Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3kuq_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 3.A N GLU 62.A O no hydrogen 3.000 N/A GLY 5.A N GLU 62.A OE1 no hydrogen 3.087 N/A SER 6.A N PHE 3.A O no hydrogen 3.184 N/A SER 6.A OG PHE 3.A O no hydrogen 2.697 N/A SER 6.A OG GLU 62.A O no hydrogen 3.179 N/A VAL 7.A N GLU 62.A OE2 no hydrogen 3.079 N/A PHE 8.A N GLU 62.A OE2 no hydrogen 3.101 N/A VAL 10.A N VAL 7.A O no hydrogen 3.262 N/A ASN 15.A N PRO 11.A O no hydrogen 3.214 N/A ASN 15.A ND2 PRO 22.A O no hydrogen 2.774 N/A VAL 16.A N LEU 12.A O no hydrogen 3.088 N/A GLN 17.A N THR 13.A O no hydrogen 3.016 N/A ARG 18.A N VAL 14.A O no hydrogen 2.926 N/A THR 19.A N ASN 15.A O no hydrogen 2.866 N/A THR 19.A OG1 ASN 15.A O no hydrogen 2.672 N/A GLY 20.A N VAL 16.A O no hydrogen 3.011 N/A GLN 21.A N THR 19.A OG1 no hydrogen 3.412 N/A GLN 25.A N ASP 66.A OD2 no hydrogen 2.641 N/A SER 26.A N ASP 66.A OD1 no hydrogen 3.156 N/A SER 26.A OG ASN 61.A OD1 no hydrogen 2.551 N/A SER 26.A OG ASP 66.A OD1 no hydrogen 3.448 N/A ILE 27.A N PRO 24.A O no hydrogen 2.959 N/A GLN 28.A N PRO 24.A O no hydrogen 3.039 N/A GLN 28.A NE2 GLN 21.A OE1 no hydrogen 3.307 N/A GLN 28.A NE2 LEU 23.A O no hydrogen 2.732 N/A GLN 29.A N GLN 25.A O no hydrogen 2.763 N/A ALA 30.A N ILE 27.A O no hydrogen 3.165 N/A MET 31.A N ILE 27.A O no hydrogen 3.368 N/A ARG 32.A N GLN 28.A O no hydrogen 2.935 N/A ARG 32.A NH2 GLN 25.A OE1 no hydrogen 3.303 N/A TYR 33.A N GLN 29.A O no hydrogen 2.889 N/A TYR 33.A OH GLN 73.A O no hydrogen 2.736 N/A LEU 34.A N ALA 30.A O no hydrogen 3.020 N/A ARG 35.A N MET 31.A O no hydrogen 2.897 N/A ARG 35.A NE ASP 142.A OD2 no hydrogen 2.667 N/A ASN 36.A N ARG 32.A O no hydrogen 2.727 N/A HIS 37.A N TYR 33.A O no hydrogen 3.074 N/A CYS 38.A N LEU 34.A O no hydrogen 3.015 N/A CYS 38.A SG TYR 33.A O no hydrogen 3.805 N/A GLN 41.A N CYS 38.A O no hydrogen 3.060 N/A GLN 41.A NE2 ASP 40.A OD1 no hydrogen 2.827 N/A GLY 43.A N ASN 150.A O no hydrogen 2.903 N/A LEU 44.A N GLN 41.A O no hydrogen 3.275 N/A ARG 46.A N GLY 43.A O no hydrogen 2.825 N/A LYS 47.A N GLY 43.A O no hydrogen 2.914 N/A GLY 49.A N ASP 80.A OD2 no hydrogen 2.711 N/A VAL 50.A N ASP 77.A OD1 no hydrogen 2.639 N/A ARG 53.A NH1 ASP 77.A OD2 no hydrogen 3.491 N/A ILE 54.A N VAL 50.A O no hydrogen 2.793 N/A GLN 55.A N LYS 51.A O no hydrogen 2.662 N/A GLN 55.A NE2 GLN 59.A OE1 no hydrogen 2.752 N/A ALA 56.A N SER 52.A O no hydrogen 2.890 N/A LEU 57.A N ARG 53.A O no hydrogen 3.119 N/A ARG 58.A N ILE 54.A O no hydrogen 3.004 N/A ARG 58.A NH1 GLN 84.A OE1 no hydrogen 2.839 N/A ARG 58.A NH1 ASP 88.A OD2 no hydrogen 2.855 N/A ARG 58.A NH2 ASP 88.A OD2 no hydrogen 3.085 N/A GLN 59.A N GLN 55.A O no hydrogen 3.034 N/A MET 60.A N ALA 56.A O no hydrogen 2.970 N/A ASN 61.A N LEU 57.A O no hydrogen 3.011 N/A ASN 61.A ND2 LEU 57.A O no hydrogen 2.821 N/A ASN 61.A ND2 TYR 70.A OH no hydrogen 3.045 N/A GLU 62.A N ARG 58.A O no hydrogen 3.018 N/A GLU 62.A N GLN 59.A O no hydrogen 3.213 N/A GLY 63.A N MET 60.A O no hydrogen 3.442 N/A ALA 64.A N LEU 1.A O no hydrogen 2.733 N/A CYS 67.A N ILE 65.A O no hydrogen 3.088 N/A VAL 68.A N GLN 29.A OE1 no hydrogen 2.829 N/A TYR 70.A OH SER 26.A O no hydrogen 2.519 N/A GLU 71.A N ASN 69.A OD1 no hydrogen 2.999 N/A GLN 73.A N TYR 70.A O no hydrogen 2.974 N/A TYR 76.A N SER 74.A OG no hydrogen 3.150 N/A TYR 76.A OH VAL 42.A O no hydrogen 2.694 N/A ASP 77.A N SER 74.A O no hydrogen 3.167 N/A VAL 78.A N SER 74.A O no hydrogen 3.329 N/A ALA 79.A N ALA 75.A O no hydrogen 2.862 N/A ASP 80.A N TYR 76.A O no hydrogen 3.039 N/A MET 81.A N ASP 77.A O no hydrogen 2.748 N/A LEU 82.A N VAL 78.A O no hydrogen 2.886 N/A LYS 83.A N ALA 79.A O no hydrogen 3.042 N/A LYS 83.A NZ PHE 45.A O no hydrogen 2.730 N/A GLN 84.A N ASP 80.A O no hydrogen 2.937 N/A TYR 85.A N MET 81.A O no hydrogen 2.800 N/A PHE 86.A N LEU 82.A O no hydrogen 3.315 N/A ARG 87.A N LYS 83.A O no hydrogen 2.951 N/A ARG 87.A NE ASP 88.A OD1 no hydrogen 3.073 N/A ARG 87.A NH2 ASP 88.A OD1 no hydrogen 3.010 N/A ASP 88.A N GLN 84.A O no hydrogen 2.772 N/A ASP 88.A N TYR 85.A O no hydrogen 3.263 N/A LEU 89.A N TYR 85.A O no hydrogen 3.233 N/A MET 94.A N LEU 165.A O no hydrogen 3.065 N/A THR 95.A N PRO 92.A O no hydrogen 2.898 N/A THR 95.A OG1 MET 94.A O no hydrogen 2.322 N/A ASN 96.A ND2 GLU 91.A OE1 no hydrogen 2.935 N/A SER 99.A OG GLU 178.A OE1 no hydrogen 2.407 N/A THR 101.A N LYS 97.A O no hydrogen 3.053 N/A THR 101.A OG1 LYS 97.A O no hydrogen 3.287 N/A PHE 102.A N LEU 98.A O no hydrogen 2.797 N/A LEU 103.A N SER 99.A O no hydrogen 3.142 N/A GLN 104.A N GLU 100.A O no hydrogen 3.106 N/A ILE 105.A N THR 101.A O no hydrogen 2.967 N/A TYR 106.A N PHE 102.A O no hydrogen 3.022 N/A GLN 107.A N LEU 103.A O no hydrogen 2.684 N/A TYR 108.A N GLN 104.A O no hydrogen 2.765 N/A TYR 108.A N ILE 105.A O no hydrogen 3.387 N/A VAL 109.A N ILE 105.A O no hydrogen 2.969 N/A GLN 113.A N PRO 110.A O no hydrogen 2.616 N/A ARG 114.A N LYS 111.A O no hydrogen 3.076 N/A ARG 114.A NE VAL 109.A O no hydrogen 2.837 N/A ARG 114.A NH2 VAL 109.A O no hydrogen 3.213 N/A ALA 117.A N GLN 113.A O no hydrogen 2.959 N/A ILE 118.A N ARG 114.A O no hydrogen 2.788 N/A LYS 119.A N LEU 115.A O no hydrogen 2.790 N/A ALA 120.A N GLN 116.A O no hydrogen 3.072 N/A ALA 121.A N ALA 117.A O no hydrogen 2.947 N/A ILE 122.A N ILE 118.A O no hydrogen 3.075 N/A MET 123.A N LYS 119.A O no hydrogen 3.067 N/A LEU 124.A N ALA 121.A O no hydrogen 3.209 N/A LEU 125.A N ILE 122.A O no hydrogen 3.063 N/A GLU 128.A N GLU 128.A OE1 no hydrogen 2.825 N/A ASN 129.A ND2 LEU 93.A O no hydrogen 2.755 N/A ARG 130.A N PRO 126.A O no hydrogen 2.941 N/A ARG 130.A NH1 LEU 125.A O no hydrogen 2.447 N/A ARG 130.A NH2 ASP 127.A OD1 no hydrogen 2.501 N/A GLU 131.A N ASP 127.A O no hydrogen 2.962 N/A VAL 132.A N GLU 128.A O no hydrogen 2.982 N/A LEU 133.A N ASN 129.A O no hydrogen 2.864 N/A GLN 134.A N ARG 130.A O no hydrogen 3.101 N/A THR 135.A N GLU 131.A O no hydrogen 3.115 N/A THR 135.A OG1 GLU 131.A O no hydrogen 3.091 N/A LEU 136.A N VAL 132.A O no hydrogen 2.842 N/A LEU 137.A N LEU 133.A O no hydrogen 2.810 N/A TYR 138.A N GLN 134.A O no hydrogen 3.092 N/A PHE 139.A N THR 135.A O no hydrogen 3.072 N/A LEU 140.A N LEU 136.A O no hydrogen 2.730 N/A SER 141.A N LEU 137.A O no hydrogen 2.828 N/A ASP 142.A N TYR 138.A O no hydrogen 2.960 N/A VAL 143.A N PHE 139.A O no hydrogen 3.095 N/A THR 144.A N LEU 140.A O no hydrogen 2.964 N/A THR 144.A OG1 MET 152.A O no hydrogen 3.097 N/A ALA 145.A N SER 141.A O no hydrogen 2.938 N/A ALA 146.A N VAL 143.A O no hydrogen 3.071 N/A VAL 147.A N THR 144.A O no hydrogen 3.024 N/A GLU 149.A N ALA 146.A O no hydrogen 2.990 N/A ASN 150.A N ALA 146.A O no hydrogen 3.011 N/A ASN 150.A ND2 LEU 39.A O no hydrogen 2.925 N/A ASN 150.A ND2 VAL 143.A O no hydrogen 2.968 N/A GLN 151.A N VAL 147.A O no hydrogen 2.818 N/A MET 152.A N ASN 150.A OD1 no hydrogen 2.912 N/A ASN 156.A N THR 153.A OG1 no hydrogen 2.904 N/A ASN 156.A ND2 GLN 151.A O no hydrogen 2.769 N/A LEU 157.A N THR 153.A O no hydrogen 2.948 N/A ALA 158.A N PRO 154.A O no hydrogen 2.932 N/A VAL 159.A N THR 155.A O no hydrogen 3.050 N/A CYS 160.A N LEU 157.A O no hydrogen 3.118 N/A CYS 160.A SG ASN 156.A O no hydrogen 3.257 N/A LEU 161.A N LEU 157.A O no hydrogen 2.846 N/A ALA 162.A N ALA 158.A O no hydrogen 2.841 N/A SER 164.A N LEU 161.A O no hydrogen 3.093 N/A SER 164.A OG LEU 161.A O no hydrogen 3.235 N/A LEU 165.A N LEU 161.A O no hydrogen 3.182 N/A PHE 166.A N ALA 162.A O no hydrogen 2.829 N/A HIS 167.A NE2 PHE 86.A O no hydrogen 2.905 N/A LEU 168.A N PRO 163.A O no hydrogen 3.093 N/A GLN 173.A NE2 ASN 177.A OD1 no hydrogen 2.539 N/A LYS 174.A N ASP 172.A OD2 no hydrogen 3.163 N/A LYS 174.A NZ GLU 100.A OE2 no hydrogen 2.899 N/A LYS 174.A NZ GLU 178.A OE2 no hydrogen 3.386 N/A LEU 176.A N ASP 172.A O no hydrogen 3.199 N/A ASN 177.A N GLN 173.A O no hydrogen 2.733 N/A GLU 178.A N LYS 174.A O no hydrogen 2.879 N/A ASN 179.A N ASP 175.A O no hydrogen 3.009 N/A LEU 180.A N LEU 176.A O no hydrogen 2.989 N/A ALA 181.A N ASN 177.A O no hydrogen 2.882 N/A ALA 182.A N GLU 178.A O no hydrogen 2.800 N/A THR 183.A N ASN 179.A O no hydrogen 3.096 N/A THR 183.A OG1 ASN 179.A O no hydrogen 2.703 N/A THR 183.A OG1 ASN 179.A OD1 no hydrogen 3.428 N/A GLN 184.A N LEU 180.A O no hydrogen 2.896 N/A GLN 184.A NE2 GLN 184.A O no hydrogen 3.692 N/A GLY 185.A N ALA 181.A O no hydrogen 2.721 N/A LEU 186.A N ALA 182.A O no hydrogen 2.848 N/A ALA 187.A N THR 183.A O no hydrogen 2.880 N/A HIS 188.A N GLN 184.A O no hydrogen 2.933 N/A MET 189.A N GLY 185.A O no hydrogen 3.027 N/A ILE 190.A N LEU 186.A O no hydrogen 2.869 N/A ALA 191.A N ALA 187.A O no hydrogen 2.839 N/A GLU 192.A N HIS 188.A O no hydrogen 3.322 N/A GLU 192.A N MET 189.A O no hydrogen 3.143 N/A