Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4mdj_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A N ASP 1.A OD1 no hydrogen 3.140 N/A ARG 3.A NE ASP 1.A OD1 no hydrogen 3.081 N/A ARG 3.A NH2 ASP 1.A OD2 no hydrogen 2.821 N/A ARG 5.A NH1 ASP 1.A OD1 no hydrogen 2.971 N/A ARG 5.A NH1 ARG 3.A O no hydrogen 2.940 N/A ARG 5.A NH2 ASP 1.A OD2 no hydrogen 2.892 N/A LEU 7.A N HIS 32.A ND1 no hydrogen 3.345 N/A GLN 9.A N PHE 30.A O no hydrogen 2.965 N/A GLN 9.A NE2 HIS 32.A O no hydrogen 2.937 N/A LYS 11.A N ARG 28.A O no hydrogen 2.876 N/A HIS 12.A ND1 ASP 27.A OD1 no hydrogen 2.679 N/A GLU 13.A N LEU 26.A O no hydrogen 2.754 N/A HIS 15.A N ARG 24.A O no hydrogen 2.801 N/A HIS 15.A NE2 GLU 13.A OE1 no hydrogen 2.813 N/A PHE 17.A N ARG 22.A O no hydrogen 2.888 N/A GLU 21.A N ASN 18.A O no hydrogen 3.153 N/A ARG 22.A N PHE 17.A O no hydrogen 3.228 N/A ARG 24.A N HIS 15.A O no hydrogen 2.905 N/A ARG 24.A NE ASP 40.A OD1 no hydrogen 2.988 N/A PHE 25.A N SER 41.A OG no hydrogen 2.834 N/A LEU 26.A N GLU 13.A O no hydrogen 2.891 N/A ASP 27.A N PHE 39.A O no hydrogen 2.851 N/A ARG 28.A N LYS 11.A O no hydrogen 2.880 N/A ARG 28.A NE GLU 35.A OE2 no hydrogen 2.885 N/A ARG 28.A NH1 GLU 13.A OE2 no hydrogen 2.742 N/A ARG 28.A NH2 GLU 35.A OE1 no hydrogen 2.887 N/A TYR 29.A N VAL 37.A O no hydrogen 3.116 N/A TYR 29.A OH ASP 27.A OD2 no hydrogen 2.838 N/A PHE 30.A N GLN 9.A O no hydrogen 2.867 N/A TYR 31.A N GLU 34.A O no hydrogen 2.919 N/A HIS 32.A N LEU 7.A O no hydrogen 2.726 N/A GLU 34.A N TYR 31.A O no hydrogen 2.983 N/A TYR 36.A N TYR 29.A O no hydrogen 2.904 N/A TYR 36.A OH GLU 8.A OE2 no hydrogen 2.672 N/A ARG 38.A N ARG 47.A O no hydrogen 3.056 N/A ARG 38.A NE GLU 35.A OE2 no hydrogen 2.937 N/A ARG 38.A NH2 GLU 35.A OE1 no hydrogen 2.835 N/A ARG 38.A NH2 GLU 35.A OE2 no hydrogen 3.445 N/A PHE 39.A N ASP 27.A O no hydrogen 2.851 N/A SER 41.A N PHE 25.A O no hydrogen 2.900 N/A SER 41.A OG PHE 25.A O no hydrogen 3.449 N/A ASP 42.A N ASP 40.A OD1 no hydrogen 2.955 N/A VAL 43.A N ASP 40.A O no hydrogen 2.832 N/A GLY 44.A N ASP 40.A O no hydrogen 2.909 N/A TYR 46.A N ASN 61.A OD1 no hydrogen 2.830 N/A TYR 46.A OH ASP 27.A OD2 no hydrogen 2.820 N/A ARG 47.A N ARG 38.A O no hydrogen 2.839 N/A ARG 47.A NE GLU 45.A OE2.B no hydrogen 2.420 N/A ARG 47.A NH1 GLU 45.A OE2.B no hydrogen 3.092 N/A VAL 49.A N TYR 36.A O no hydrogen 2.837 N/A THR 50.A N TYR 36.A O no hydrogen 3.368 N/A THR 50.A OG1 GLU 34.A OE1.A no hydrogen 2.661 N/A GLY 53.A N THR 50.A O no hydrogen 2.929 N/A ARG 54.A N GLU 51.A O no hydrogen 3.158 N/A ARG 54.A NE GLU 51.A OE2 no hydrogen 2.349 N/A ARG 54.A NH2 GLU 51.A OE2 no hydrogen 2.851 N/A ALA 57.A N GLY 53.A O no hydrogen 3.072 N/A GLU 58.A N ARG 54.A O no hydrogen 3.065 N/A TYR 59.A N PRO 55.A O no hydrogen 3.057 N/A TRP 60.A N ASP 56.A O no hydrogen 2.825 N/A ASN 61.A N ALA 57.A O no hydrogen 3.055 N/A ASN 61.A ND2 TYR 46.A O no hydrogen 2.912 N/A SER 62.A N TYR 59.A O no hydrogen 3.046 N/A SER 62.A OG TYR 59.A O no hydrogen 2.577 N/A GLN 63.A N TRP 60.A O no hydrogen 3.081 N/A GLN 63.A NE2.A SER 62.A OG no hydrogen 3.179 N/A LEU 67.A N GLN 63.A O no hydrogen 3.124 N/A GLU 68.A N LYS 64.A O no hydrogen 2.897 N/A ASP 69.A N ASP 65.A O no hydrogen 3.064 N/A GLU 70.A N ILE 66.A O no hydrogen 2.961 N/A ARG 71.A N LEU 67.A O no hydrogen 2.765 N/A ARG 71.A NE GLY 44.A O no hydrogen 2.755 N/A ARG 71.A NH1 GLU 68.A OE2 no hydrogen 2.793 N/A ARG 71.A NH2 GLY 44.A O no hydrogen 3.025 N/A ALA 72.A N GLU 68.A O no hydrogen 3.104 N/A ALA 73.A N GLU 70.A O no hydrogen 3.091 N/A ASP 75.A N ALA 72.A O no hydrogen 2.932 N/A THR 76.A N ALA 72.A O no hydrogen 2.977 N/A THR 76.A OG1 ALA 72.A O no hydrogen 3.330 N/A TYR 77.A N ALA 73.A O no hydrogen 2.874 N/A CYS 78.A N ALA 73.A O no hydrogen 2.920 N/A CYS 78.A SG ALA 73.A O no hydrogen 3.869 N/A ARG 79.A N VAL 74.A O no hydrogen 2.943 N/A ARG 79.A NE THR 20.A O no hydrogen 2.974 N/A ARG 79.A NH1 THR 20.A O no hydrogen 2.916 N/A ARG 79.A NH1 GLU 21.A O no hydrogen 3.528 N/A ARG 79.A NH2 ASP 75.A OD1 no hydrogen 2.919 N/A ASN 81.A N TYR 77.A O no hydrogen 2.886 N/A TYR 82.A N CYS 78.A O no hydrogen 2.953 N/A GLY 83.A N ARG 79.A O no hydrogen 3.150 N/A VAL 84.A N HIS 80.A O no hydrogen 3.149 N/A VAL 85.A N ASN 81.A O no hydrogen 2.985 N/A GLU 86.A N TYR 82.A O no hydrogen 2.848 N/A PHE 88.A N VAL 85.A O no hydrogen 3.154 N/A THR 89.A N GLU 86.A O no hydrogen 3.353 N/A THR 89.A OG1 VAL 85.A O no hydrogen 2.769 N/A VAL 90.A N THR 89.A OG1 no hydrogen 2.677 N/A GLN 91.A N GLU 86.A O no hydrogen 2.933 N/A ARG 92.A N THR 89.A O no hydrogen 3.028 N/A ARG 92.A NE TRP 152.A O no hydrogen 3.339 N/A ARG 92.A NH2 TRP 152.A O no hydrogen 2.921 N/A ARG 93.A NH1 VAL 90.A O no hydrogen 3.135 N/A ARG 93.A NH1 ARG 92.A O no hydrogen 2.963 N/A VAL 94.A N TYR 122.A O no hydrogen 2.849 N/A GLU 97.A N ASN 119.A O no hydrogen 2.777 N/A THR 99.A N SER 117.A O no hydrogen 2.925 N/A TYR 101.A N VAL 115.A O no hydrogen 3.041 N/A ALA 103.A N LEU 113.A O no hydrogen 2.918 N/A LYS 104.A NZ GLN 109.A O no hydrogen 3.351 N/A THR 105.A N ASN 112.A OD1 no hydrogen 2.893 N/A THR 105.A OG1 ASN 112.A OD1 no hydrogen 3.515 N/A GLN 106.A N GLN 109.A OE1 no hydrogen 2.891 N/A GLN 109.A N GLN 106.A O no hydrogen 3.111 N/A ASN 112.A N ALA 103.A O no hydrogen 3.102 N/A ASN 112.A ND2 GLN 109.A OE1 no hydrogen 2.761 N/A LEU 113.A N ALA 103.A O no hydrogen 3.041 N/A LEU 114.A N LEU 160.A O no hydrogen 2.960 N/A VAL 115.A N TYR 101.A O no hydrogen 2.795 N/A CYS 116.A N VAL 158.A O no hydrogen 2.832 N/A SER 117.A N THR 99.A O no hydrogen 2.774 N/A SER 117.A OG ASN 119.A OD1 no hydrogen 2.631 N/A VAL 118.A N THR 156.A O no hydrogen 2.844 N/A ASN 119.A N GLU 97.A O no hydrogen 2.825 N/A GLY 120.A N PHE 154.A O no hydrogen 2.891 N/A PHE 121.A N PHE 154.A O no hydrogen 3.255 N/A TYR 122.A N VAL 94.A O no hydrogen 3.056 N/A GLU 127.A N GLU 175.A O no hydrogen 2.948 N/A ARG 129.A N GLN 173.A O no hydrogen 2.910 N/A ARG 129.A NH1.B GLU 136.A OE1 no hydrogen 3.160 N/A ARG 129.A NH1.B GLU 136.A OE2 no hydrogen 2.952 N/A TRP 130.A NE1 VAL 158.A O no hydrogen 3.120 N/A PHE 131.A N THR 171.A O no hydrogen 2.829 N/A ARG 132.A N GLN 135.A O no hydrogen 2.805 N/A ARG 132.A NE GLU 137.A OE1 no hydrogen 3.058 N/A ARG 132.A NH2 GLU 168.A OE1.B no hydrogen 2.365 N/A ARG 132.A NH2 GLU 168.A OE2.A no hydrogen 3.411 N/A ASN 133.A N VAL 169.A O no hydrogen 2.806 N/A ASN 133.A ND2 GLU 168.A OE1.B no hydrogen 2.864 N/A ASN 133.A ND2 GLU 168.A OE2.B no hydrogen 2.550 N/A GLN 135.A N ARG 132.A O no hydrogen 3.130 N/A GLU 137.A N TRP 130.A O no hydrogen 2.877 N/A VAL 142.A N MET 159.A O no hydrogen 3.104 N/A SER 143.A OG LEU 157.A O no hydrogen 2.906 N/A THR 144.A N LEU 157.A O no hydrogen 3.056 N/A THR 144.A OG1 GLY 145.A O no hydrogen 2.869 N/A GLY 145.A N SER 143.A OG no hydrogen 2.896 N/A ILE 147.A N GLN 155.A O no hydrogen 2.919 N/A ASN 149.A N THR 153.A O no hydrogen 2.981 N/A ASN 149.A ND2 THR 153.A OG1 no hydrogen 3.029 N/A THR 153.A N ASP 151.A OD1 no hydrogen 3.193 N/A THR 153.A OG1 ASP 151.A OD1 no hydrogen 2.680 N/A PHE 154.A N PHE 121.A O no hydrogen 2.779 N/A GLN 155.A N ILE 147.A O no hydrogen 2.882 N/A GLN 155.A NE2 ASN 149.A OD1 no hydrogen 2.887 N/A THR 156.A N VAL 118.A O no hydrogen 2.861 N/A THR 156.A OG1 GLY 145.A O no hydrogen 2.895 N/A LEU 157.A N THR 144.A OG1 no hydrogen 3.019 N/A VAL 158.A N CYS 116.A O no hydrogen 2.893 N/A MET 159.A N VAL 142.A O no hydrogen 2.770 N/A LEU 160.A N LEU 114.A O no hydrogen 2.837 N/A GLU 161.A N GLY 140.A O no hydrogen 2.743 N/A ARG 165.A N GLU 168.A OE1.A no hydrogen 2.855 N/A ARG 165.A NH1 VAL 163.A O no hydrogen 3.148 N/A GLU 168.A N ARG 165.A O no hydrogen 3.171 N/A VAL 169.A N ASN 133.A OD1 no hydrogen 2.967 N/A TYR 170.A N TRP 187.A O no hydrogen 2.950 N/A TYR 170.A OH GLU 168.A OE1.A no hydrogen 2.282 N/A THR 171.A N PHE 131.A O no hydrogen 2.948 N/A CYS 172.A N VAL 185.A O no hydrogen 2.929 N/A GLN 173.A N ARG 129.A O no hydrogen 2.831 N/A VAL 174.A N LEU 183.A O no hydrogen 2.757 N/A GLU 175.A N GLU 127.A O no hydrogen 2.843 N/A HIS 176.A ND1 SER 178.A OG no hydrogen 2.769 N/A HIS 176.A NE2 PRO 123.A O no hydrogen 2.859 N/A SER 178.A N HIS 176.A ND1 no hydrogen 3.059 N/A SER 178.A OG HIS 176.A ND1 no hydrogen 2.769 N/A LEU 179.A N HIS 176.A O no hydrogen 2.918 N/A LEU 183.A N VAL 174.A O no hydrogen 2.908 N/A VAL 185.A N CYS 172.A O no hydrogen 2.955 N/A TRP 187.A N TYR 170.A O no hydrogen 2.689 N/A ARG 188.A NH1 GLU 186.A OE2 no hydrogen 2.916 N/A ARG 188.A NH2 GLU 186.A OE2 no hydrogen 3.356 N/A GLY 191.A N ARG 188.A O no hydrogen 3.207 N/A