Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ma1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 5.A N ASN 42.A OD1 no hydrogen 2.800 N/A TYR 12.A OH TRP 81.A O no hydrogen 2.974 N/A TYR 14.A OH HIS 30.A ND1 no hydrogen 2.662 N/A ALA 16.A N PRO 13.A O no hydrogen 2.690 N/A GLU 18.A N ASP 15.A O no hydrogen 3.493 N/A HIS 20.A N LEU 17.A O no hydrogen 3.050 N/A ILE 21.A N LEU 17.A O no hydrogen 3.004 N/A SER 22.A N ASP 172.A OD2 no hydrogen 2.657 N/A SER 22.A OG ASP 172.A OD1 no hydrogen 2.762 N/A SER 22.A OG ASP 172.A OD2 no hydrogen 3.174 N/A ARG 23.A N GLU 18.A OE2 no hydrogen 3.221 N/A GLN 25.A N SER 22.A OG no hydrogen 2.864 N/A GLN 25.A NE2 GLN 25.A O no hydrogen 3.139 N/A LEU 26.A N SER 22.A O no hydrogen 2.901 N/A THR 27.A N ARG 23.A O no hydrogen 2.942 N/A THR 27.A OG1 ARG 23.A O no hydrogen 2.524 N/A ILE 28.A N GLU 24.A O no hydrogen 3.224 N/A HIS 29.A N GLN 25.A O no hydrogen 3.251 N/A HIS 29.A NE2 HIS 77.A NE2 no hydrogen 2.820 N/A HIS 30.A N LEU 26.A O no hydrogen 3.042 N/A HIS 30.A ND1 TYR 14.A OH no hydrogen 2.662 N/A HIS 30.A NE2 PRO 8.A O no hydrogen 2.767 N/A GLN 31.A N THR 27.A O no hydrogen 2.866 N/A GLN 31.A NE2 TYR 14.A OH no hydrogen 2.637 N/A LYS 32.A N ILE 28.A O no hydrogen 2.908 N/A HIS 33.A N ILE 28.A O no hydrogen 3.477 N/A HIS 34.A N HIS 29.A O no hydrogen 3.060 N/A GLN 35.A NE2 GLN 35.A O no hydrogen 3.402 N/A GLN 35.A NE2 ASP 39.A OD1 no hydrogen 2.979 N/A GLN 35.A NE2 ASP 39.A OD2 no hydrogen 3.537 N/A ALA 36.A N LYS 32.A O no hydrogen 3.006 N/A TYR 37.A N HIS 33.A O no hydrogen 3.149 N/A TYR 37.A N HIS 34.A O no hydrogen 3.118 N/A VAL 38.A N HIS 34.A O no hydrogen 3.205 N/A ASP 39.A N GLN 35.A O no hydrogen 2.938 N/A GLY 40.A N ALA 36.A O no hydrogen 2.761 N/A ALA 41.A N TYR 37.A O no hydrogen 2.889 N/A ASN 42.A N VAL 38.A O no hydrogen 2.968 N/A ASN 42.A ND2 TYR 5.A O no hydrogen 2.926 N/A ALA 43.A N ASP 39.A O no hydrogen 2.862 N/A LEU 44.A N GLY 40.A O no hydrogen 3.204 N/A LEU 45.A N ALA 41.A O no hydrogen 2.957 N/A ARG 46.A N ASN 42.A O no hydrogen 2.958 N/A LYS 47.A N ALA 43.A O no hydrogen 3.018 N/A LEU 48.A N LEU 44.A O no hydrogen 2.948 N/A ASP 49.A N LEU 45.A O no hydrogen 2.892 N/A GLU 50.A N ARG 46.A O no hydrogen 2.801 N/A ALA 51.A N LYS 47.A O no hydrogen 3.116 N/A ARG 52.A N LEU 48.A O no hydrogen 3.132 N/A GLU 53.A N ASP 49.A O no hydrogen 2.925 N/A SER 54.A N GLU 50.A O no hydrogen 2.982 N/A SER 54.A OG GLU 50.A O no hydrogen 3.045 N/A SER 54.A OG THR 56.A OG1 no hydrogen 2.891 N/A ASP 55.A N ARG 52.A O no hydrogen 3.198 N/A THR 56.A N ALA 51.A O no hydrogen 2.745 N/A THR 56.A OG1 ALA 51.A O no hydrogen 3.562 N/A THR 56.A OG1 SER 54.A OG no hydrogen 2.891 N/A ALA 62.A N ASP 59.A OD2 no hydrogen 3.114 N/A ALA 63.A N ASP 59.A O no hydrogen 2.969 N/A LEU 64.A N ILE 60.A O no hydrogen 2.761 N/A LYS 65.A N LYS 61.A O no hydrogen 3.069 N/A GLU 66.A N ALA 62.A O no hydrogen 3.010 N/A LEU 67.A N ALA 63.A O no hydrogen 2.776 N/A SER 68.A N LEU 64.A O no hydrogen 2.955 N/A SER 68.A OG LEU 64.A O no hydrogen 3.412 N/A SER 68.A OG LYS 65.A O no hydrogen 2.752 N/A PHE 69.A N LYS 65.A O no hydrogen 3.232 N/A HIS 70.A N GLU 66.A O no hydrogen 3.067 N/A VAL 71.A N LEU 67.A O no hydrogen 2.951 N/A GLY 72.A N SER 68.A O no hydrogen 3.026 N/A GLY 73.A N PHE 69.A O no hydrogen 2.878 N/A TYR 74.A N HIS 70.A O no hydrogen 2.765 N/A VAL 75.A N VAL 71.A O no hydrogen 2.717 N/A LEU 76.A N GLY 72.A O no hydrogen 2.909 N/A HIS 77.A N GLY 73.A O no hydrogen 3.165 N/A HIS 77.A ND1 GLY 73.A O no hydrogen 2.861 N/A LEU 78.A N TYR 74.A O no hydrogen 3.101 N/A PHE 79.A N VAL 75.A O no hydrogen 3.174 N/A PHE 80.A N LEU 76.A O no hydrogen 2.909 N/A TRP 81.A N HIS 77.A O no hydrogen 3.053 N/A TRP 81.A NE1 HIS 34.A ND1 no hydrogen 2.843 N/A ASN 83.A N PHE 79.A O no hydrogen 3.011 N/A ASN 83.A N PHE 80.A O no hydrogen 3.175 N/A ASN 83.A ND2 VAL 161.A O no hydrogen 3.191 N/A MET 84.A N TRP 81.A O no hydrogen 3.319 N/A GLY 85.A N ILE 187.A O no hydrogen 2.888 N/A GLU 89.A N PRO 86.A O no hydrogen 2.948 N/A CYS 90.A N ALA 87.A O no hydrogen 3.308 N/A GLY 91.A N VAL 188.A O no hydrogen 2.843 N/A SER 95.A N GLU 194.A OE2 no hydrogen 2.978 N/A GLU 100.A N GLY 96.A O no hydrogen 3.067 N/A TYR 101.A N LYS 97.A O no hydrogen 2.763 N/A TYR 101.A OH ASP 138.A OD1 no hydrogen 2.682 N/A ILE 102.A N LEU 98.A O no hydrogen 2.858 N/A GLU 103.A N ALA 99.A O no hydrogen 3.099 N/A LYS 104.A N GLU 100.A O no hydrogen 3.072 N/A LYS 104.A NZ ASP 105.A OD1 no hydrogen 2.576 N/A LYS 104.A NZ ASP 105.A OD2 no hydrogen 3.375 N/A LYS 104.A NZ ASP 138.A O no hydrogen 2.858 N/A ASP 105.A N TYR 101.A O no hydrogen 2.904 N/A PHE 106.A N ILE 102.A O no hydrogen 2.874 N/A GLY 107.A N GLU 103.A O no hydrogen 2.571 N/A ARG 111.A N SER 108.A OG no hydrogen 2.946 N/A ARG 111.A NE GLU 115.A OE2 no hydrogen 2.978 N/A PHE 112.A N SER 108.A O no hydrogen 3.217 N/A ARG 113.A N PHE 109.A O no hydrogen 2.746 N/A ARG 113.A NH1 GLU 182.A OE1 no hydrogen 3.402 N/A ARG 113.A NH2 GLU 182.A OE2 no hydrogen 2.796 N/A LYS 114.A N GLU 110.A O no hydrogen 2.865 N/A GLU 115.A N ARG 111.A O no hydrogen 2.841 N/A PHE 116.A N PHE 112.A O no hydrogen 2.794 N/A SER 117.A N ARG 113.A O no hydrogen 3.021 N/A SER 117.A OG ARG 113.A O no hydrogen 2.710 N/A GLN 118.A N LYS 114.A O no hydrogen 2.871 N/A ALA 119.A N GLU 115.A O no hydrogen 2.897 N/A ALA 120.A N PHE 116.A O no hydrogen 3.077 N/A ILE 121.A N SER 117.A O no hydrogen 2.831 N/A SER 122.A N GLN 118.A O no hydrogen 2.887 N/A SER 122.A OG GLN 118.A O no hydrogen 2.582 N/A ALA 123.A N ALA 120.A O no hydrogen 3.470 N/A TRP 128.A N VAL 145.A O no hydrogen 2.697 N/A TRP 128.A NE1 HIS 148.A ND1 no hydrogen 2.980 N/A ALA 129.A N LEU 162.A O no hydrogen 3.230 N/A VAL 130.A N MET 143.A O no hydrogen 3.031 N/A LEU 131.A N LEU 160.A O no hydrogen 2.793 N/A THR 132.A N PHE 141.A O no hydrogen 2.798 N/A THR 132.A OG1 ARG 157.A O no hydrogen 2.612 N/A TYR 133.A N THR 132.A OG1 no hydrogen 2.574 N/A TYR 133.A OH ASP 138.A OD1 no hydrogen 2.503 N/A CYS 134.A N ARG 139.A O no hydrogen 2.766 N/A CYS 134.A SG THR 137.A OG1 no hydrogen 3.338 N/A ASP 138.A N CYS 134.A O no hydrogen 2.531 N/A ARG 139.A N CYS 134.A O no hydrogen 3.227 N/A LEU 140.A N ASP 105.A OD2 no hydrogen 2.830 N/A PHE 141.A N THR 132.A O no hydrogen 2.868 N/A MET 143.A N VAL 130.A O no hydrogen 2.867 N/A GLN 144.A NE2 ALA 119.A O no hydrogen 2.893 N/A VAL 145.A N TRP 128.A O no hydrogen 2.891 N/A GLU 146.A N VAL 150.A O no hydrogen 2.950 N/A LYS 147.A N SER 126.A O no hydrogen 2.886 N/A HIS 148.A N ASN 149.A OD1 no hydrogen 3.301 N/A ASN 149.A N GLU 146.A O no hydrogen 3.243 N/A ASN 149.A ND2 SER 68.A OG no hydrogen 2.970 N/A VAL 150.A N GLU 146.A O no hydrogen 3.039 N/A PHE 156.A N ILE 153.A O no hydrogen 3.403 N/A LEU 159.A N LEU 131.A O no hydrogen 2.959 N/A VAL 161.A N ASN 83.A OD1 no hydrogen 2.944 N/A LEU 162.A N ALA 129.A O no hydrogen 2.855 N/A VAL 164.A N GLY 127.A O no hydrogen 2.878 N/A TRP 165.A N ASP 163.A OD1 no hydrogen 2.940 N/A TRP 165.A NE1 LYS 147.A O no hydrogen 3.219 N/A ALA 168.A N TRP 165.A O no hydrogen 2.983 N/A TYR 169.A N GLU 166.A O no hydrogen 3.068 N/A TYR 170.A N GLU 166.A O no hydrogen 2.893 N/A ASP 172.A N GLN 25.A OE1 no hydrogen 3.132 N/A TYR 173.A N TYR 169.A O no hydrogen 2.724 N/A TYR 173.A OH HIS 20.A O no hydrogen 2.517 N/A ARG 174.A N TYR 170.A O no hydrogen 2.820 N/A ARG 174.A NE TYR 170.A O no hydrogen 3.109 N/A VAL 176.A N TYR 173.A O no hydrogen 2.830 N/A ARG 177.A N ASN 175.A O no hydrogen 2.842 N/A ARG 177.A NE TYR 169.A OH no hydrogen 2.988 N/A ARG 177.A NH1 ILE 121.A O no hydrogen 2.826 N/A ARG 177.A NH1 ALA 123.A O no hydrogen 2.838 N/A ARG 177.A NH2 GLY 125.A O no hydrogen 3.117 N/A ARG 177.A NH2 TYR 169.A OH no hydrogen 3.479 N/A ASP 179.A N VAL 176.A O no hydrogen 3.000 N/A TYR 180.A OH ASP 163.A O no hydrogen 3.104 N/A VAL 181.A N ARG 177.A O no hydrogen 2.897 N/A GLU 182.A N PRO 178.A O no hydrogen 2.910 N/A ALA 183.A N ASP 179.A O no hydrogen 2.863 N/A PHE 184.A N TYR 180.A O no hydrogen 3.015 N/A PHE 184.A N VAL 181.A O no hydrogen 3.224 N/A TRP 185.A N GLU 182.A O no hydrogen 3.424 N/A TRP 185.A NE1 SER 117.A OG no hydrogen 3.063 N/A ASN 186.A N ALA 183.A O no hydrogen 2.956 N/A ASN 186.A ND2 ALA 183.A O no hydrogen 3.161 N/A ILE 187.A N PHE 184.A O no hydrogen 2.925 N/A ASN 189.A N ASN 83.A O no hydrogen 2.980 N/A TRP 190.A NE1 GLY 92.A O no hydrogen 2.979 N/A GLU 192.A N ASN 189.A O no hydrogen 3.208 N/A GLU 192.A N ASN 189.A OD1 no hydrogen 3.196 N/A VAL 193.A N ASN 189.A O no hydrogen 3.325 N/A GLU 194.A N TRP 190.A O no hydrogen 2.736 N/A LYS 195.A N LYS 191.A O no hydrogen 2.881 N/A ARG 196.A N GLU 192.A O no hydrogen 2.864 N/A ARG 196.A NE GLU 192.A OE2 no hydrogen 3.117 N/A ARG 196.A NH1 PHE 79.A O no hydrogen 3.519 N/A ARG 196.A NH1 ASN 83.A OD1 no hydrogen 2.933 N/A ARG 196.A NH1 LEU 159.A O no hydrogen 2.915 N/A ARG 196.A NH2 PHE 79.A O no hydrogen 2.816 N/A PHE 197.A N VAL 193.A O no hydrogen 2.928 N/A GLU 198.A N GLU 194.A O no hydrogen 3.159 N/A GLU 198.A N LYS 195.A O no hydrogen 3.002 N/A ASP 199.A N LYS 195.A O no hydrogen 3.364 N/A ASP 199.A N ARG 196.A O no hydrogen 3.306 N/A ILE 200.A N PHE 197.A O no hydrogen 3.416 N/A LEU 201.A N GLU 198.A O no hydrogen 3.187 N/A