Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3q4q_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A N GLU 6.A OE1 no hydrogen 2.850 N/A SER 3.A OG GLU 6.A OE1 no hydrogen 3.313 N/A GLU 6.A N SER 3.A OG no hydrogen 3.021 N/A LYS 7.A N SER 3.A O no hydrogen 2.992 N/A LYS 7.A NZ GLU 4.A OE1 no hydrogen 2.953 N/A GLU 8.A N GLU 4.A O no hydrogen 2.913 N/A GLY 9.A N GLU 5.A O no hydrogen 3.204 N/A LEU 10.A N GLU 6.A O no hydrogen 3.174 N/A ILE 11.A N LYS 7.A O no hydrogen 2.954 N/A GLU 12.A N GLU 8.A O no hydrogen 2.979 N/A MET 13.A N GLY 9.A O no hydrogen 2.902 N/A ARG 14.A N LEU 10.A O no hydrogen 2.832 N/A ARG 14.A NE ASP 61.A OD1 no hydrogen 2.857 N/A ARG 14.A NH1 MET 47.A O no hydrogen 2.912 N/A ARG 14.A NH2 ASP 61.A OD2 no hydrogen 2.806 N/A GLU 16.A N GLU 12.A O no hydrogen 2.875 N/A GLU 17.A N MET 13.A O no hydrogen 3.074 N/A LYS 18.A NZ ASP 22.A OD1 no hydrogen 2.699 N/A LYS 18.A NZ SER 67.A O no hydrogen 2.782 N/A LYS 18.A NZ VAL 70.A O no hydrogen 2.934 N/A LEU 19.A N GLU 15.A O no hydrogen 2.835 N/A ALA 20.A N GLU 16.A O no hydrogen 3.314 N/A ARG 21.A N GLU 17.A O no hydrogen 2.912 N/A ARG 21.A NE ASP 22.A OD2 no hydrogen 2.948 N/A ARG 21.A NH1 GLN 44.A OE1 no hydrogen 2.811 N/A ARG 21.A NH1 ASP 66.A OD1 no hydrogen 3.126 N/A ARG 21.A NH1 ASP 66.A OD2 no hydrogen 3.261 N/A ARG 21.A NH2 ASP 22.A OD2 no hydrogen 2.771 N/A ARG 21.A NH2 ASP 66.A O no hydrogen 2.849 N/A ASP 22.A N LYS 18.A O no hydrogen 2.813 N/A VAL 23.A N LEU 19.A O no hydrogen 2.890 N/A TYR 24.A N ALA 20.A O no hydrogen 2.948 N/A TYR 24.A OH GLY 98.A O no hydrogen 3.206 N/A TYR 24.A OH GLU 102.A OE2 no hydrogen 2.636 N/A LEU 25.A N ARG 21.A O no hydrogen 2.862 N/A THR 26.A N ASP 22.A O no hydrogen 2.960 N/A THR 26.A OG1 ASP 22.A O no hydrogen 2.800 N/A THR 26.A OG1 TYR 80.A OH no hydrogen 2.659 N/A LEU 27.A N VAL 23.A O no hydrogen 2.833 N/A TYR 28.A N TYR 24.A O no hydrogen 2.845 N/A ASN 29.A N LEU 25.A O no hydrogen 3.029 N/A LYS 30.A N THR 26.A O no hydrogen 3.127 N/A TRP 31.A N LEU 27.A O no hydrogen 2.927 N/A TRP 31.A NE1 GLY 87.A O no hydrogen 2.911 N/A LYS 32.A N TYR 28.A O no hydrogen 2.706 N/A GLN 34.A NE2 ASN 38.A OD1 no hydrogen 3.079 N/A PHE 36.A N LEU 33.A O no hydrogen 2.972 N/A ASN 38.A N GLN 34.A O no hydrogen 2.929 N/A ILE 39.A N ILE 35.A O no hydrogen 2.925 N/A ALA 40.A N PHE 36.A O no hydrogen 2.934 N/A GLU 41.A N LYS 37.A O no hydrogen 3.189 N/A SER 42.A N ASN 38.A O no hydrogen 3.258 N/A SER 42.A OG HIS 135.A NE2 no hydrogen 2.921 N/A GLU 43.A N ILE 39.A O no hydrogen 2.767 N/A GLN 44.A N ALA 40.A O no hydrogen 2.987 N/A GLN 44.A NE2 GLN 44.A O no hydrogen 3.275 N/A GLN 44.A NE2 ASP 48.A OD1 no hydrogen 3.060 N/A THR 45.A N GLU 41.A O no hydrogen 3.162 N/A THR 45.A OG1 GLU 41.A O no hydrogen 3.357 N/A HIS 46.A N SER 42.A O no hydrogen 2.997 N/A MET 47.A N GLU 43.A O no hydrogen 2.839 N/A ASP 48.A N GLN 44.A O no hydrogen 2.927 N/A ALA 49.A N THR 45.A O no hydrogen 2.980 N/A VAL 50.A N HIS 46.A O no hydrogen 3.139 N/A LYS 51.A N MET 47.A O no hydrogen 2.967 N/A LYS 51.A NZ ASP 61.A OD2 no hydrogen 2.746 N/A TYR 52.A N ASP 48.A O no hydrogen 2.935 N/A LEU 53.A N ALA 49.A O no hydrogen 3.418 N/A LEU 54.A N VAL 50.A O no hydrogen 2.945 N/A GLU 55.A N LYS 51.A O no hydrogen 2.847 N/A LYS 56.A N TYR 52.A O no hydrogen 2.938 N/A TYR 57.A N LEU 53.A O no hydrogen 3.148 N/A ASN 58.A N GLU 55.A O no hydrogen 3.084 N/A ILE 59.A N LEU 54.A O no hydrogen 2.797 N/A VAL 63.A N ASP 61.A OD1 no hydrogen 2.932 N/A SER 67.A N ASN 65.A OD1 no hydrogen 2.957 N/A SER 67.A OG ASN 65.A OD1 no hydrogen 2.667 N/A GLY 69.A N ASP 22.A OD1 no hydrogen 2.830 N/A VAL 70.A N SER 67.A O no hydrogen 3.255 N/A SER 72.A N GLU 15.A OE2 no hydrogen 2.694 N/A SER 72.A OG PRO 62.A O no hydrogen 2.533 N/A ASN 73.A N GLU 15.A OE1 no hydrogen 2.933 N/A LYS 75.A N ASN 73.A OD1 no hydrogen 2.837 N/A LYS 75.A NZ GLU 12.A OE2 no hydrogen 2.860 N/A PHE 76.A N ASN 73.A O no hydrogen 2.917 N/A GLU 77.A N ASN 73.A O no hydrogen 3.457 N/A GLU 78.A N PRO 74.A O no hydrogen 2.891 N/A LEU 79.A N LYS 75.A O no hydrogen 3.083 N/A TYR 80.A N PHE 76.A O no hydrogen 2.739 N/A TYR 80.A OH THR 26.A OG1 no hydrogen 2.659 N/A LYS 81.A N GLU 77.A O no hydrogen 3.062 N/A LYS 81.A NZ GLU 77.A OE1 no hydrogen 2.962 N/A LYS 82.A N GLU 78.A O no hydrogen 2.947 N/A LEU 83.A N LEU 79.A O no hydrogen 2.959 N/A VAL 84.A N TYR 80.A O no hydrogen 3.058 N/A GLU 85.A N LYS 81.A O no hydrogen 3.229 N/A LYS 86.A N LYS 82.A O no hydrogen 3.018 N/A GLY 87.A N LEU 83.A O no hydrogen 2.827 N/A ASP 88.A N VAL 84.A O no hydrogen 3.000 N/A ASP 88.A N GLU 85.A O no hydrogen 3.339 N/A LYS 89.A N LYS 86.A O no hydrogen 3.149 N/A LYS 89.A NZ LYS 86.A O no hydrogen 3.380 N/A SER 90.A OG ASP 93.A OD2 no hydrogen 2.530 N/A ASP 93.A N SER 90.A OG no hydrogen 2.935 N/A ALA 94.A N SER 90.A O no hydrogen 2.984 N/A LEU 95.A N GLU 91.A O no hydrogen 3.024 N/A LYS 96.A N VAL 92.A O no hydrogen 2.928 N/A LYS 96.A NZ SER 148.A OG no hydrogen 3.384 N/A LYS 96.A NZ ASN 149.A O no hydrogen 2.775 N/A VAL 97.A N ASP 93.A O no hydrogen 2.963 N/A GLY 98.A N ALA 94.A O no hydrogen 2.975 N/A ALA 99.A N LEU 95.A O no hydrogen 3.029 N/A THR 100.A N LYS 96.A O no hydrogen 2.806 N/A THR 100.A OG1 LYS 96.A O no hydrogen 2.781 N/A ILE 101.A N VAL 97.A O no hydrogen 2.984 N/A GLU 102.A N GLY 98.A O no hydrogen 3.062 N/A ASP 103.A N ALA 99.A O no hydrogen 2.915 N/A LEU 104.A N THR 100.A O no hydrogen 2.935 N/A ASP 105.A N ILE 101.A O no hydrogen 3.028 N/A ILE 106.A N GLU 102.A O no hydrogen 2.956 N/A ALA 107.A N ASP 103.A O no hydrogen 3.058 N/A ASP 108.A N LEU 104.A O no hydrogen 2.835 N/A LEU 109.A N ASP 105.A O no hydrogen 2.748 N/A GLU 110.A N ILE 106.A O no hydrogen 2.928 N/A LYS 111.A N ALA 107.A O no hydrogen 3.064 N/A TRP 112.A N ASP 108.A O no hydrogen 3.132 N/A ILE 113.A N LEU 109.A O no hydrogen 2.778 N/A ASN 114.A N GLU 110.A O no hydrogen 3.137 N/A LYS 115.A N TRP 112.A O no hydrogen 3.002 N/A THR 116.A N ILE 113.A O no hydrogen 3.476 N/A THR 116.A OG1 GLU 6.A OE2 no hydrogen 2.584 N/A ASN 118.A N THR 116.A OG1 no hydrogen 2.931 N/A LYS 122.A N ASN 118.A O no hydrogen 2.980 N/A LYS 122.A NZ ILE 113.A O no hydrogen 3.077 N/A PHE 123.A N GLU 119.A O no hydrogen 2.943 N/A VAL 124.A N ASP 120.A O no hydrogen 3.433 N/A TYR 125.A N ILE 121.A O no hydrogen 2.916 N/A GLU 126.A N LYS 122.A O no hydrogen 2.681 N/A ASN 127.A N PHE 123.A O no hydrogen 2.911 N/A LEU 128.A N VAL 124.A O no hydrogen 2.801 N/A MET 129.A N TYR 125.A O no hydrogen 2.857 N/A LYS 130.A N GLU 126.A O no hydrogen 2.938 N/A GLY 131.A N ASN 127.A O no hydrogen 2.985 N/A SER 132.A N LEU 128.A O no hydrogen 2.903 N/A SER 132.A OG ASP 105.A OD2 no hydrogen 2.575 N/A SER 132.A OG LEU 128.A O no hydrogen 3.047 N/A ARG 133.A N MET 129.A O no hydrogen 2.953 N/A ARG 133.A NE GLU 169.A OE2 no hydrogen 2.731 N/A ARG 133.A NH2 GLU 169.A OE1 no hydrogen 3.068 N/A ARG 133.A NH2 GLU 169.A OE2 no hydrogen 3.396 N/A ASN 134.A N LYS 130.A O no hydrogen 3.081 N/A HIS 135.A N GLY 131.A O no hydrogen 2.854 N/A MET 136.A N SER 132.A O no hydrogen 2.860 N/A ARG 137.A N ARG 133.A O no hydrogen 3.006 N/A ARG 137.A NE ILE 163.A O no hydrogen 3.053 N/A ARG 137.A NE SER 166.A O no hydrogen 3.252 N/A ARG 137.A NH1 GLU 169.A OE2 no hydrogen 3.149 N/A ARG 137.A NH2 ILE 163.A O no hydrogen 3.434 N/A ARG 137.A NH2 SER 166.A OG no hydrogen 2.974 N/A ARG 137.A NH2 GLU 169.A OE2 no hydrogen 3.213 N/A ALA 138.A N ASN 134.A O no hydrogen 2.993 N/A PHE 139.A N HIS 135.A O no hydrogen 2.880 N/A VAL 140.A N MET 136.A O no hydrogen 2.964 N/A ARG 141.A N ARG 137.A O no hydrogen 2.981 N/A MET 142.A N ALA 138.A O no hydrogen 3.047 N/A LEU 143.A N PHE 139.A O no hydrogen 2.876 N/A ASN 144.A N VAL 140.A O no hydrogen 2.797 N/A ASN 144.A ND2 SER 148.A O no hydrogen 3.000 N/A ASN 145.A N ARG 141.A O no hydrogen 3.109 N/A TYR 146.A N MET 142.A O no hydrogen 3.298 N/A TYR 146.A N LEU 143.A O no hydrogen 2.978 N/A TYR 146.A OH GLU 91.A OE2 no hydrogen 2.539 N/A GLY 147.A N ASN 144.A O no hydrogen 2.796 N/A SER 148.A N LEU 143.A O no hydrogen 2.796 N/A SER 148.A OG ASN 149.A O no hydrogen 3.448 N/A ASN 149.A N SER 148.A OG no hydrogen 2.772 N/A TYR 150.A OH ASP 103.A OD2 no hydrogen 2.552 N/A GLN 153.A N ASP 103.A OD2 no hydrogen 2.762 N/A TYR 154.A N ASP 103.A OD1 no hydrogen 3.016 N/A TYR 154.A N ASP 103.A OD2 no hydrogen 3.447 N/A ILE 155.A N ASP 103.A OD1 no hydrogen 2.823 N/A GLU 159.A N SER 156.A OG no hydrogen 2.916 N/A TYR 160.A N SER 156.A O no hydrogen 2.931 N/A GLU 161.A N LYS 157.A O no hydrogen 3.041 N/A GLU 162.A N GLU 158.A O no hydrogen 3.032 N/A ILE 163.A N GLU 159.A O no hydrogen 3.007 N/A ILE 164.A N TYR 160.A O no hydrogen 3.046 N/A SER 165.A N GLU 161.A O no hydrogen 3.092 N/A SER 165.A OG GLU 161.A O no hydrogen 2.807 N/A SER 165.A OG GLU 162.A O no hydrogen 3.516 N/A SER 166.A N ILE 163.A O no hydrogen 3.248 N/A SER 166.A OG GLU 162.A O no hydrogen 2.799 N/A SER 166.A OG ILE 163.A O no hydrogen 2.845 N/A