Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4gck_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A NH2 ALA 39.A O no hydrogen 3.483 N/A ARG 3.A NH2 HIS 43.A NE2 no hydrogen 2.855 N/A ARG 4.A N ARG 1.A O no hydrogen 3.255 N/A GLU 5.A N ARG 1.A O no hydrogen 3.354 N/A GLU 6.A N ASN 2.A O no hydrogen 2.660 N/A ILE 7.A N ARG 3.A O no hydrogen 3.019 N/A LEU 8.A N ARG 4.A O no hydrogen 3.156 N/A GLN 9.A N GLU 5.A O no hydrogen 2.814 N/A SER 10.A N GLU 6.A O no hydrogen 2.876 N/A SER 10.A OG GLU 6.A O no hydrogen 3.051 N/A LEU 11.A N ILE 7.A O no hydrogen 2.893 N/A ALA 12.A N LEU 8.A O no hydrogen 3.004 N/A LEU 13.A N GLN 9.A O no hydrogen 3.128 N/A MET 14.A N SER 10.A O no hydrogen 3.058 N/A LEU 15.A N LEU 11.A O no hydrogen 3.017 N/A GLU 16.A N ALA 12.A O no hydrogen 2.771 N/A SER 17.A N LEU 13.A O no hydrogen 2.874 N/A SER 17.A OG MET 14.A O no hydrogen 2.711 N/A SER 17.A OG ASP 19.A OD1 no hydrogen 3.215 N/A ASP 19.A N SER 17.A OG no hydrogen 3.022 N/A GLY 20.A N SER 17.A O no hydrogen 3.060 N/A SER 21.A N SER 18.A O no hydrogen 3.476 N/A SER 21.A OG SER 18.A O no hydrogen 2.886 N/A GLN 22.A N ASP 19.A O no hydrogen 2.890 N/A THR 26.A OG1 GLU 37.A OE1 no hydrogen 2.541 N/A LYS 28.A N THR 25.A OG1 no hydrogen 2.897 N/A LEU 29.A N THR 25.A O no hydrogen 2.828 N/A ALA 30.A N THR 26.A O no hydrogen 2.802 N/A ALA 31.A N ALA 27.A O no hydrogen 2.925 N/A SER 32.A N LYS 28.A O no hydrogen 3.023 N/A VAL 33.A N LEU 29.A O no hydrogen 3.037 N/A GLY 34.A N ALA 30.A O no hydrogen 3.007 N/A GLY 34.A N ALA 31.A O no hydrogen 3.211 N/A VAL 35.A N ALA 30.A O no hydrogen 3.301 N/A ALA 39.A N SER 36.A OG no hydrogen 3.314 N/A LEU 40.A N SER 36.A O no hydrogen 3.374 N/A LEU 40.A N GLU 37.A O no hydrogen 2.927 N/A TYR 41.A N ALA 38.A O no hydrogen 2.804 N/A ARG 42.A N ALA 39.A O no hydrogen 3.203 N/A HIS 43.A N LEU 40.A O no hydrogen 3.114 N/A PHE 44.A N LEU 40.A O no hydrogen 3.138 N/A LYS 47.A NZ ILE 24.A O no hydrogen 2.753 N/A LYS 47.A NZ GLU 109.A OE2 no hydrogen 2.727 N/A ARG 49.A N SER 46.A O no hydrogen 3.045 N/A ARG 49.A N SER 46.A OG no hydrogen 3.016 N/A PHE 51.A N LYS 47.A O no hydrogen 3.229 N/A ASP 52.A N THR 48.A O no hydrogen 2.963 N/A SER 53.A N ARG 49.A O no hydrogen 2.926 N/A SER 53.A OG ARG 49.A O no hydrogen 3.164 N/A LEU 54.A N MET 50.A O no hydrogen 2.932 N/A ILE 55.A N PHE 51.A O no hydrogen 2.701 N/A GLU 56.A N ASP 52.A O no hydrogen 2.737 N/A PHE 57.A N SER 53.A O no hydrogen 3.052 N/A ILE 58.A N LEU 54.A O no hydrogen 3.038 N/A GLU 59.A N ILE 55.A O no hydrogen 2.929 N/A ASP 60.A N GLU 56.A O no hydrogen 2.807 N/A SER 61.A N PHE 57.A O no hydrogen 2.867 N/A SER 61.A OG PHE 57.A O no hydrogen 2.636 N/A LEU 62.A N ILE 58.A O no hydrogen 2.955 N/A ILE 63.A N GLU 59.A O no hydrogen 2.748 N/A THR 64.A N ASP 60.A O no hydrogen 2.879 N/A THR 64.A OG1 ASP 60.A O no hydrogen 2.869 N/A ARG 65.A N SER 61.A O no hydrogen 3.122 N/A ILE 66.A N LEU 62.A O no hydrogen 2.897 N/A ASN 67.A N ILE 63.A O no hydrogen 3.079 N/A LEU 68.A N THR 64.A O no hydrogen 3.165 N/A ILE 69.A N ARG 65.A O no hydrogen 2.966 N/A LEU 70.A N ILE 66.A O no hydrogen 2.961 N/A LYS 71.A N ASN 67.A O no hydrogen 2.974 N/A LYS 71.A NZ ASP 72.A OD1 no hydrogen 2.600 N/A ASP 72.A N LEU 68.A O no hydrogen 3.039 N/A GLU 73.A N ILE 69.A O no hydrogen 2.859 N/A LYS 74.A NZ LEU 70.A O no hydrogen 3.011 N/A ASP 75.A N GLU 73.A OE1 no hydrogen 2.497 N/A ALA 78.A N ASP 75.A OD2 no hydrogen 2.959 N/A ARG 79.A N ASP 75.A O no hydrogen 2.750 N/A ARG 79.A NH1 GLU 73.A O no hydrogen 3.066 N/A LEU 80.A N THR 76.A O no hydrogen 3.023 N/A ARG 81.A N THR 77.A O no hydrogen 2.958 N/A ARG 81.A NH2 GLU 179.A OE1 no hydrogen 2.878 N/A LEU 82.A N ALA 78.A O no hydrogen 2.910 N/A ILE 83.A N ARG 79.A O no hydrogen 2.891 N/A VAL 84.A N LEU 80.A O no hydrogen 3.015 N/A LEU 85.A N ARG 81.A O no hydrogen 2.869 N/A LEU 86.A N LEU 82.A O no hydrogen 2.793 N/A ILE 87.A N ILE 83.A O no hydrogen 3.049 N/A LEU 88.A N VAL 84.A O no hydrogen 3.064 N/A GLY 89.A N LEU 85.A O no hydrogen 2.720 N/A PHE 90.A N LEU 86.A O no hydrogen 2.770 N/A GLY 91.A N ILE 87.A O no hydrogen 2.963 N/A GLU 92.A N LEU 88.A O no hydrogen 2.882 N/A ARG 93.A N GLY 89.A O no hydrogen 2.959 N/A ASN 94.A N PHE 90.A O no hydrogen 3.146 N/A ASN 94.A N GLY 91.A O no hydrogen 3.152 N/A ASN 94.A ND2 PHE 90.A O no hydrogen 2.770 N/A THR 98.A N ASN 94.A O no hydrogen 3.062 N/A THR 98.A OG1 GLY 91.A O no hydrogen 2.697 N/A THR 98.A OG1 ASN 94.A O no hydrogen 2.986 N/A ARG 99.A N PRO 95.A O no hydrogen 3.127 N/A ARG 99.A NH1 LEU 15.A O no hydrogen 2.951 N/A ILE 100.A N LEU 97.A O no hydrogen 2.924 N/A LEU 101.A N LEU 97.A O no hydrogen 2.785 N/A THR 102.A N THR 98.A O no hydrogen 2.800 N/A THR 102.A OG1 THR 98.A O no hydrogen 3.188 N/A THR 102.A OG1 ARG 99.A O no hydrogen 3.433 N/A THR 102.A OG1 HIS 104.A ND1 no hydrogen 2.803 N/A GLY 103.A N ILE 100.A O no hydrogen 2.997 N/A HIS 104.A ND1 THR 102.A OG1 no hydrogen 2.803 N/A ALA 105.A N ARG 99.A O no hydrogen 3.028 N/A LEU 106.A N GLY 103.A O no hydrogen 3.195 N/A MET 107.A N HIS 104.A O no hydrogen 3.157 N/A GLU 109.A N LEU 106.A O no hydrogen 3.084 N/A ARG 112.A NH2 ASP 52.A OD1 no hydrogen 3.422 N/A LEU 113.A N GLN 110.A O no hydrogen 2.843 N/A GLY 115.A N ASP 111.A O no hydrogen 3.252 N/A ARG 116.A N ARG 112.A O no hydrogen 2.978 N/A ARG 116.A NE ASP 52.A OD1 no hydrogen 3.299 N/A ARG 116.A NH2 ASP 52.A OD1 no hydrogen 3.268 N/A ILE 117.A N LEU 113.A O no hydrogen 3.062 N/A ASN 118.A N GLN 114.A O no hydrogen 2.801 N/A GLN 119.A N GLY 115.A O no hydrogen 3.017 N/A GLN 119.A NE2 GLY 115.A O no hydrogen 3.399 N/A LEU 120.A N ARG 116.A O no hydrogen 3.030 N/A PHE 121.A N ILE 117.A O no hydrogen 2.986 N/A GLU 122.A N ASN 118.A O no hydrogen 2.882 N/A ARG 123.A N GLN 119.A O no hydrogen 2.830 N/A ARG 123.A NE GLU 59.A OE2 no hydrogen 3.568 N/A ILE 124.A N LEU 120.A O no hydrogen 2.934 N/A GLU 125.A N PHE 121.A O no hydrogen 2.841 N/A VAL 126.A N GLU 122.A O no hydrogen 2.769 N/A GLN 127.A N ARG 123.A O no hydrogen 2.891 N/A LEU 128.A N ILE 124.A O no hydrogen 2.930 N/A ARG 129.A N GLU 125.A O no hydrogen 2.892 N/A GLN 130.A N VAL 126.A O no hydrogen 3.019 N/A VAL 131.A N GLN 127.A O no hydrogen 2.971 N/A MET 132.A N LEU 128.A O no hydrogen 3.054 N/A ARG 133.A N ARG 129.A O no hydrogen 2.823 N/A ARG 133.A NE GLU 147.A OE2 no hydrogen 2.827 N/A ARG 133.A NH2 GLU 147.A OE2 no hydrogen 3.556 N/A GLU 134.A N VAL 131.A O no hydrogen 3.229 N/A LYS 135.A N MET 132.A O no hydrogen 3.304 N/A ARG 138.A N GLU 134.A O no hydrogen 2.707 N/A ARG 138.A NE GLU 134.A OE2 no hydrogen 2.589 N/A ARG 138.A NH2 GLU 134.A OE2 no hydrogen 3.054 N/A GLU 139.A N LYS 135.A O no hydrogen 2.666 N/A GLY 140.A N LYS 136.A O no hydrogen 2.740 N/A THR 144.A N GLN 190.A OXT no hydrogen 2.628 N/A LEU 145.A N GLN 190.A O no hydrogen 2.941 N/A GLU 147.A N GLU 147.A OE1 no hydrogen 2.606 N/A THR 148.A N ASP 146.A OD1 no hydrogen 2.443 N/A LEU 149.A N ASP 146.A O no hydrogen 2.955 N/A LEU 149.A N ASP 146.A OD1 no hydrogen 3.334 N/A LEU 150.A N ASP 146.A O no hydrogen 3.021 N/A ALA 151.A N GLU 147.A O no hydrogen 2.764 N/A SER 152.A N THR 148.A O no hydrogen 3.244 N/A SER 152.A OG THR 148.A O no hydrogen 2.995 N/A SER 152.A OG LEU 149.A O no hydrogen 2.889 N/A GLN 153.A N LEU 149.A O no hydrogen 3.018 N/A LEU 154.A N LEU 150.A O no hydrogen 2.977 N/A LEU 155.A N ALA 151.A O no hydrogen 2.935 N/A ALA 156.A N SER 152.A O no hydrogen 2.740 N/A PHE 157.A N GLN 153.A O no hydrogen 3.130 N/A CYS 158.A N LEU 154.A O no hydrogen 3.083 N/A CYS 158.A SG LEU 154.A O no hydrogen 3.559 N/A GLU 159.A N LEU 155.A O no hydrogen 2.787 N/A GLY 160.A N ALA 156.A O no hydrogen 2.855 N/A MET 161.A N PHE 157.A O no hydrogen 3.040 N/A LEU 162.A N CYS 158.A O no hydrogen 2.948 N/A SER 163.A N GLU 159.A O no hydrogen 2.898 N/A ARG 164.A N GLY 160.A O no hydrogen 3.083 N/A PHE 165.A N MET 161.A O no hydrogen 2.966 N/A VAL 166.A N LEU 162.A O no hydrogen 2.957 N/A ARG 167.A N SER 163.A O no hydrogen 2.895 N/A SER 168.A N ARG 164.A O no hydrogen 3.032 N/A SER 168.A OG ARG 164.A O no hydrogen 2.690 N/A SER 168.A OG PHE 165.A O no hydrogen 3.071 N/A GLU 169.A N VAL 166.A O no hydrogen 3.152 N/A PHE 170.A N PHE 165.A O no hydrogen 2.706 N/A LYS 171.A N SER 168.A O no hydrogen 3.232 N/A LYS 171.A N SER 168.A OG no hydrogen 3.231 N/A LYS 171.A NZ SER 168.A O no hydrogen 3.212 N/A TYR 172.A N SER 168.A OG no hydrogen 3.020 N/A ARG 173.A N LYS 171.A O no hydrogen 3.091 N/A THR 175.A N GLU 92.A OE1 no hydrogen 2.758 N/A THR 175.A OG1 GLU 92.A OE1 no hydrogen 2.616 N/A THR 175.A OG1 GLU 92.A OE2 no hydrogen 3.299 N/A ASP 176.A N ARG 173.A O no hydrogen 3.184 N/A PHE 178.A N THR 175.A O no hydrogen 2.864 N/A ALA 180.A N ASP 177.A O no hydrogen 2.820 N/A ARG 181.A N ASP 177.A O no hydrogen 2.746 N/A ARG 181.A NE ASP 176.A O no hydrogen 3.267 N/A TRP 182.A N PHE 178.A O no hydrogen 2.616 N/A VAL 185.A N ARG 181.A O no hydrogen 3.038 N/A ALA 186.A N TRP 182.A O no hydrogen 2.734 N/A ALA 187.A N PRO 183.A O no hydrogen 3.113 N/A GLN 188.A N VAL 185.A O no hydrogen 2.960 N/A LEU 189.A N ALA 186.A O no hydrogen 2.880 N/A GLN 190.A NE2 ALA 187.A O no hydrogen 3.003 N/A