Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4w7r_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 3.A N GLU 6.A OE1 no hydrogen 3.166 N/A GLY 4.A N MET 85.A O no hydrogen 2.764 N/A LEU 7.A N GLY 4.A O no hydrogen 2.974 N/A PHE 8.A N GLU 5.A O no hydrogen 2.530 N/A THR 9.A OG1 GLU 6.A O no hydrogen 3.166 N/A VAL 12.A N GLY 35.A O no hydrogen 2.824 N/A ILE 14.A N GLY 33.A O no hydrogen 2.824 N/A LEU 15.A N LEU 116.A O no hydrogen 2.961 N/A ILE 16.A N GLY 31.A O no hydrogen 2.949 N/A GLU 17.A N ASN 118.A O no hydrogen 2.907 N/A LEU 18.A N VAL 29.A O no hydrogen 2.790 N/A ASP 19.A N ILE 120.A O no hydrogen 2.854 N/A GLY 20.A N PHE 27.A O no hydrogen 2.868 N/A ASP 21.A N LEU 122.A O no hydrogen 2.978 N/A VAL 22.A N HIS 25.A O no hydrogen 2.802 N/A ASN 23.A N GLY 124.A O no hydrogen 2.953 N/A ASN 23.A ND2 PHE 127.A O no hydrogen 2.832 N/A HIS 25.A N VAL 22.A O no hydrogen 2.851 N/A HIS 25.A ND1 VAL 22.A O no hydrogen 3.194 N/A LYS 26.A NZ GLY 24.A O no hydrogen 2.741 N/A PHE 27.A N GLY 20.A O no hydrogen 2.964 N/A PHE 28.A N THR 50.A OG1 no hydrogen 3.006 N/A VAL 29.A N LEU 18.A O no hydrogen 2.886 N/A ARG 30.A N ILE 47.A O no hydrogen 3.033 N/A ARG 30.A NE GLU 17.A OE2 no hydrogen 3.176 N/A ARG 30.A NH2 GLU 17.A OE2 no hydrogen 3.310 N/A GLY 31.A N ILE 16.A O no hydrogen 2.809 N/A GLU 32.A N LYS 45.A O no hydrogen 2.905 N/A GLY 33.A N ILE 14.A O no hydrogen 3.264 N/A GLU 34.A N SER 43.A O no hydrogen 2.979 N/A GLY 35.A N VAL 12.A O no hydrogen 2.942 N/A ASP 36.A N LYS 41.A O no hydrogen 2.827 N/A THR 38.A N ASP 36.A OD1 no hydrogen 3.116 N/A THR 38.A OG1 ASP 36.A OD1 no hydrogen 2.509 N/A ILE 39.A N ASP 36.A O no hydrogen 3.284 N/A LYS 41.A N ASP 36.A O no hydrogen 2.954 N/A LYS 41.A NZ TYR 220.A OH no hydrogen 3.200 N/A LEU 42.A N GLU 219.A O no hydrogen 2.795 N/A SER 43.A N GLU 34.A O no hydrogen 2.879 N/A LEU 44.A N LEU 217.A O no hydrogen 2.869 N/A LYS 45.A N GLU 32.A O no hydrogen 2.904 N/A LYS 45.A NZ ASP 207.A OD2 no hydrogen 2.935 N/A LYS 45.A NZ GLU 210.A OE1 no hydrogen 2.854 N/A PHE 46.A N MET 215.A O no hydrogen 2.736 N/A ILE 47.A N ARG 30.A O no hydrogen 2.760 N/A ALA 48.A N ASP 213.A O no hydrogen 2.948 N/A THR 49.A N PHE 28.A O no hydrogen 3.072 N/A THR 49.A OG1 PHE 28.A O no hydrogen 3.512 N/A GLY 51.A N ALA 48.A O no hydrogen 3.341 N/A LEU 53.A N ASP 213.A OD2 no hydrogen 3.028 N/A TRP 57.A NE1 ASP 213.A OD1 no hydrogen 2.906 N/A THR 59.A N PRO 56.A O no hydrogen 2.957 N/A THR 59.A OG1 PRO 56.A O no hydrogen 2.691 N/A THR 59.A OG1 TYR 103.A OH no hydrogen 2.854 N/A LEU 60.A N TRP 57.A O no hydrogen 3.114 N/A VAL 61.A N PRO 58.A O no hydrogen 3.401 N/A THR 62.A OG1 HIS 178.A NE2 no hydrogen 2.795 N/A THR 63.A N LEU 60.A O no hydrogen 2.891 N/A LEU 64.A N LEU 60.A O no hydrogen 2.925 N/A PHE 68.A N VAL 65.A O no hydrogen 3.036 N/A SER 69.A N GLN 66.A O no hydrogen 3.101 N/A SER 69.A OG GLN 66.A O no hydrogen 2.775 N/A ARG 70.A N VAL 221.A O no hydrogen 2.943 N/A TYR 71.A OH HIS 196.A NE2 no hydrogen 2.915 N/A MET 75.A N PRO 72.A O no hydrogen 2.820 N/A LYS 76.A N ASP 73.A O no hydrogen 3.488 N/A LYS 76.A NZ GLU 5.A OE2 no hydrogen 2.410 N/A ARG 77.A NH2 ASP 194.A OD2 no hydrogen 3.549 N/A HIS 78.A N MET 75.A O no hydrogen 2.845 N/A ASP 79.A N LYS 76.A O no hydrogen 3.277 N/A PHE 80.A N HIS 78.A O no hydrogen 3.084 N/A LYS 82.A N ASP 79.A OD1 no hydrogen 3.122 N/A LYS 82.A NZ ALA 67.A O no hydrogen 2.852 N/A LYS 82.A NZ SER 69.A O no hydrogen 2.893 N/A LYS 82.A NZ ASP 79.A OD2 no hydrogen 2.792 N/A SER 83.A N ASP 79.A O no hydrogen 3.384 N/A SER 83.A OG PHE 80.A O no hydrogen 2.750 N/A ALA 84.A N PHE 80.A O no hydrogen 3.244 N/A MET 85.A N LYS 82.A O no hydrogen 3.067 N/A GLU 87.A N GLU 87.A OE1 no hydrogen 2.602 N/A GLY 88.A N ALA 84.A O no hydrogen 2.798 N/A TYR 89.A N VAL 109.A O no hydrogen 2.904 N/A VAL 90.A N THR 183.A O no hydrogen 2.830 N/A GLN 91.A N ALA 107.A O no hydrogen 2.825 N/A GLU 92.A N GLN 181.A O no hydrogen 2.847 N/A ARG 93.A N THR 105.A O no hydrogen 3.048 N/A ARG 93.A NE GLN 180.A OE1 no hydrogen 2.930 N/A ARG 93.A NH1 THR 62.A O no hydrogen 2.916 N/A ARG 93.A NH2 GLN 180.A OE1 no hydrogen 2.765 N/A THR 94.A N TYR 179.A O no hydrogen 2.901 N/A ILE 95.A N TYR 103.A O no hydrogen 2.852 N/A TYR 96.A N ASP 177.A O no hydrogen 3.019 N/A PHE 97.A N GLY 101.A O no hydrogen 3.039 N/A LYS 98.A N LEU 175.A O no hydrogen 3.140 N/A LYS 98.A NZ ASP 177.A OD2 no hydrogen 3.126 N/A ASP 100.A N PHE 97.A O no hydrogen 2.834 N/A GLY 101.A N ASP 100.A OD1 no hydrogen 2.697 N/A THR 102.A N ILE 125.A O no hydrogen 2.795 N/A TYR 103.A N ILE 95.A O no hydrogen 2.840 N/A TYR 103.A OH THR 59.A OG1 no hydrogen 2.854 N/A LYS 104.A N HIS 123.A O no hydrogen 2.686 N/A LYS 104.A NZ THR 94.A OG1 no hydrogen 2.739 N/A THR 105.A N ARG 93.A O no hydrogen 3.038 N/A ARG 106.A N HIS 121.A O no hydrogen 3.121 N/A ALA 107.A N GLN 91.A O no hydrogen 2.730 N/A GLU 108.A N ARG 119.A O no hydrogen 2.928 N/A VAL 109.A N TYR 89.A O no hydrogen 2.930 N/A LYS 110.A N VAL 117.A O no hydrogen 3.027 N/A LYS 110.A NZ GLU 112.A OE2 no hydrogen 2.983 N/A PHE 111.A N PRO 86.A O no hydrogen 3.070 N/A GLU 112.A N THR 115.A O no hydrogen 2.827 N/A THR 115.A N GLU 112.A O no hydrogen 3.127 N/A LEU 116.A N PRO 13.A O no hydrogen 2.994 N/A VAL 117.A N LYS 110.A O no hydrogen 2.799 N/A ASN 118.A N LEU 15.A O no hydrogen 2.780 N/A ASN 118.A ND2 THR 63.A O no hydrogen 3.345 N/A ASN 118.A ND2 LEU 64.A O no hydrogen 2.782 N/A ARG 119.A N GLU 108.A O no hydrogen 2.909 N/A ARG 119.A NE GLU 112.A OE2 no hydrogen 2.858 N/A ARG 119.A NH2 GLU 112.A OE1 no hydrogen 2.983 N/A ARG 119.A NH2 GLU 112.A OE2 no hydrogen 3.206 N/A ILE 120.A N GLU 17.A O no hydrogen 2.737 N/A HIS 121.A N ARG 106.A O no hydrogen 3.048 N/A HIS 121.A NE2 HIS 123.A NE2 no hydrogen 2.949 N/A LEU 122.A N ASP 19.A O no hydrogen 2.828 N/A HIS 123.A N LYS 104.A O no hydrogen 2.763 N/A HIS 123.A NE2 HIS 121.A NE2 no hydrogen 2.949 N/A GLY 124.A N ASP 21.A O no hydrogen 2.793 N/A ILE 125.A N THR 102.A O no hydrogen 2.839 N/A PHE 127.A N ASN 23.A OD1 no hydrogen 3.117 N/A LYS 128.A N ASP 100.A OD1 no hydrogen 2.874 N/A LYS 128.A NZ ASP 99.A O no hydrogen 2.950 N/A ASP 130.A N ASP 130.A OD1 no hydrogen 2.427 N/A GLY 131.A N LYS 128.A O no hydrogen 3.280 N/A ASN 132.A ND2 GLN 174.A OE1 no hydrogen 2.919 N/A GLY 135.A N GLY 131.A O no hydrogen 2.895 N/A HIS 136.A N ILE 133.A O no hydrogen 2.855 N/A LYS 137.A N ASN 132.A O no hydrogen 2.978 N/A LYS 137.A NZ ASP 130.A O no hydrogen 2.883 N/A GLU 139.A N ASN 167.A O no hydrogen 2.851 N/A TYR 140.A OH SER 205.A O no hydrogen 2.583 N/A ASN 141.A ND2 GLU 139.A OE1 no hydrogen 2.925 N/A ASN 143.A ND2 ARG 165.A O no hydrogen 2.924 N/A ASN 143.A ND2 ASN 167.A OD1 no hydrogen 3.086 N/A HIS 145.A N THR 200.A O no hydrogen 3.244 N/A HIS 145.A N THR 200.A OG1 no hydrogen 3.066 N/A VAL 147.A N LEU 198.A O no hydrogen 2.857 N/A TYR 148.A N ASN 161.A O no hydrogen 3.114 N/A ILE 149.A N HIS 196.A O no hydrogen 2.854 N/A THR 150.A N LYS 159.A O no hydrogen 2.821 N/A THR 150.A OG1 ASP 195.A OD1 no hydrogen 2.710 N/A ASP 152.A N GLY 157.A O no hydrogen 2.585 N/A ASN 155.A N ASP 152.A O no hydrogen 3.211 N/A ASN 155.A ND2 ASP 152.A OD2 no hydrogen 2.565 N/A ASN 155.A ND2 GLN 181.A OE1 no hydrogen 3.081 N/A ASN 156.A N LYS 153.A O no hydrogen 3.339 N/A GLY 157.A N ASP 152.A O no hydrogen 2.890 N/A ILE 158.A N ASN 182.A O no hydrogen 3.013 N/A LYS 159.A N THR 150.A O no hydrogen 2.734 N/A ALA 160.A N GLN 180.A O no hydrogen 2.895 N/A ASN 161.A N TYR 148.A O no hydrogen 3.080 N/A PHE 162.A N HIS 178.A O no hydrogen 3.292 N/A THR 163.A OG1 ASP 177.A OD1 no hydrogen 2.742 N/A ILE 164.A N ALA 176.A O no hydrogen 2.894 N/A ARG 165.A N HIS 145.A NE2 no hydrogen 3.019 N/A HIS 166.A N GLN 174.A O no hydrogen 2.784 N/A ASN 167.A ND2 ASN 141.A OD1 no hydrogen 3.686 N/A VAL 168.A N SER 172.A O no hydrogen 2.807 N/A GLU 169.A N LYS 137.A O no hydrogen 2.831 N/A GLY 171.A N VAL 168.A O no hydrogen 2.919 N/A SER 172.A N ASP 170.A OD1 no hydrogen 2.913 N/A SER 172.A OG ASP 170.A OD1 no hydrogen 2.555 N/A SER 172.A OG ASP 170.A OD2 no hydrogen 3.508 N/A GLN 174.A N HIS 166.A O no hydrogen 2.738 N/A GLN 174.A NE2 LYS 98.A O no hydrogen 3.021 N/A GLN 174.A NE2 LEU 175.A O no hydrogen 3.060 N/A ALA 176.A N ILE 164.A O no hydrogen 2.870 N/A ASP 177.A N TYR 96.A O no hydrogen 2.888 N/A HIS 178.A N PHE 162.A O no hydrogen 2.614 N/A HIS 178.A ND1 ALA 176.A O no hydrogen 2.967 N/A HIS 178.A NE2 THR 62.A OG1 no hydrogen 2.795 N/A TYR 179.A N THR 94.A O no hydrogen 2.846 N/A GLN 180.A N ALA 160.A O no hydrogen 2.926 N/A GLN 180.A NE2 GLN 66.A OE1 no hydrogen 2.873 N/A GLN 180.A NE2 ASN 182.A OD1 no hydrogen 2.926 N/A GLN 181.A N GLU 92.A O no hydrogen 2.863 N/A ASN 182.A N ILE 158.A O no hydrogen 2.897 N/A ASN 182.A ND2 GLN 91.A OE1 no hydrogen 3.053 N/A THR 183.A N VAL 90.A O no hydrogen 3.129 N/A ILE 185.A N GLY 88.A O no hydrogen 2.896 N/A ASP 191.A N SER 83.A OG no hydrogen 3.038 N/A ASP 194.A N HIS 78.A ND1 no hydrogen 3.159 N/A HIS 196.A N ILE 149.A O no hydrogen 3.173 N/A HIS 196.A ND1 ASP 194.A O no hydrogen 2.707 N/A HIS 196.A NE2 TYR 71.A OH no hydrogen 2.915 N/A TYR 197.A N ALA 224.A O no hydrogen 3.078 N/A LEU 198.A N VAL 147.A O no hydrogen 2.795 N/A SER 199.A N THR 222.A O no hydrogen 2.869 N/A THR 200.A N HIS 145.A O no hydrogen 3.081 N/A THR 200.A OG1 HIS 145.A O no hydrogen 3.249 N/A GLN 201.A N TYR 220.A O no hydrogen 3.016 N/A THR 202.A OG1 GLU 219.A OE1 no hydrogen 3.106 N/A ILE 203.A N LEU 218.A O no hydrogen 2.734 N/A SER 205.A N VAL 216.A O no hydrogen 2.833 N/A LYS 206.A NZ HIS 214.A O no hydrogen 2.670 N/A ASP 207.A N HIS 214.A NE2 no hydrogen 2.817 N/A ASN 209.A N ASP 207.A OD1 no hydrogen 2.911 N/A GLU 210.A N ASP 207.A O no hydrogen 2.926 N/A ARG 212.A N GLU 210.A OE2 no hydrogen 2.949 N/A ARG 212.A NE GLU 210.A OE2 no hydrogen 2.807 N/A ARG 212.A NH2 GLU 210.A OE1 no hydrogen 3.030 N/A HIS 214.A ND1 ARG 212.A O no hydrogen 2.734 N/A MET 215.A N PHE 46.A O no hydrogen 2.927 N/A VAL 216.A N SER 205.A O no hydrogen 2.944 N/A LEU 217.A N LEU 44.A O no hydrogen 2.684 N/A LEU 218.A N ILE 203.A O no hydrogen 2.978 N/A GLU 219.A N LEU 42.A O no hydrogen 3.086 N/A TYR 220.A N GLN 201.A O no hydrogen 2.981 N/A VAL 221.A N GLY 40.A O no hydrogen 2.913 N/A THR 222.A N SER 199.A O no hydrogen 3.059 N/A ALA 223.A N ARG 70.A O no hydrogen 2.953 N/A ALA 224.A N TYR 197.A O no hydrogen 2.888 N/A