Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3toj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG ASP 3.A OD1.A no hydrogen 2.773 N/A ASP 3.A N SER 1.A OG no hydrogen 3.046 N/A TYR 5.A N GLY 2.A O no hydrogen 2.911 N/A ARG 6.A N ASP 3.A O no hydrogen 3.346 N/A ARG 6.A NE GLU 195.A OE2.A no hydrogen 3.301 N/A ARG 6.A NH1 ASP 3.A O no hydrogen 3.496 N/A ARG 6.A NH2 GLU 195.A OE2.A no hydrogen 2.675 N/A CYS 8.A SG LEU 9.A O no hydrogen 3.984 N/A LEU 9.A N ALA 192.A O no hydrogen 2.877 N/A TYR 10.A OH SER 186.A O no hydrogen 2.690 N/A GLU 11.A N GLY 189.A O no hydrogen 2.914 N/A LEU 14.A N SER 45.A OG no hydrogen 2.966 N/A LEU 15.A N ARG 30.A O no hydrogen 3.017 N/A ALA 16.A N ARG 43.A O no hydrogen 2.947 N/A ARG 20.A N HIS 18.A O no hydrogen 2.915 N/A ARG 20.A NE LEU 17.A O no hydrogen 2.838 N/A ALA 21.A N MET 41.A O no hydrogen 3.007 N/A GLN 23.A N GLN 23.A OE1 no hydrogen 2.787 N/A GLN 23.A NE2 GLN 80.A OE1 no hydrogen 2.856 N/A LEU 24.A N ALA 21.A O no hydrogen 3.237 N/A LYS 25.A N VAL 34.A O no hydrogen 3.111 N/A LYS 25.A NZ GLY 35.A O no hydrogen 3.221 N/A LYS 25.A NZ GLU 36.A OE1 no hydrogen 2.716 N/A SER 27.A N THR 32.A O no hydrogen 2.835 N/A SER 27.A OG ASP 29.A OD1 no hydrogen 2.648 N/A SER 27.A OG THR 32.A O no hydrogen 3.282 N/A ARG 30.A N SER 27.A O no hydrogen 3.021 N/A ARG 30.A NH2 ALA 16.A O no hydrogen 3.140 N/A LEU 31.A N ASP 29.A OD1 no hydrogen 3.174 N/A THR 32.A N SER 27.A OG no hydrogen 3.034 N/A THR 32.A OG1 SER 166.A OG no hydrogen 2.878 N/A VAL 33.A N VAL 165.A O no hydrogen 3.080 N/A VAL 34.A N LYS 25.A O no hydrogen 2.912 N/A GLY 35.A N CYS 163.A O no hydrogen 3.034 N/A LYS 37.A NZ GLU 36.A OE2 no hydrogen 2.656 N/A SER 40.A N LEU 159.A O no hydrogen 3.411 N/A MET 41.A N LEU 79.A O no hydrogen 2.858 N/A VAL 42.A N ILE 157.A O no hydrogen 2.897 N/A ARG 43.A NE ASP 19.A OD2 no hydrogen 2.892 N/A ARG 43.A NH1 GLY 77.A O no hydrogen 2.904 N/A ARG 43.A NH2 ASP 19.A OD1 no hydrogen 2.985 N/A ALA 44.A N PRO 155.A O no hydrogen 2.925 N/A SER 45.A N LEU 14.A O no hydrogen 2.732 N/A SER 45.A OG LEU 14.A O no hydrogen 3.222 N/A SER 45.A OG HIS 46.A ND1 no hydrogen 2.665 N/A HIS 46.A ND1 SER 45.A OG no hydrogen 2.665 N/A HIS 46.A NE2 GLU 11.A OE2 no hydrogen 2.887 N/A VAL 48.A N TYR 153.A O no hydrogen 2.862 N/A GLY 51.A N LEU 124.A O no hydrogen 2.967 N/A TRP 53.A N ILE 122.A O no hydrogen 2.900 N/A TRP 53.A NE1 LYS 50.A O no hydrogen 3.048 N/A TYR 54.A N ARG 183.A O no hydrogen 3.083 N/A PHE 55.A N PHE 120.A O no hydrogen 3.111 N/A GLU 56.A N ASN 168.A O no hydrogen 2.985 N/A ILE 57.A N LEU 118.A O no hydrogen 2.973 N/A THR 58.A N SER 166.A O no hydrogen 2.810 N/A VAL 59.A N ASP 116.A O no hydrogen 3.037 N/A GLU 61.A N THR 164.A O no hydrogen 3.073 N/A MET 62.A N GLN 114.A OE1 no hydrogen 2.963 N/A THR 66.A N PRO 63.A O no hydrogen 3.188 N/A THR 66.A OG1 PRO 63.A O no hydrogen 2.667 N/A ALA 67.A N TYR 160.A O no hydrogen 3.169 N/A ALA 68.A N SER 94.A OG no hydrogen 3.009 N/A ARG 69.A N SER 158.A O no hydrogen 2.974 N/A ARG 69.A NH1 LEU 83.A O no hydrogen 3.163 N/A LEU 70.A N TRP 92.A O no hydrogen 3.091 N/A GLY 71.A N ALA 156.A O no hydrogen 3.084 N/A TRP 72.A N TYR 90.A O no hydrogen 3.140 N/A SER 73.A N PHE 154.A O no hydrogen 2.904 N/A SER 73.A OG GLN 74.A O no hydrogen 2.658 N/A GLN 74.A N PHE 88.A O no hydrogen 2.833 N/A GLY 77.A N GLN 74.A O no hydrogen 3.019 N/A ASN 78.A N ASP 86.A OD2 no hydrogen 3.360 N/A GLN 80.A N ASN 78.A OD1 no hydrogen 2.744 N/A GLN 80.A NE2 GLN 23.A OE1 no hydrogen 3.193 N/A LEU 83.A N SER 158.A OG no hydrogen 2.940 N/A GLY 84.A N SER 89.A OG no hydrogen 2.699 N/A TYR 85.A N PRO 82.A O no hydrogen 3.075 N/A PHE 88.A N ASP 86.A OD1 no hydrogen 2.980 N/A TYR 90.A N TRP 72.A O no hydrogen 3.061 N/A SER 91.A N PHE 100.A O no hydrogen 2.970 N/A SER 91.A OG LEU 83.A O no hydrogen 2.760 N/A TRP 92.A N LEU 70.A O no hydrogen 2.819 N/A TRP 92.A NE1 SER 109.A OG no hydrogen 3.069 N/A ARG 93.A N THR 98.A O no hydrogen 2.793 N/A ARG 93.A NE LYS 95.A O no hydrogen 2.959 N/A ARG 93.A NH2 THR 98.A OG1 no hydrogen 3.024 N/A SER 94.A N ALA 68.A O no hydrogen 2.949 N/A SER 94.A OG ALA 68.A O no hydrogen 3.350 N/A THR 98.A OG1 LYS 95.A O no hydrogen 3.392 N/A LYS 99.A N LYS 106.A O no hydrogen 3.081 N/A LYS 99.A NZ ALA 144.A O no hydrogen 2.744 N/A PHE 100.A N SER 91.A O no hydrogen 3.018 N/A HIS 101.A N ILE 104.A O no hydrogen 3.313 N/A HIS 101.A ND1 SER 89.A O no hydrogen 2.879 N/A GLN 102.A N ASP 86.A O no hydrogen 3.041 N/A GLN 102.A NE2 HIS 101.A NE2 no hydrogen 2.954 N/A SER 103.A N GLY 84.A O no hydrogen 2.926 N/A SER 103.A OG TYR 85.A O no hydrogen 2.514 N/A ILE 104.A N HIS 101.A O no hydrogen 3.013 N/A LYS 106.A N LYS 99.A O no hydrogen 2.884 N/A TYR 108.A OH GLY 142.A O no hydrogen 2.594 N/A SER 109.A N GLY 97.A O no hydrogen 3.175 N/A SER 109.A OG GLY 97.A O no hydrogen 3.543 N/A SER 109.A OG SER 110.A O no hydrogen 2.809 N/A TYR 112.A N SER 94.A O no hydrogen 3.023 N/A TYR 112.A OH TRP 92.A O no hydrogen 2.801 N/A GLY 113.A N ASP 116.A OD2 no hydrogen 2.853 N/A GLY 115.A N VAL 59.A O no hydrogen 2.736 N/A ASP 116.A N GLY 113.A O no hydrogen 3.056 N/A VAL 117.A N ASN 137.A OD1 no hydrogen 2.950 N/A LEU 118.A N ILE 57.A O no hydrogen 2.764 N/A GLY 119.A N TYR 135.A O no hydrogen 2.747 N/A PHE 120.A N PHE 55.A O no hydrogen 2.935 N/A TYR 121.A N ILE 133.A O no hydrogen 3.006 N/A ILE 122.A N TRP 53.A O no hydrogen 3.093 N/A ASN 123.A N GLU 131.A O no hydrogen 2.998 N/A LEU 124.A N GLY 51.A O no hydrogen 2.862 N/A SER 129.A OG SER 130.A O no hydrogen 3.533 N/A SER 129.A OG ASP 147.A OD1 no hydrogen 2.996 N/A GLU 131.A N ASN 123.A O no hydrogen 3.067 N/A ILE 132.A N TYR 145.A O no hydrogen 2.889 N/A ILE 133.A N TYR 121.A O no hydrogen 3.081 N/A PHE 134.A N TYR 108.A OH no hydrogen 3.336 N/A TYR 135.A N GLY 119.A O no hydrogen 2.822 N/A TYR 135.A OH ASP 179.A OD2 no hydrogen 2.917 N/A LYS 136.A N VAL 139.A O no hydrogen 2.998 N/A LYS 136.A NZ GLY 111.A O no hydrogen 2.773 N/A ASN 137.A N VAL 117.A O no hydrogen 2.899 N/A ASN 137.A ND2 ASP 116.A OD1 no hydrogen 3.160 N/A VAL 139.A N LYS 136.A O no hydrogen 2.989 N/A ASN 140.A ND2 ASP 179.A OD1 no hydrogen 3.218 N/A GLN 141.A N PHE 134.A O no hydrogen 2.921 N/A GLN 141.A NE2 VAL 139.A O no hydrogen 2.910 N/A GLY 142.A N ASN 140.A OD1 no hydrogen 2.570 N/A ALA 144.A N ILE 132.A O no hydrogen 2.936 N/A TYR 145.A N ILE 132.A O no hydrogen 3.515 N/A ASP 147.A N SER 130.A O no hydrogen 2.921 N/A ILE 148.A N SER 130.A OG no hydrogen 2.950 N/A PHE 149.A N TYR 90.A OH no hydrogen 3.188 N/A TYR 153.A N VAL 48.A O no hydrogen 2.861 N/A TYR 153.A OH PHE 149.A O no hydrogen 2.587 N/A PHE 154.A N SER 73.A O no hydrogen 2.799 N/A ALA 156.A N GLY 71.A O no hydrogen 2.892 N/A ILE 157.A N VAL 42.A O no hydrogen 2.997 N/A SER 158.A N ARG 69.A O no hydrogen 3.109 N/A SER 158.A OG ARG 69.A O no hydrogen 2.825 N/A LEU 159.A N SER 40.A O no hydrogen 3.157 N/A TYR 160.A N ALA 67.A O no hydrogen 2.822 N/A LYS 161.A N LYS 37.A O no hydrogen 2.760 N/A LYS 161.A NZ ASP 65.A OD2 no hydrogen 2.687 N/A SER 162.A OG GLY 35.A O no hydrogen 3.276 N/A CYS 163.A N LYS 161.A O no hydrogen 2.895 N/A CYS 163.A SG ALA 67.A O no hydrogen 3.249 N/A CYS 163.A SG TYR 160.A O no hydrogen 3.940 N/A CYS 163.A SG LYS 161.A O no hydrogen 3.933 N/A THR 164.A N GLU 61.A O no hydrogen 2.763 N/A VAL 165.A N VAL 33.A O no hydrogen 3.168 N/A SER 166.A N THR 58.A O no hydrogen 2.875 N/A SER 166.A OG THR 32.A OG1 no hydrogen 2.878 N/A SER 166.A OG ASP 60.A OD1 no hydrogen 3.547 N/A SER 166.A OG ASP 60.A OD2 no hydrogen 2.519 N/A ILE 167.A N LEU 31.A O no hydrogen 2.846 N/A ASN 168.A N GLU 56.A O no hydrogen 2.773 N/A ASN 168.A ND2 CYS 172.A O no hydrogen 2.828 N/A GLY 170.A N ASN 168.A OD1 no hydrogen 2.774 N/A LYS 174.A N GLU 56.A OE1 no hydrogen 2.851 N/A TYR 175.A N GLU 56.A OE2 no hydrogen 2.828 N/A ASP 179.A N ASP 179.A OD2 no hydrogen 2.573 N/A ARG 183.A N ALA 52.A O no hydrogen 2.991 N/A MET 185.A N TYR 54.A O no hydrogen 2.973 N/A SER 186.A N PHE 169.A O no hydrogen 2.856 N/A SER 186.A OG PHE 169.A O no hydrogen 3.497 N/A ASP 187.A N PRO 184.A O no hydrogen 2.887 N/A MET 188.A N MET 185.A O no hydrogen 2.872 N/A GLY 189.A N SER 186.A O no hydrogen 3.109 N/A TRP 190.A N ASP 187.A O no hydrogen 3.458 N/A TRP 190.A NE1 ASP 187.A OD1 no hydrogen 3.168 N/A GLY 191.A N LEU 9.A O no hydrogen 2.711 N/A VAL 194.A N ALA 7.A O no hydrogen 2.788 N/A