Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2x3m_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 3.A N GLU 84.A OE1 no hydrogen 2.794 N/A ASP 5.A N ASN 2.A OD1 no hydrogen 2.947 N/A TRP 6.A N ASN 2.A O no hydrogen 3.047 N/A ILE 7.A N TRP 3.A O no hydrogen 2.883 N/A MET 8.A N ALA 4.A O no hydrogen 2.919 N/A GLY 9.A N ASP 5.A O no hydrogen 3.027 N/A GLY 9.A N TRP 6.A O no hydrogen 3.092 N/A TRP 10.A N ILE 7.A O no hydrogen 3.142 N/A ARG 11.A N MET 8.A O no hydrogen 3.161 N/A ARG 11.A NE ALA 53.A O no hydrogen 2.804 N/A ARG 11.A NH2 LEU 52.A O no hydrogen 2.797 N/A LYS 19.A N SER 16.A OG no hydrogen 3.062 N/A MET 20.A N SER 16.A O no hydrogen 2.947 N/A GLU 21.A N.A GLU 17.A O no hydrogen 2.918 N/A GLU 21.A N.B GLU 17.A O no hydrogen 2.902 N/A PHE 22.A N LYS 18.A O no hydrogen 2.921 N/A MET 23.A N LYS 19.A O no hydrogen 3.047 N/A TYR 24.A N MET 20.A O no hydrogen 3.026 N/A TYR 24.A OH ASP 43.A OD1 no hydrogen 2.460 N/A TRP 25.A N.A GLU 21.A O.A no hydrogen 2.922 N/A TRP 25.A N.A GLU 21.A O.B no hydrogen 2.895 N/A TRP 25.A N.B GLU 21.A O.A no hydrogen 2.913 N/A TRP 25.A N.B GLU 21.A O.B no hydrogen 2.886 N/A TYR 26.A N PHE 22.A O no hydrogen 2.876 N/A THR 27.A N MET 23.A O no hydrogen 2.932 N/A THR 27.A OG1 MET 23.A O no hydrogen 2.766 N/A ARG 28.A N.A TYR 24.A O no hydrogen 2.862 N/A ARG 28.A N.B TYR 24.A O no hydrogen 2.862 N/A ARG 28.A NE.A GLU 32.A OE2 no hydrogen 2.774 N/A ARG 28.A NH1.A TYR 24.A OH no hydrogen 2.964 N/A ARG 28.A NH1.B TYR 24.A OH no hydrogen 2.875 N/A THR 29.A N TRP 25.A O.A no hydrogen 2.919 N/A THR 29.A N TRP 25.A O.B no hydrogen 2.853 N/A THR 29.A OG1 TRP 25.A O.A no hydrogen 2.726 N/A THR 29.A OG1 TRP 25.A O.B no hydrogen 2.796 N/A TYR 30.A N TYR 26.A O no hydrogen 2.946 N/A LEU 31.A N THR 27.A O no hydrogen 2.953 N/A GLU 32.A N ARG 28.A O.A no hydrogen 2.971 N/A GLU 32.A N ARG 28.A O.B no hydrogen 2.983 N/A GLU 33.A N THR 29.A O no hydrogen 2.841 N/A ALA 34.A N TYR 30.A O no hydrogen 2.752 N/A LYS 35.A NZ GLU 77.A OE1 no hydrogen 3.503 N/A LYS 35.A NZ GLU 77.A OE2 no hydrogen 3.220 N/A ILE 37.A N LEU 31.A O no hydrogen 3.015 N/A ARG 38.A NE ASP 40.A OD1 no hydrogen 2.711 N/A ARG 38.A NH2 ASP 40.A OD2 no hydrogen 3.298 N/A ALA 42.A N ARG 38.A O no hydrogen 2.831 N/A ASP 43.A N PRO 39.A O no hydrogen 2.857 N/A ALA 44.A N ASP 40.A O no hydrogen 3.230 N/A LEU 45.A N ILE 41.A O no hydrogen 2.974 N/A ALA 46.A N ALA 42.A O no hydrogen 2.872 N/A ARG 47.A N ASP 43.A O no hydrogen 2.895 N/A ARG 47.A NH1 GLU 21.A OE2.A no hydrogen 2.902 N/A ARG 47.A NH2 GLU 21.A OE1.A no hydrogen 2.804 N/A ARG 47.A NH2 GLU 21.A OE1.B no hydrogen 3.225 N/A ARG 47.A NH2 GLU 21.A OE2.A no hydrogen 3.548 N/A GLY 48.A N ALA 44.A O no hydrogen 2.941 N/A MET 49.A N LEU 45.A O no hydrogen 2.868 N/A ALA 50.A N ALA 46.A O no hydrogen 2.845 N/A GLY 51.A N ARG 47.A O no hydrogen 2.902 N/A LEU 52.A N GLY 48.A O no hydrogen 2.968 N/A ALA 53.A N MET 49.A O no hydrogen 2.887 N/A PHE 54.A N ALA 50.A O no hydrogen 2.952 N/A ARG 56.A N GLY 51.A O no hydrogen 2.985 N/A ARG 56.A NE ASP 58.A OD1 no hydrogen 2.964 N/A ARG 56.A NE ASP 58.A OD2 no hydrogen 3.498 N/A ARG 56.A NH2 ASP 58.A OD2 no hydrogen 3.047 N/A TRP 59.A N ARG 56.A O no hydrogen 3.035 N/A VAL 60.A N ARG 56.A O no hydrogen 3.057 N/A ALA 61.A N THR 57.A O no hydrogen 3.211 N/A SER 62.A N TRP 59.A O no hydrogen 2.993 N/A MET 63.A N VAL 60.A O no hydrogen 2.983 N/A LEU 64.A N ALA 61.A O no hydrogen 2.973 N/A GLN 67.A N ASP 65.A OD1 no hydrogen 2.950 N/A ILE 68.A N ASP 65.A O no hydrogen 2.857 N/A MET 69.A N ASP 65.A O no hydrogen 2.905 N/A ARG 70.A N PRO 66.A O no hydrogen 3.063 N/A ARG 70.A NE ASP 109.A OD1 no hydrogen 2.879 N/A ARG 70.A NH1 GLN 67.A OE1 no hydrogen 3.011 N/A ARG 70.A NH2 ASP 109.A OD1 no hydrogen 2.890 N/A ARG 70.A NH2 GLU 113.A OE2 no hydrogen 2.642 N/A HIS 71.A N ILE 68.A O no hydrogen 3.064 N/A HIS 71.A ND1 THR 74.A OG1 no hydrogen 3.101 N/A ILE 72.A N MET 69.A O no hydrogen 3.060 N/A TYR 73.A N ARG 70.A O no hydrogen 3.248 N/A TYR 73.A OH MET 102.A O.A no hydrogen 2.683 N/A TYR 73.A OH MET 102.A O.B no hydrogen 2.986 N/A THR 74.A N HIS 71.A O no hydrogen 3.124 N/A THR 74.A OG1 HIS 71.A ND1 no hydrogen 3.101 N/A THR 74.A OG1 HIS 71.A O no hydrogen 3.408 N/A ASP 75.A N HIS 71.A O no hydrogen 3.019 N/A GLU 77.A N ASP 75.A OD1 no hydrogen 2.873 N/A VAL 78.A N ASP 75.A O no hydrogen 2.881 N/A ALA 79.A N ASP 75.A O no hydrogen 3.008 N/A ARG 80.A N PRO 76.A O no hydrogen 2.938 N/A ARG 80.A NE GLU 84.A OE1 no hydrogen 3.377 N/A ARG 80.A NE GLU 84.A OE2 no hydrogen 2.918 N/A ARG 80.A NH2 THR 1.A O no hydrogen 3.170 N/A ILE 81.A N GLU 77.A O no hydrogen 3.150 N/A TYR 82.A N VAL 78.A O no hydrogen 3.099 N/A TYR 82.A OH MET 63.A O no hydrogen 2.635 N/A SER 83.A N ALA 79.A O no hydrogen 2.875 N/A SER 83.A OG ALA 79.A O no hydrogen 3.304 N/A SER 83.A OG ARG 80.A O no hydrogen 3.178 N/A GLU 84.A N ARG 80.A O no hydrogen 2.891 N/A THR 85.A N ILE 81.A O no hydrogen 3.059 N/A THR 85.A OG1 ILE 81.A O no hydrogen 2.707 N/A THR 85.A OG1 TYR 82.A O no hydrogen 3.526 N/A ARG 86.A N SER 83.A O no hydrogen 3.386 N/A ARG 86.A NE LEU 99.A O no hydrogen 2.951 N/A ARG 86.A NH2 SER 98.A O no hydrogen 3.251 N/A ARG 86.A NH2 LEU 99.A O no hydrogen 3.031 N/A LEU 89.A N THR 85.A O no hydrogen 2.891 N/A ARG 90.A N.A ARG 86.A O no hydrogen 2.822 N/A ARG 90.A N.B ARG 86.A O no hydrogen 2.801 N/A ARG 91.A N ASP 87.A O no hydrogen 2.994 N/A VAL 92.A N.A MET 88.A O no hydrogen 3.040 N/A VAL 92.A N.B MET 88.A O no hydrogen 3.021 N/A SER 93.A N LEU 89.A O no hydrogen 3.072 N/A SER 93.A OG LEU 89.A O no hydrogen 3.430 N/A SER 93.A OG ARG 90.A O.A no hydrogen 2.941 N/A SER 93.A OG ARG 90.A O.B no hydrogen 2.853 N/A ASP 94.A N ARG 91.A O no hydrogen 3.028 N/A TYR 95.A N ARG 90.A O.A no hydrogen 2.736 N/A TYR 95.A N ARG 90.A O.B no hydrogen 2.791 N/A TYR 96.A N SER 93.A O no hydrogen 3.108 N/A ILE 97.A N SER 93.A OG no hydrogen 3.120 N/A SER 98.A N ASN 143.A OD1 no hydrogen 2.788 N/A SER 98.A OG SER 139.A OG no hydrogen 3.361 N/A LEU 99.A N ASN 143.A OD1 no hydrogen 3.223 N/A THR 100.A N GLU 103.A OE1 no hydrogen 2.891 N/A GLU 103.A N THR 100.A OG1 no hydrogen 3.054 N/A LEU 104.A N THR 100.A O no hydrogen 2.839 N/A GLY 105.A N THR 101.A O no hydrogen 2.980 N/A LYS 106.A N MET 102.A O.A no hydrogen 3.141 N/A LYS 106.A N MET 102.A O.B no hydrogen 2.967 N/A VAL 107.A N GLU 103.A O no hydrogen 2.868 N/A ALA 108.A N LEU 104.A O no hydrogen 2.899 N/A ASP 109.A N GLY 105.A O no hydrogen 3.033 N/A ILE 110.A N LYS 106.A O no hydrogen 2.987 N/A ILE 111.A N VAL 107.A O no hydrogen 2.958 N/A ALA 112.A N ALA 108.A O no hydrogen 2.880 N/A GLU 113.A N ASP 109.A O no hydrogen 2.957 N/A ALA 114.A N ILE 110.A O no hydrogen 2.880 N/A LYS 115.A N ILE 111.A O no hydrogen 2.850 N/A LYS 115.A NZ ASP 153.A OD2 no hydrogen 2.511 N/A ALA 116.A N ALA 112.A O no hydrogen 3.228 N/A LYS 117.A N GLU 113.A O no hydrogen 3.282 N/A LYS 117.A N ALA 114.A O no hydrogen 3.177 N/A GLY 118.A N LYS 115.A O no hydrogen 3.169 N/A GLU 119.A N ALA 114.A O no hydrogen 2.950 N/A ASN 120.A N GLU 119.A OE2 no hydrogen 2.807 N/A GLU 122.A N ASN 120.A OD1 no hydrogen 2.988 N/A VAL 123.A N ASN 120.A O no hydrogen 2.935 N/A VAL 124.A N ASN 120.A O no hydrogen 3.167 N/A ALA 125.A N PRO 121.A O no hydrogen 2.906 N/A ARG 126.A N GLU 122.A O no hydrogen 3.383 N/A ARG 126.A NH2 GLU 122.A O no hydrogen 2.899 N/A ARG 126.A NH2 GLU 122.A OE1 no hydrogen 3.001 N/A GLU 127.A N VAL 123.A O no hydrogen 2.948 N/A ILE 128.A N VAL 124.A O no hydrogen 2.929 N/A ALA 129.A N ALA 125.A O no hydrogen 2.949 N/A GLU 130.A N ARG 126.A O no hydrogen 3.033 N/A ALA 131.A N GLU 127.A O no hydrogen 2.929 N/A VAL 132.A N ILE 128.A O no hydrogen 2.992 N/A ARG 134.A NE GLU 103.A OE2 no hydrogen 2.879 N/A ARG 134.A NH2 SER 98.A O no hydrogen 2.966 N/A ARG 134.A NH2 GLU 103.A OE1 no hydrogen 2.826 N/A LEU 135.A N VAL 132.A O no hydrogen 3.299 N/A LYS 138.A NZ SER 164.A O.A no hydrogen 2.748 N/A LYS 138.A NZ SER 164.A O.B no hydrogen 2.736 N/A SER 139.A N SER 136.A OG no hydrogen 2.979 N/A LEU 140.A N SER 136.A O no hydrogen 2.897 N/A TYR 141.A N PRO 137.A O no hydrogen 2.794 N/A PHE 142.A N LYS 138.A O no hydrogen 3.168 N/A ASN 143.A N SER 139.A O no hydrogen 3.081 N/A ASN 143.A ND2 SER 98.A OG no hydrogen 2.983 N/A ASN 143.A ND2 SER 139.A O no hydrogen 2.875 N/A LEU 144.A N LEU 140.A O no hydrogen 2.961 N/A TYR 145.A N TYR 141.A O no hydrogen 2.706 N/A TYR 146.A N PHE 142.A O no hydrogen 3.095 N/A ILE 147.A N ASN 143.A O no hydrogen 3.086 N/A GLY 148.A N LEU 144.A O no hydrogen 2.728 N/A ARG 149.A N TYR 145.A O no hydrogen 2.953 N/A SER 150.A N.A TYR 146.A O no hydrogen 2.941 N/A SER 150.A N.B TYR 146.A O no hydrogen 2.942 N/A SER 150.A OG.B TYR 146.A O no hydrogen 2.761 N/A ILE 151.A N ILE 147.A O no hydrogen 2.994 N/A ASP 153.A N GLY 148.A O no hydrogen 2.964 N/A TYR 155.A OH GLU 119.A O no hydrogen 2.684 N/A VAL 156.A N ASP 153.A OD1 no hydrogen 3.099 N/A LEU 157.A N ASP 153.A O no hydrogen 3.102 N/A GLU 158.A N ASN 154.A O no hydrogen 2.860 N/A VAL 159.A N TYR 155.A O no hydrogen 3.036 N/A ALA 160.A N VAL 156.A O no hydrogen 2.883 N/A ARG 161.A N LEU 157.A O no hydrogen 2.899 N/A VAL 162.A N GLU 158.A O no hydrogen 3.160 N/A LEU 163.A N VAL 159.A O no hydrogen 3.096 N/A SER 164.A N.A ALA 160.A O no hydrogen 2.931 N/A SER 164.A N.B ALA 160.A O no hydrogen 2.932 N/A SER 164.A OG.B ARG 161.A O no hydrogen 2.646 N/A LYS 165.A N VAL 162.A O no hydrogen 3.103 N/A MET 166.A N LEU 163.A O no hydrogen 3.229 N/A