LEU 55.A O no hydrogen 2.795 N/A LEU 59.A N SER 56.A O no hydrogen 3.221 N/A GLY 62.A N VAL 130.A O no hydrogen 2.834 N/A CYS 63.A N MET 60.A O no hydrogen 3.184 N/A CYS 63.A SG MET 60.A O no hydrogen 3.273 N/A ASP 64.A N PHE 22.A O no hydrogen 2.891 N/A TYR 65.A N VAL 128.A O no hydrogen 3.192 N/A TYR 65.A OH GLN 54.A O no hydrogen 2.832 N/A SER 66.A N TRP 20.A O no hydrogen 3.008 N/A LEU 67.A N ALA 126.A O no hydrogen 3.139 N/A PHE 68.A N ALA 18.A O no hydrogen 2.903 N/A LYS 69.A N CYS 124.A O no hydrogen 3.107 N/A LYS 69.A NZ SER 120.A O no hydrogen 2.864 N/A LYS 69.A NZ VAL 123.A O no hydrogen 2.878 N/A ASP 70.A N ARG 16.A O no hydrogen 2.882 N/A ILE 72.A N LYS 69.A O no hydrogen 3.019 N/A GLU 73.A N ASP 78.A OD1 no hydrogen 2.643 N/A MET 75.A N GLU 73.A O no hydrogen 2.794 N/A GLU 77.A N GLU 77.A OE1 no hydrogen 2.428 N/A ASP 78.A N MET 75.A O no hydrogen 2.800 N/A LYS 80.A N ASP 78.A OD2 no hydrogen 2.820 N/A ASN 81.A N ASP 78.A O no hydrogen 2.764 N/A ASN 81.A ND2 MET 75.A O no hydrogen 3.088 N/A LYS 82.A N ASP 78.A O no hydrogen 2.849 N/A LYS 82.A NZ GLU 79.A OE1 no hydrogen 3.126 N/A GLY 84.A N ASN 81.A O no hydrogen 3.016 N/A GLY 85.A N THR 141.A O no hydrogen 3.268 N/A ARG 86.A N GLN 172.A O no hydrogen 2.957 N/A ARG 86.A NE GLN 172.A OE1 no hydrogen 3.451 N/A ARG 86.A NH1 GLN 172.A OE1 no hydrogen 3.389 N/A TRP 87.A N ILE 139.A O no hydrogen 3.019 N/A TRP 87.A NE1 VAL 150.A O no hydrogen 2.781 N/A LEU 88.A N GLY 170.A O no hydrogen 3.070 N/A ILE 89.A N ILE 137.A O no hydrogen 2.827 N/A LEU 91.A N ASP 135.A O no hydrogen 2.920 N/A ASN 92.A N GLN 95.A OE1 no hydrogen 2.669 N/A GLN 94.A N ASN 92.A OD1 no hydrogen 2.757 N/A GLN 95.A N ASN 92.A O no hydrogen 3.256 N/A GLN 95.A N ASN 92.A OD1 no hydrogen 3.175 N/A GLN 95.A NE2 ASP 99.A OD2 no hydrogen 3.422 N/A ARG 96.A N ASN 92.A O no hydrogen 3.248 N/A ARG 96.A NE ASP 135.A OD1 no hydrogen 2.859 N/A ARG 96.A NH2 ASP 135.A OD1 no hydrogen 3.313 N/A ARG 96.A NH2 ASP 135.A OD2 no hydrogen 2.513 N/A SER 98.A OG ASP 99.A OD1 no hydrogen 3.536 N/A ASP 99.A N GLN 95.A O no hydrogen 2.832 N/A LEU 100.A N GLN 95.A O no hydrogen 2.892 N/A ARG 102.A NE SER 98.A O no hydrogen 3.118 N/A PHE 103.A N ASP 99.A O no hydrogen 2.799 N/A TRP 104.A N LEU 100.A O no hydrogen 2.879 N/A LEU 105.A N ASP 101.A O no hydrogen 3.003 N/A GLU 106.A N ARG 102.A O no hydrogen 3.065 N/A THR 107.A N PHE 103.A O no hydrogen 2.850 N/A THR 107.A OG1 PHE 103.A O no hydrogen 2.775 N/A THR 107.A OG1 TYR 157.A OH no hydrogen 2.712 N/A LEU 108.A N TRP 104.A O no hydrogen 2.853 N/A LEU 109.A N LEU 105.A O no hydrogen 2.878 N/A CYS 110.A N GLU 106.A O no hydrogen 2.887 N/A CYS 110.A N THR 107.A O no hydrogen 3.056 N/A CYS 110.A SG GLU 106.A O no hydrogen 3.364 N/A CYS 110.A SG GLU 106.A OE2 no hydrogen 3.761 N/A LEU 111.A N THR 107.A O no hydrogen 3.099 N/A ILE 112.A N LEU 108.A O no hydrogen 3.135 N/A GLU 114.A N LEU 111.A O no hydrogen 3.111 N/A SER 115.A N CYS 110.A O no hydrogen 3.001 N/A SER 115.A OG CYS 110.A O no hydrogen 3.485 N/A PHE 116.A N SER 120.A OG.A no hydrogen 3.283 N/A ASP 117.A N GLU 114.A O no hydrogen 3.213 N/A TYR 119.A OH GLU 148.A OE1 no hydrogen 2.709 N/A SER 120.A N ASP 117.A O no hydrogen 2.939 N/A SER 120.A OG.B GLU 114.A OE1 no hydrogen 2.971 N/A SER 120.A OG.B ASP 117.A O no hydrogen 2.843 N/A ASP 121.A N ASP 118.A O no hydrogen 3.518 N/A ASP 122.A N TYR 119.A O no hydrogen 2.885 N/A VAL 123.A N SER 120.A O no hydrogen 3.310 N/A CYS 124.A N TRP 140.A O no hydrogen 2.855 N/A CYS 124.A SG LYS 80.A O no hydrogen 3.615 N/A CYS 124.A SG ASN 81.A OD1 no hydrogen 3.579 N/A CYS 124.A SG ASP 122.A O no hydrogen 4.031 N/A ALA 126.A N LEU 67.A O no hydrogen 2.846 N/A VAL 127.A N ALA 138.A O no hydrogen 2.777 N/A VAL 128.A N TYR 65.A O no hydrogen 3.092 N/A ASN 129.A N LYS 136.A O no hydrogen 2.591 N/A ASN 129.A ND2 ASP 64.A OD1 no hydrogen 2.516 N/A VAL 130.A N CYS 63.A O no hydrogen 3.067 N/A ARG 131.A N ASP 135.A OD2 no hydrogen 3.018 N/A ARG 131.A NH1 VAL 130.A O no hydrogen 3.118 N/A ARG 131.A NH2 ASP 64.A OD2 no hydrogen 3.379 N/A GLY 134.A N ARG 131.A O no hydrogen 3.133 N/A LYS 136.A N ASN 129.A O no hydrogen 2.834 N/A ILE 137.A N ILE 89.A O no hydrogen 3.086 N/A ALA 138.A N VAL 127.A O no hydrogen 2.634 N/A ILE 139.A N TRP 87.A O no hydrogen 3.030 N/A TRP 140.A N GLY 125.A O no hydrogen 2.767 N/A THR 141.A N GLY 85.A O no hydrogen 3.005 N/A THR 141.A OG1 TYR 171.A OH no hydrogen 2.532 N/A THR 142.A N ASP 122.A O no hydrogen 2.669 N/A THR 142.A OG1 LYS 80.A O no hydrogen 2.755 N/A CYS 144.A N ARG 83.A O no hydrogen 2.753 N/A CYS 144.A SG ARG 83.A O no hydrogen 3.574 N/A GLU 145.A N GLU 143.A OE1 no hydrogen 3.267 N/A ASN 146.A N GLU 143.A O no hydrogen 3.465 N/A ASN 146.A ND2.A ASP 122.A OD2 no hydrogen 2.838 N/A ALA 149.A N ASN 146.A OD1.B no hydrogen 3.267 N/A VAL 150.A N ASN 146.A O no hydrogen 2.792 N/A THR 151.A N ARG 147.A O no hydrogen 3.063 N/A THR 151.A OG1 ARG 147.A O no hydrogen 2.812 N/A HIS 152.A N GLU 148.A O no hydrogen 3.285 N/A ILE 153.A N ALA 149.A O no hydrogen 2.899 N/A GLY 154.A N VAL 150.A O no hydrogen 3.041 N/A ARG 155.A N THR 151.A O no hydrogen 3.077 N/A ARG 155.A N HIS 152.A O no hydrogen 2.914 N/A ARG 155.A NH2 HIS 152.A ND1 no hydrogen 3.511 N/A VAL 156.A N HIS 152.A O no hydrogen 2.828 N/A TYR 157.A N ILE 153.A O no hydrogen 2.948 N/A TYR 157.A OH THR 107.A OG1 no hydrogen 2.712 N/A LYS 158.A N GLY 154.A O no hydrogen 3.131 N/A LYS 158.A NZ ILE 167.A O no hydrogen 2.499 N/A LYS 158.A NZ VAL 187.A O no hydrogen 2.913 N/A GLU 159.A N ARG 155.A O no hydrogen 3.122 N/A ARG 160.A N VAL 156.A O no hydrogen 2.862 N/A ARG 160.A NH1 GLU 106.A OE2 no hydrogen 2.573 N/A LEU 161.A N TYR 157.A O no hydrogen 3.007 N/A GLY 162.A N GLU 159.A O no hydrogen 3.023 N/A LEU 163.A N LYS 158.A O no hydrogen 3.171 N/A ILE 167.A N PRO 164.A O no hydrogen 2.981 N/A ILE 169.A N VAL 187.A O no hydrogen 2.861 N/A TYR 171.A N PHE 185.A O no hydrogen 2.873 N/A TYR 171.A OH THR 141.A OG1 no hydrogen 2.532 N/A GLN 172.A N ARG 86.A O no hydrogen 3.034 N/A GLN 172.A NE2 ASN 183.A OD1 no hydrogen 3.031 N/A HIS 174.A N GLY 84.A O no hydrogen 3.012 N/A ASP 176.A N SER 173.A OG no hydrogen 3.141 N/A THR 177.A N SER 173.A O no hydrogen 3.173 N/A THR 177.A OG1 SER 173.A O no hydrogen 2.980 N/A ALA 178.A N HIS 174.A O no hydrogen 2.787 N/A THR 179.A N ASP 176.A O no hydrogen 3.190 N/A THR 179.A OG1 ALA 175.A O no hydrogen 3.204 N/A THR 179.A OG1 ASP 176.A O no hydrogen 3.420 N/A ARG 184.A N TYR 171.A O no hydrogen 2.645 N/A PHE 185.A N TYR 171.A O no hydrogen 3.465 N/A VAL 187.A N ILE 169.A O no hydrogen 2.975 N/A