Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2p5e_E.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 1.A N ASP 24.A OD1 no hydrogen 2.983 N/A THR 3.A N ALA 22.A O no hydrogen 2.847 N/A GLN 4.A NE2 TYR 87.A O no hydrogen 3.021 N/A GLN 4.A NE2 SER 106.A OG no hydrogen 3.141 N/A THR 5.A N GLN 20.A O no hydrogen 3.054 N/A LYS 7.A NZ GLN 4.A O no hydrogen 2.683 N/A GLN 9.A N ARG 107.A O no hydrogen 2.966 N/A LEU 11.A N THR 109.A O no hydrogen 2.828 N/A LYS 12.A N GLN 15.A OE1 no hydrogen 2.715 N/A THR 13.A N LEU 111.A O no hydrogen 2.920 N/A THR 13.A OG1 GLU 112.A OE1 no hydrogen 2.832 N/A GLY 14.A N ALA 79.A O no hydrogen 2.736 N/A GLN 15.A N LYS 12.A O no hydrogen 3.073 N/A SER 16.A OG LEU 77.A O no hydrogen 2.689 N/A MET 17.A N.A LEU 76.A O no hydrogen 3.105 N/A MET 17.A N.B LEU 76.A O no hydrogen 3.115 N/A LEU 19.A N LEU 74.A O no hydrogen 2.665 N/A GLN 20.A N THR 5.A O no hydrogen 2.728 N/A ALA 22.A N THR 3.A O no hydrogen 2.962 N/A GLN 23.A N GLU 70.A O no hydrogen 2.964 N/A GLN 23.A NE2 ILE 69.A O no hydrogen 2.772 N/A MET 25.A N GLN 23.A OE1 no hydrogen 3.036 N/A HIS 27.A N GLN 23.A OE1 no hydrogen 3.098 N/A HIS 27.A ND1 SER 91.A OG no hydrogen 2.846 N/A GLU 28.A N GLU 28.A OE1 no hydrogen 2.746 N/A TYR 29.A N SER 92.A O no hydrogen 3.046 N/A MET 30.A N SER 47.A O no hydrogen 2.902 N/A SER 31.A N ALA 90.A O no hydrogen 2.850 N/A SER 31.A OG ALA 90.A O no hydrogen 2.875 N/A TRP 32.A N HIS 45.A O no hydrogen 2.910 N/A TRP 32.A NE1 PHE 72.A O no hydrogen 2.650 N/A TYR 33.A N PHE 88.A O no hydrogen 2.660 N/A ARG 34.A N ARG 42.A O no hydrogen 2.919 N/A ARG 34.A NH1 SER 82.A O no hydrogen 3.290 N/A ARG 34.A NH2 ASP 36.A OD1 no hydrogen 2.938 N/A ARG 34.A NH2 SER 82.A O no hydrogen 2.803 N/A GLN 35.A N VAL 86.A O no hydrogen 2.764 N/A MET 39.A N ASP 36.A O no hydrogen 2.865 N/A ARG 42.A N ARG 34.A O no hydrogen 2.891 N/A ARG 42.A NE GLU 57.A OE2 no hydrogen 3.020 N/A ILE 44.A N TRP 32.A O no hydrogen 2.781 N/A HIS 45.A NE2 TYR 62.A O no hydrogen 2.949 N/A TYR 46.A N ASP 54.A O no hydrogen 2.937 N/A SER 47.A N MET 30.A O no hydrogen 2.727 N/A SER 47.A OG THR 52.A O no hydrogen 2.587 N/A GLN 51.A N ARG 66.A O no hydrogen 2.630 N/A THR 52.A N ALA 49.A O no hydrogen 3.149 N/A THR 52.A OG1 ILE 50.A O no hydrogen 3.279 N/A ASP 54.A N TYR 46.A O no hydrogen 2.852 N/A GLY 56.A N ILE 44.A O no hydrogen 2.838 N/A VAL 58.A N LEU 43.A O no hydrogen 2.991 N/A TYR 62.A N PRO 59.A O no hydrogen 2.995 N/A TYR 62.A OH TYR 87.A OH no hydrogen 2.680 N/A ASN 63.A N ARG 75.A O no hydrogen 3.010 N/A ASN 63.A ND2 TYR 62.A O no hydrogen 2.684 N/A ARG 66.A NE THR 68.A O no hydrogen 3.095 N/A ARG 66.A NH1 GLU 28.A O no hydrogen 2.813 N/A ARG 66.A NH1 SER 47.A OG no hydrogen 2.880 N/A ARG 66.A NH2 HIS 27.A O no hydrogen 3.005 N/A ARG 66.A NH2 GLU 28.A O no hydrogen 3.061 N/A ARG 66.A NH2 ILE 69.A O no hydrogen 2.862 N/A THR 68.A OG1 GLU 70.A OE1 no hydrogen 3.524 N/A THR 68.A OG1 ASP 71.A OD1 no hydrogen 3.061 N/A GLU 70.A N GLU 70.A OE1 no hydrogen 2.798 N/A ASP 71.A N THR 68.A OG1 no hydrogen 3.299 N/A PHE 72.A N CYS 21.A O no hydrogen 2.900 N/A LEU 74.A N LEU 19.A O no hydrogen 2.848 N/A ARG 75.A N ASN 63.A O no hydrogen 2.775 N/A ARG 75.A NH1 THR 18.A OG1 no hydrogen 2.750 N/A LEU 76.A N MET 17.A O.A no hydrogen 2.621 N/A LEU 76.A N MET 17.A O.B no hydrogen 2.657 N/A LEU 77.A N GLY 61.A O no hydrogen 3.332 N/A ALA 79.A N GLN 15.A O no hydrogen 2.736 N/A ALA 80.A N GLN 83.A OE1 no hydrogen 2.926 N/A GLN 83.A N ALA 80.A O no hydrogen 2.757 N/A GLN 83.A NE2 GLY 61.A O no hydrogen 3.502 N/A THR 84.A N PRO 81.A O no hydrogen 3.180 N/A THR 84.A OG1 PRO 81.A O no hydrogen 3.089 N/A SER 85.A N LEU 108.A O.A no hydrogen 3.198 N/A SER 85.A N LEU 108.A O.B no hydrogen 3.205 N/A SER 85.A OG ASP 36.A OD1 no hydrogen 2.803 N/A VAL 86.A N GLN 35.A O no hydrogen 3.236 N/A TYR 87.A N SER 106.A O no hydrogen 2.748 N/A TYR 87.A OH TYR 62.A OH no hydrogen 2.680 N/A TYR 87.A OH GLN 83.A O no hydrogen 2.616 N/A PHE 88.A N TYR 33.A O no hydrogen 2.849 N/A CYS 89.A N GLN 4.A OE1 no hydrogen 2.870 N/A CYS 89.A SG SER 31.A O no hydrogen 3.526 N/A ALA 90.A N SER 31.A O no hydrogen 2.908 N/A SER 91.A N PHE 101.A O no hydrogen 2.933 N/A SER 91.A OG HIS 27.A ND1 no hydrogen 2.846 N/A SER 92.A N TYR 29.A O no hydrogen 2.950 N/A SER 92.A OG TYR 93.A O no hydrogen 2.830 N/A TYR 93.A OH MET 25.A O no hydrogen 2.674 N/A LEU 94.A N GLU 28.A OE1 no hydrogen 3.008 N/A GLY 98.A N GLY 95.A O no hydrogen 3.040 N/A PHE 101.A N SER 91.A O no hydrogen 2.840 N/A GLY 103.A N CYS 89.A O no hydrogen 2.761 N/A GLY 105.A N GLN 4.A OE1 no hydrogen 3.274 N/A SER 106.A N TYR 87.A O no hydrogen 2.783 N/A SER 106.A OG PRO 6.A O no hydrogen 2.547 N/A ARG 107.A N LYS 7.A O no hydrogen 2.811 N/A ARG 107.A NH1 GLU 104.A O no hydrogen 3.062 N/A LEU 108.A N.A SER 85.A O no hydrogen 3.030 N/A LEU 108.A N.B SER 85.A O no hydrogen 3.039 N/A THR 109.A N GLN 9.A O no hydrogen 2.943 N/A THR 109.A OG1 HIS 151.A NE2 no hydrogen 2.945 N/A VAL 110.A N THR 84.A OG1 no hydrogen 2.969 N/A LEU 111.A N LEU 11.A O no hydrogen 2.766 N/A LYS 115.A N ASP 113.A OD1 no hydrogen 3.159 N/A ASN 116.A N ASP 113.A O no hydrogen 3.123 N/A ASN 116.A ND2 ASP 182.A OD1 no hydrogen 2.912 N/A VAL 117.A N LEU 114.A O no hydrogen 3.071 N/A PHE 118.A N TYR 148.A O no hydrogen 2.820 N/A GLU 121.A N THR 145.A O no hydrogen 2.851 N/A ALA 123.A N LEU 143.A O no hydrogen 3.027 N/A PHE 125.A N VAL 141.A O no hydrogen 2.746 N/A ALA 130.A N SER 128.A OG no hydrogen 2.972 N/A ILE 132.A N SER 128.A O no hydrogen 3.060 N/A SER 133.A N GLU 129.A O no hydrogen 2.860 N/A SER 133.A OG GLU 129.A O no hydrogen 3.081 N/A SER 133.A OG ALA 130.A O no hydrogen 3.142 N/A HIS 134.A N ALA 130.A O no hydrogen 3.010 N/A HIS 134.A ND1 ALA 130.A O no hydrogen 2.877 N/A THR 135.A N GLU 131.A O no hydrogen 2.817 N/A THR 135.A OG1 GLU 131.A O no hydrogen 2.701 N/A GLN 136.A N ILE 132.A O no hydrogen 2.859 N/A LYS 137.A N THR 135.A OG1 no hydrogen 3.041 N/A ALA 138.A N VAL 193.A O no hydrogen 2.615 N/A THR 139.A N GLU 131.A OE1 no hydrogen 2.910 N/A THR 139.A OG1 GLU 131.A OE1 no hydrogen 3.410 N/A THR 139.A OG1 GLU 131.A OE2 no hydrogen 2.531 N/A LEU 140.A N LEU 191.A O no hydrogen 2.841 N/A VAL 141.A N PHE 125.A O no hydrogen 3.107 N/A CYS 142.A N SER 189.A O no hydrogen 2.812 N/A CYS 142.A SG ALA 123.A O no hydrogen 3.945 N/A LEU 143.A N ALA 123.A O no hydrogen 2.847 N/A ALA 144.A N LEU 187.A O no hydrogen 2.779 N/A THR 145.A N GLU 121.A O no hydrogen 2.926 N/A GLY 146.A N GLU 176.A OE2 no hydrogen 3.004 N/A PHE 147.A N TYR 185.A O no hydrogen 3.230 N/A TYR 148.A N PHE 118.A O no hydrogen 2.881 N/A GLU 153.A N GLN 210.A O no hydrogen 2.812 N/A SER 155.A N GLN 208.A O no hydrogen 2.843 N/A TRP 156.A NE1 SER 189.A OG no hydrogen 2.787 N/A TRP 157.A N ARG 206.A O no hydrogen 2.747 N/A TRP 157.A NE1 SER 155.A OG no hydrogen 2.858 N/A VAL 158.A N LYS 161.A O no hydrogen 2.768 N/A ASN 159.A N HIS 204.A O no hydrogen 2.871 N/A ASN 159.A ND2 ASN 203.A OD1 no hydrogen 2.931 N/A LYS 161.A N VAL 158.A O no hydrogen 3.242 N/A VAL 163.A N TRP 156.A O no hydrogen 2.829 N/A VAL 167.A N HIS 164.A O no hydrogen 3.257 N/A CYS 168.A N ARG 190.A O no hydrogen 3.136 N/A THR 169.A OG1 SER 189.A OG no hydrogen 2.778 N/A ASP 170.A N SER 188.A O no hydrogen 3.098 N/A LEU 174.A N ALA 186.A O no hydrogen 2.902 N/A LYS 175.A NZ PRO 178.A O no hydrogen 2.893 N/A LYS 175.A NZ LEU 180.A O no hydrogen 2.710 N/A GLU 176.A N ARG 184.A O no hydrogen 2.989 N/A GLN 177.A N SER 183.A OG no hydrogen 2.738 N/A LEU 180.A N GLN 177.A O no hydrogen 2.863 N/A SER 183.A N LEU 180.A O no hydrogen 3.244 N/A SER 183.A OG ARG 184.A O no hydrogen 2.994 N/A ARG 184.A NE GLY 146.A O no hydrogen 2.747 N/A ARG 184.A NH2 GLY 146.A O no hydrogen 3.138 N/A TYR 185.A N PHE 147.A O no hydrogen 2.549 N/A ALA 186.A N LEU 174.A O no hydrogen 2.940 N/A LEU 187.A N ALA 144.A O no hydrogen 2.755 N/A SER 188.A N ASP 170.A OD2 no hydrogen 2.997 N/A SER 188.A OG ASP 170.A OD1 no hydrogen 3.237 N/A SER 188.A OG ASP 170.A OD2 no hydrogen 2.739 N/A SER 189.A N CYS 142.A O no hydrogen 2.953 N/A SER 189.A OG CYS 168.A O no hydrogen 3.178 N/A SER 189.A OG THR 169.A OG1 no hydrogen 2.778 N/A ARG 190.A N CYS 168.A O no hydrogen 2.973 N/A ARG 190.A NH1 ASP 170.A OD1 no hydrogen 2.831 N/A ARG 190.A NH1 SER 188.A OG no hydrogen 3.031 N/A ARG 190.A NH2 ASP 170.A OD1 no hydrogen 2.992 N/A LEU 191.A N LEU 140.A O no hydrogen 2.888 N/A ARG 192.A N GLY 166.A O no hydrogen 2.814 N/A VAL 193.A N ALA 138.A O no hydrogen 2.846 N/A ALA 195.A N GLN 136.A O no hydrogen 2.929 N/A PHE 197.A N SER 194.A OG no hydrogen 3.135 N/A TRP 198.A N SER 194.A O no hydrogen 3.132 N/A GLN 199.A N ALA 195.A O no hydrogen 2.887 N/A ASP 200.A N PHE 197.A O no hydrogen 3.274 N/A ARG 202.A N ASP 200.A OD1 no hydrogen 3.055 N/A ARG 202.A NE ASP 200.A OD1 no hydrogen 3.458 N/A ARG 202.A NE ASP 200.A OD2 no hydrogen 3.488 N/A ARG 202.A NH2 ASP 200.A OD2 no hydrogen 3.362 N/A ASN 203.A N ASP 200.A O no hydrogen 2.964 N/A ASN 203.A ND2 PHE 197.A O no hydrogen 2.765 N/A HIS 204.A N ASN 159.A OD1 no hydrogen 2.753 N/A HIS 204.A NE2 GLU 235.A OE1 no hydrogen 2.428 N/A PHE 205.A N ALA 236.A O no hydrogen 2.753 N/A ARG 206.A N TRP 157.A O no hydrogen 2.777 N/A CYS 207.A N ALA 234.A O no hydrogen 2.786 N/A GLN 208.A N SER 155.A O no hydrogen 2.857 N/A VAL 209.A N VAL 232.A O no hydrogen 2.850 N/A GLN 210.A N GLU 153.A O no hydrogen 2.792 N/A PHE 211.A N GLN 230.A O no hydrogen 2.781 N/A TYR 212.A N HIS 151.A O no hydrogen 2.986 N/A TYR 212.A OH GLU 153.A OE1 no hydrogen 2.578 N/A GLY 213.A N THR 229.A OG1 no hydrogen 3.004 N/A LEU 214.A N PRO 227.A O no hydrogen 3.001 N/A SER 215.A N ASP 218.A OD2 no hydrogen 2.935 N/A SER 215.A OG ASP 218.A OD2 no hydrogen 3.293 N/A ASP 218.A N SER 215.A O no hydrogen 3.137 N/A TRP 220.A NE1 ARG 224.A O no hydrogen 2.848 N/A ARG 224.A NH1 VAL 117.A O no hydrogen 2.864 N/A ARG 224.A NH2 VAL 117.A O no hydrogen 2.822 N/A LYS 226.A NZ SER 215.A O no hydrogen 3.159 N/A LYS 226.A NZ ASP 218.A O no hydrogen 2.884 N/A VAL 228.A N LYS 226.A O no hydrogen 2.804 N/A GLN 230.A N PHE 211.A O no hydrogen 2.936 N/A GLN 230.A NE2 VAL 228.A O no hydrogen 2.850 N/A VAL 232.A N VAL 209.A O no hydrogen 3.013 N/A ALA 234.A N CYS 207.A O no hydrogen 2.970 N/A ALA 236.A N PHE 205.A O no hydrogen 2.804 N/A GLY 238.A N ASN 203.A O no hydrogen 2.858 N/A ARG 239.A N TRP 198.A O no hydrogen 2.955 N/A ARG 239.A NH1 GLU 126.A OE1 no hydrogen 3.050 N/A