Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4wq2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 5.A N GLU 1.A O no hydrogen 2.783 N/A PHE 6.A N GLU 2.A O no hydrogen 3.086 N/A ARG 7.A N VAL 3.A O no hydrogen 2.897 N/A ARG 8.A N ARG 4.A O no hydrogen 3.038 N/A LEU 9.A N GLN 5.A O no hydrogen 2.888 N/A PHE 10.A N PHE 6.A O no hydrogen 2.917 N/A ALA 11.A N ARG 7.A O no hydrogen 2.877 N/A GLN 12.A N ARG 8.A O no hydrogen 3.063 N/A LEU 13.A N LEU 9.A O no hydrogen 3.075 N/A ALA 14.A N PHE 10.A O no hydrogen 2.697 N/A GLY 15.A N ALA 11.A O no hydrogen 3.065 N/A MET 18.A N.A GLY 15.A O no hydrogen 3.071 N/A MET 18.A N.B GLY 15.A O no hydrogen 3.098 N/A GLU 19.A N ASP 17.A OD1 no hydrogen 3.203 N/A VAL 20.A N LEU 64.A O no hydrogen 2.785 N/A SER 21.A N GLU 24.A OE1 no hydrogen 2.842 N/A GLU 24.A N SER 21.A OG no hydrogen 3.050 N/A LEU 25.A N SER 21.A O no hydrogen 2.907 N/A MET 26.A N ALA 22.A O no hydrogen 2.870 N/A ASN 27.A N THR 23.A O no hydrogen 2.961 N/A ILE 28.A N GLU 24.A O no hydrogen 3.021 N/A LEU 29.A N.A LEU 25.A O no hydrogen 2.969 N/A LEU 29.A N.B LEU 25.A O no hydrogen 2.963 N/A ASN 30.A N MET 26.A O no hydrogen 2.974 N/A ASN 30.A ND2 PHE 44.A O no hydrogen 3.091 N/A LYS 31.A N ASN 27.A O no hydrogen 2.921 N/A VAL 32.A N ILE 28.A O no hydrogen 2.895 N/A VAL 33.A N LEU 29.A O.A no hydrogen 2.824 N/A VAL 33.A N LEU 29.A O.B no hydrogen 3.034 N/A THR 34.A N.A ASN 30.A O no hydrogen 3.202 N/A THR 34.A N.B ASN 30.A O no hydrogen 3.188 N/A THR 34.A OG1.A LYS 31.A O no hydrogen 2.532 N/A THR 34.A OG1.B ASN 30.A O no hydrogen 3.432 N/A ARG 35.A N VAL 32.A O no hydrogen 2.971 N/A HIS 36.A N VAL 33.A O no hydrogen 2.951 N/A ASP 38.A N ASP 38.A OD1 no hydrogen 2.572 N/A LEU 39.A N HIS 36.A O no hydrogen 2.874 N/A LYS 40.A N GLY 92.A O no hydrogen 3.068 N/A THR 41.A OG1.A LEU 39.A O no hydrogen 3.307 N/A THR 41.A OG1.B ASP 132.A OD1 no hydrogen 2.525 N/A GLY 43.A N THR 41.A OG1.B no hydrogen 2.750 N/A PHE 44.A N ASN 30.A OD1 no hydrogen 2.866 N/A CYS 49.A N GLY 45.A O no hydrogen 3.102 N/A CYS 49.A SG GLY 45.A O no hydrogen 3.428 N/A ARG 50.A N ILE 46.A O no hydrogen 2.843 N/A SER 51.A N.A ASP 47.A O no hydrogen 3.112 N/A SER 51.A N.B ASP 47.A O no hydrogen 3.042 N/A SER 51.A OG.A SER 173.A O no hydrogen 2.421 N/A SER 51.A OG.B SER 173.A O no hydrogen 3.060 N/A SER 51.A OG.B SER 173.A OXT no hydrogen 3.461 N/A MET 52.A N.A THR 48.A O no hydrogen 2.924 N/A MET 52.A N.B THR 48.A O no hydrogen 3.054 N/A VAL 53.A N CYS 49.A O no hydrogen 2.945 N/A ALA 54.A N ARG 50.A O no hydrogen 2.902 N/A VAL 55.A N SER 51.A O.A no hydrogen 3.067 N/A VAL 55.A N SER 51.A O.B no hydrogen 2.977 N/A MET 56.A N MET 52.A O.A no hydrogen 3.274 N/A MET 56.A N MET 52.A O.B no hydrogen 3.086 N/A ASP 57.A N ALA 54.A O no hydrogen 3.243 N/A ASP 59.A N GLU 68.A OE2 no hydrogen 3.370 N/A THR 60.A N ASP 57.A O no hydrogen 3.089 N/A THR 60.A OG1 ASP 59.A O no hydrogen 2.901 N/A THR 61.A N ASP 57.A OD1 no hydrogen 3.216 N/A THR 61.A N ASP 59.A OD1 no hydrogen 3.384 N/A THR 61.A OG1 GLU 19.A OE1 no hydrogen 2.706 N/A THR 61.A OG1 ASP 57.A OD1 no hydrogen 3.281 N/A THR 61.A OG1 ASP 59.A OD1 no hydrogen 3.325 N/A GLY 62.A N ASP 57.A OD2 no hydrogen 2.800 N/A LYS 63.A N THR 61.A OG1 no hydrogen 3.421 N/A LEU 64.A N VAL 20.A O no hydrogen 2.774 N/A GLY 65.A N GLU 68.A OE1 no hydrogen 2.879 N/A PHE 69.A N GLY 65.A O no hydrogen 2.848 N/A LYS 70.A N PHE 66.A O no hydrogen 2.863 N/A TYR 71.A N GLU 67.A O no hydrogen 3.077 N/A TYR 71.A OH ASP 142.A OD1 no hydrogen 3.333 N/A TYR 71.A OH ASP 142.A OD2 no hydrogen 2.633 N/A LEU 72.A N GLU 68.A O no hydrogen 3.094 N/A TRP 73.A N PHE 69.A O no hydrogen 2.816 N/A ASN 74.A N LYS 70.A O no hydrogen 2.947 N/A ASN 75.A N TYR 71.A O no hydrogen 3.142 N/A ILE 76.A N LEU 72.A O no hydrogen 2.890 N/A LYS 77.A N TRP 73.A O no hydrogen 2.915 N/A ARG 78.A N ASN 74.A O no hydrogen 3.172 N/A TRP 79.A N ASN 75.A O no hydrogen 2.855 N/A GLN 80.A N ILE 76.A O no hydrogen 2.836 N/A ILE 82.A N ARG 78.A O no hydrogen 3.096 N/A TYR 83.A N TRP 79.A O no hydrogen 2.936 N/A TYR 83.A OH GLY 92.A O no hydrogen 2.634 N/A LYS 84.A N GLN 80.A O no hydrogen 2.980 N/A LYS 84.A NZ HIS 36.A ND1 no hydrogen 3.013 N/A LYS 84.A NZ ASP 38.A OD1 no hydrogen 3.065 N/A LYS 84.A NZ ASP 38.A OD2 no hydrogen 2.742 N/A GLN 85.A N ALA 81.A O no hydrogen 3.017 N/A PHE 86.A N ILE 82.A O no hydrogen 2.883 N/A THR 88.A N GLU 98.A OE2 no hydrogen 3.202 N/A ARG 90.A N ASP 87.A O no hydrogen 3.013 N/A ARG 90.A NH1 ASP 87.A O no hydrogen 2.966 N/A SER 91.A N ASP 87.A OD1 no hydrogen 3.322 N/A SER 91.A OG ASP 87.A OD1 no hydrogen 3.157 N/A SER 91.A OG ASP 89.A OD1 no hydrogen 3.192 N/A SER 91.A OG THR 93.A OG1 no hydrogen 2.852 N/A GLY 92.A N ASP 87.A OD2 no hydrogen 2.714 N/A THR 93.A N SER 91.A OG no hydrogen 3.281 N/A THR 93.A OG1 SER 91.A OG no hydrogen 2.852 N/A THR 93.A OG1 ASN 128.A OD1 no hydrogen 2.947 N/A ILE 94.A N MET 129.A O no hydrogen 2.968 N/A CYS 95.A N GLU 98.A OE1 no hydrogen 2.926 N/A CYS 95.A SG SER 97.A OG.A no hydrogen 2.940 N/A SER 96.A OG.A GLY 127.A O no hydrogen 3.160 N/A GLU 98.A N CYS 95.A O no hydrogen 3.012 N/A LEU 99.A N CYS 95.A O no hydrogen 3.034 N/A LEU 99.A N SER 96.A O.A no hydrogen 3.424 N/A ALA 102.A N GLU 98.A O no hydrogen 3.250 N/A PHE 103.A N LEU 99.A O no hydrogen 2.901 N/A GLU 104.A N PRO 100.A O no hydrogen 2.854 N/A ALA 105.A N GLY 101.A O no hydrogen 2.959 N/A ALA 106.A N ALA 102.A O no hydrogen 3.194 N/A GLY 107.A N GLU 104.A O no hydrogen 2.894 N/A PHE 108.A N PHE 103.A O no hydrogen 2.950 N/A LEU 110.A N TYR 115.A OH no hydrogen 3.225 N/A TYR 115.A N ASN 111.A O no hydrogen 3.004 N/A TYR 115.A OH GLU 104.A OE1 no hydrogen 2.835 N/A TYR 115.A OH PHE 108.A O no hydrogen 3.283 N/A ASN 116.A N GLU 112.A O no hydrogen 2.917 N/A MET 117.A N.A HIS 113.A O no hydrogen 3.118 N/A MET 117.A N.B HIS 113.A O no hydrogen 3.112 N/A ILE 118.A N LEU 114.A O.A no hydrogen 2.940 N/A ILE 118.A N LEU 114.A O.B no hydrogen 2.834 N/A ILE 119.A N TYR 115.A O no hydrogen 2.934 N/A ARG 120.A N ASN 116.A O no hydrogen 3.139 N/A ARG 121.A N MET 117.A O.A no hydrogen 3.012 N/A ARG 121.A N MET 117.A O.B no hydrogen 3.063 N/A ARG 121.A NH1 ARG 121.A O no hydrogen 3.055 N/A TYR 122.A N ILE 118.A O no hydrogen 2.821 N/A SER 123.A N ILE 119.A O no hydrogen 2.920 N/A ASP 124.A N ASN 128.A O no hydrogen 2.869 N/A GLY 127.A N ASP 124.A O no hydrogen 2.958 N/A ASN 128.A N ASP 124.A OD1 no hydrogen 2.933 N/A MET 129.A N ILE 94.A O no hydrogen 2.808 N/A PHE 131.A N LYS 40.A O no hydrogen 2.953 N/A ASN 133.A N ASP 130.A OD1 no hydrogen 3.188 N/A ASN 133.A ND2 TYR 122.A O no hydrogen 2.797 N/A PHE 134.A N ASP 130.A O no hydrogen 2.963 N/A ILE 135.A N PHE 131.A O no hydrogen 2.964 N/A SER 136.A N.A ASP 132.A O no hydrogen 2.929 N/A SER 136.A N.B ASP 132.A O no hydrogen 2.919 N/A SER 136.A N.C ASP 132.A O no hydrogen 2.963 N/A SER 136.A OG.B ASP 132.A O no hydrogen 2.720 N/A SER 136.A OG.C ASP 132.A O no hydrogen 3.151 N/A SER 136.A OG.C ASN 133.A O no hydrogen 3.048 N/A CYS 137.A N ASN 133.A O no hydrogen 2.929 N/A LEU 138.A N PHE 134.A O no hydrogen 3.018 N/A VAL 139.A N ILE 135.A O no hydrogen 2.884 N/A ARG 140.A N SER 136.A O.A no hydrogen 3.056 N/A ARG 140.A N SER 136.A O.B no hydrogen 3.146 N/A ARG 140.A N SER 136.A O.C no hydrogen 3.290 N/A ARG 140.A NH1 SER 173.A O no hydrogen 2.969 N/A ARG 140.A NH1 SER 173.A OG no hydrogen 3.337 N/A ARG 140.A NH2 SER 173.A OG no hydrogen 3.021 N/A LEU 141.A N CYS 137.A O no hydrogen 2.734 N/A ASP 142.A N LEU 138.A O no hydrogen 2.859 N/A ALA 143.A N VAL 139.A O no hydrogen 2.991 N/A MET 144.A N ARG 140.A O no hydrogen 2.793 N/A PHE 145.A N LEU 141.A O no hydrogen 2.969 N/A ARG 146.A N ASP 142.A O no hydrogen 2.970 N/A ARG 146.A NE ASP 142.A OD2 no hydrogen 3.010 N/A ALA 147.A N ALA 143.A O no hydrogen 2.806 N/A PHE 148.A N MET 144.A O no hydrogen 3.004 N/A LYS 149.A N.A PHE 145.A O no hydrogen 2.898 N/A LYS 149.A N.B PHE 145.A O no hydrogen 2.946 N/A SER 150.A N.A ARG 146.A O no hydrogen 3.053 N/A SER 150.A N.B ARG 146.A O no hydrogen 2.903 N/A SER 150.A N.C ARG 146.A O no hydrogen 2.888 N/A SER 150.A OG.A ARG 146.A O no hydrogen 2.996 N/A SER 150.A OG.B ALA 147.A O no hydrogen 2.787 N/A LEU 151.A N ALA 147.A O no hydrogen 3.044 N/A LEU 151.A N PHE 148.A O no hydrogen 3.014 N/A ASP 152.A N PHE 148.A O no hydrogen 2.863 N/A ASP 152.A N LYS 149.A O.B no hydrogen 2.946 N/A LYS 153.A NZ SER 150.A O.A no hydrogen 3.242 N/A LYS 153.A NZ SER 150.A O.B no hydrogen 3.293 N/A GLY 155.A N ASP 152.A O no hydrogen 3.178 N/A THR 156.A N ASP 152.A OD1 no hydrogen 2.936 N/A THR 156.A OG1 ASP 152.A OD1 no hydrogen 3.294 N/A GLY 157.A N ASP 152.A OD2 no hydrogen 2.798 N/A GLN 158.A N THR 156.A OG1 no hydrogen 3.137 N/A ASN 162.A N GLU 165.A OE1 no hydrogen 3.146 N/A GLN 164.A NE2 GLN 168.A OE1 no hydrogen 2.910 N/A GLU 165.A N ASN 162.A OD1 no hydrogen 2.867 N/A TRP 166.A N ASN 162.A O no hydrogen 2.824 N/A LEU 167.A N ILE 163.A O no hydrogen 2.859 N/A GLN 168.A N GLN 164.A O no hydrogen 2.972 N/A LEU 169.A N GLU 165.A O no hydrogen 2.964 N/A THR 170.A N TRP 166.A O no hydrogen 2.987 N/A THR 170.A OG1 TRP 166.A O no hydrogen 2.859 N/A MET 171.A N LEU 167.A O no hydrogen 2.822 N/A TYR 172.A N GLN 168.A O no hydrogen 3.082 N/A TYR 172.A OH ASP 57.A OD2 no hydrogen 2.608 N/A SER 173.A OG THR 170.A O no hydrogen 2.867 N/A