Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4xkc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 5.A N ASN 1.A O no hydrogen 3.151 N/A SER 6.A N LEU 2.A O no hydrogen 2.880 N/A SER 6.A OG LEU 2.A O no hydrogen 2.821 N/A GLN 7.A N THR 3.A O no hydrogen 3.085 N/A GLN 7.A N GLU 4.A O no hydrogen 3.240 N/A GLN 8.A N LEU 5.A O no hydrogen 3.155 N/A LEU 9.A N SER 6.A O no hydrogen 3.307 N/A GLN 12.A NE2 LEU 9.A O no hydrogen 2.391 N/A THR 14.A OG1 LYS 11.A O no hydrogen 2.674 N/A ALA 15.A N LYS 11.A O no hydrogen 3.486 N/A ILE 16.A N GLN 12.A O no hydrogen 3.057 N/A ALA 17.A N LEU 13.A O no hydrogen 2.757 N/A ALA 18.A N THR 14.A O no hydrogen 2.907 N/A LEU 19.A N ALA 15.A O no hydrogen 2.856 N/A ALA 20.A N ILE 16.A O no hydrogen 3.084 N/A GLU 21.A N ALA 18.A O no hydrogen 3.197 N/A MET 22.A N LEU 19.A O no hydrogen 3.085 N/A GLY 26.A N MET 22.A O no hydrogen 3.269 N/A GLN 27.A N GLY 23.A O no hydrogen 3.107 N/A GLN 27.A NE2 ALA 20.A O no hydrogen 3.325 N/A GLY 28.A N GLU 24.A O no hydrogen 2.841 N/A ILE 29.A N GLY 25.A O no hydrogen 3.172 N/A LEU 30.A N GLY 26.A O no hydrogen 3.029 N/A LEU 31.A N GLN 27.A O no hydrogen 2.857 N/A ASP 32.A N GLY 28.A O no hydrogen 3.016 N/A TYR 33.A N ILE 29.A O no hydrogen 2.954 N/A LEU 34.A N LEU 30.A O no hydrogen 3.167 N/A ALA 35.A N LEU 31.A O no hydrogen 3.230 N/A LYS 36.A N ASP 32.A O no hydrogen 3.277 N/A LYS 36.A N TYR 33.A O no hydrogen 3.219 N/A LYS 36.A NZ ASP 32.A OD2 no hydrogen 2.950 N/A ASN 37.A N LEU 34.A O no hydrogen 3.001 N/A ASN 37.A ND2 TYR 33.A O no hydrogen 2.836 N/A VAL 38.A N LEU 34.A O no hydrogen 2.803 N/A LEU 40.A N ILE 74.A O no hydrogen 3.009 N/A VAL 47.A N VAL 44.A O no hydrogen 3.074 N/A GLY 48.A N VAL 44.A O no hydrogen 3.276 N/A ASN 49.A N LEU 45.A O no hydrogen 2.796 N/A ASN 49.A ND2 ASN 147.A OD1 no hydrogen 2.848 N/A VAL 50.A N ALA 46.A O no hydrogen 2.907 N/A TYR 51.A N VAL 47.A O no hydrogen 3.076 N/A GLN 52.A N GLY 48.A O no hydrogen 2.917 N/A GLN 52.A NE2 ASN 56.A OD1 no hydrogen 3.096 N/A GLN 52.A NE2 GLY 93.A O no hydrogen 3.121 N/A THR 53.A N ASN 49.A O no hydrogen 2.875 N/A THR 53.A OG1 ASN 49.A O no hydrogen 2.574 N/A LEU 54.A N VAL 50.A O no hydrogen 3.100 N/A ARG 55.A N TYR 51.A O no hydrogen 2.977 N/A ARG 55.A NH1 TYR 51.A OH no hydrogen 2.824 N/A ASN 56.A N GLN 52.A O no hydrogen 2.819 N/A LEU 57.A N LEU 54.A O no hydrogen 3.201 N/A GLU 58.A N ARG 55.A O no hydrogen 3.182 N/A THR 63.A N GLN 59.A O no hydrogen 2.939 N/A THR 63.A OG1 GLN 59.A O no hydrogen 3.097 N/A THR 64.A N GLU 60.A O no hydrogen 2.814 N/A THR 64.A OG1 GLU 60.A O no hydrogen 2.787 N/A GLN 65.A N THR 61.A O no hydrogen 3.062 N/A LEU 66.A N ILE 62.A O no hydrogen 2.864 N/A GLN 67.A N THR 63.A O no hydrogen 2.886 N/A ARG 68.A N THR 64.A O no hydrogen 2.921 N/A ASN 69.A N GLN 65.A O no hydrogen 2.857 N/A ASN 69.A ND2 GLN 65.A O no hydrogen 2.945 N/A TYR 70.A N LEU 66.A O no hydrogen 2.753 N/A GLY 73.A N TYR 70.A O no hydrogen 3.114 N/A SER 79.A OG ASP 134.A OD2 no hydrogen 2.567 N/A ALA 80.A N ASP 134.A OD1 no hydrogen 2.665 N/A GLN 81.A N SER 79.A OG no hydrogen 3.103 N/A GLN 81.A NE2.B LEU 111.A O no hydrogen 3.053 N/A GLY 82.A N SER 79.A O no hydrogen 3.441 N/A ILE 83.A N SER 79.A OG no hydrogen 2.870 N/A TYR 85.A OH ASP 134.A OD2 no hydrogen 2.653 N/A LEU 86.A N ASP 84.A OD1 no hydrogen 3.050 N/A GLN 89.A N TYR 85.A O no hydrogen 3.042 N/A GLN 89.A NE2 TYR 51.A OH no hydrogen 3.566 N/A GLU 90.A N LEU 86.A O no hydrogen 2.738 N/A ALA 91.A N PRO 87.A O no hydrogen 3.062 N/A LEU 92.A N LEU 88.A O no hydrogen 3.029 N/A GLY 93.A N GLN 89.A O no hydrogen 2.762 N/A SER 94.A N GLU 90.A O no hydrogen 3.053 N/A SER 94.A N ALA 91.A O no hydrogen 3.229 N/A SER 94.A OG.A GLU 90.A O no hydrogen 3.162 N/A SER 94.A OG.B GLU 90.A O no hydrogen 3.116 N/A SER 94.A OG.B ALA 91.A O no hydrogen 2.689 N/A GLN 95.A N LEU 92.A O no hydrogen 2.889 N/A GLN 95.A NE2 LEU 92.A O no hydrogen 2.865 N/A GLN 95.A NE2 HIS 145.A O no hydrogen 3.020 N/A ASP 96.A N ALA 91.A O no hydrogen 2.851 N/A THR 99.A N ASP 96.A OD1 no hydrogen 3.276 N/A THR 99.A OG1 ASP 96.A OD1 no hydrogen 3.361 N/A THR 99.A OG1 ASP 96.A OD2 no hydrogen 2.758 N/A ALA 100.A N ASP 96.A O no hydrogen 2.996 N/A ASP 101.A N PHE 97.A O no hydrogen 2.836 N/A GLU 102.A N GLU 98.A O no hydrogen 3.138 N/A ILE 103.A N THR 99.A O no hydrogen 2.892 N/A THR 104.A N ALA 100.A O no hydrogen 2.924 N/A THR 104.A OG1 ALA 100.A O no hydrogen 2.814 N/A ARG 105.A N ASP 101.A O no hydrogen 3.083 N/A ARG 105.A NH1.A ASP 101.A OD2 no hydrogen 3.418 N/A ARG 105.A NH1.B ASP 101.A OD2 no hydrogen 3.273 N/A ARG 105.A NH2.A ASP 101.A OD2 no hydrogen 2.586 N/A ASP 106.A N GLU 102.A O no hydrogen 3.062 N/A LYS 107.A N ILE 103.A O no hydrogen 2.724 N/A LYS 107.A NZ ASP 84.A O no hydrogen 2.660 N/A LEU 108.A N THR 104.A O no hydrogen 2.969 N/A CYS 109.A N ARG 105.A O no hydrogen 3.385 N/A CYS 109.A SG ARG 105.A O no hydrogen 3.752 N/A CYS 109.A SG ALA 116.A O no hydrogen 3.808 N/A GLU 110.A N ASP 106.A O no hydrogen 3.024 N/A LEU 111.A N LYS 107.A O no hydrogen 2.808 N/A ALA 112.A N LEU 108.A O no hydrogen 3.023 N/A GLY 113.A N CYS 109.A O no hydrogen 3.149 N/A SER 117.A N GLY 113.A O no hydrogen 2.940 N/A SER 117.A OG CYS 109.A O no hydrogen 3.129 N/A SER 117.A OG GLY 113.A O no hydrogen 2.626 N/A GLN 118.A N PRO 114.A O no hydrogen 2.874 N/A ARG 119.A N GLY 115.A O no hydrogen 3.089 N/A ARG 119.A NH1 TRP 121.A O no hydrogen 2.830 N/A ARG 119.A NH1 GLU 126.A OE1 no hydrogen 2.998 N/A ARG 119.A NH1 GLU 126.A OE2 no hydrogen 3.463 N/A ARG 119.A NH2 GLU 126.A OE2 no hydrogen 2.970 N/A GLN 120.A N ALA 116.A O no hydrogen 2.706 N/A GLN 120.A NE2 SER 117.A O no hydrogen 2.743 N/A TYR 123.A N GLU 126.A OE1 no hydrogen 3.073 N/A GLU 126.A N TYR 123.A O no hydrogen 3.074 N/A VAL 127.A N TYR 123.A O no hydrogen 3.275 N/A GLU 128.A N PHE 124.A O no hydrogen 3.034 N/A LYS 129.A N THR 125.A O no hydrogen 3.276 N/A LYS 129.A N GLU 126.A O no hydrogen 3.214 N/A PHE 130.A N VAL 127.A O no hydrogen 3.181 N/A HIS 136.A N ALA 132.A O no hydrogen 2.912 N/A THR 137.A N LEU 133.A O no hydrogen 3.015 N/A THR 137.A OG1 GLN 78.A O no hydrogen 2.795 N/A THR 137.A OG1 LEU 133.A O no hydrogen 3.216 N/A ILE 138.A N ASP 134.A O no hydrogen 2.983 N/A ASN 139.A N LEU 135.A O no hydrogen 2.895 N/A ASN 139.A ND2 SER 153.A OG no hydrogen 2.887 N/A ALA 140.A N HIS 136.A O no hydrogen 2.823 N/A LEU 141.A N THR 137.A O no hydrogen 3.082 N/A TRP 142.A N ILE 138.A O no hydrogen 3.262 N/A TRP 142.A NE1 THR 104.A OG1 no hydrogen 2.815 N/A TRP 143.A N ASN 139.A O no hydrogen 2.881 N/A LEU 144.A N ALA 140.A O no hydrogen 2.775 N/A HIS 145.A N LEU 141.A O no hydrogen 3.151 N/A HIS 145.A ND1 GLN 52.A OE1 no hydrogen 2.838 N/A SER 146.A N TRP 143.A O no hydrogen 3.396 N/A SER 146.A OG TRP 142.A O no hydrogen 2.693 N/A SER 146.A OG TRP 143.A O no hydrogen 3.467 N/A GLY 148.A N TRP 143.A O no hydrogen 2.950 N/A ASN 149.A N SER 146.A O no hydrogen 2.963 N/A ASN 149.A ND2 ALA 194.A O no hydrogen 3.138 N/A PHE 150.A N SER 146.A OG no hydrogen 2.827 N/A GLY 151.A N LEU 199.A O no hydrogen 2.857 N/A SER 153.A N ASN 139.A OD1 no hydrogen 2.853 N/A GLN 155.A N GLY 151.A O no hydrogen 3.126 N/A GLN 155.A NE2 GLY 197.A O no hydrogen 3.053 N/A GLN 155.A NE2 PRO 200.A O no hydrogen 2.710 N/A ARG 156.A N PHE 152.A O no hydrogen 2.789 N/A ARG 156.A NE TYR 215.A O no hydrogen 3.332 N/A ARG 157.A N SER 153.A O no hydrogen 3.081 N/A ARG 157.A NE TRP 225.A O no hydrogen 2.667 N/A ARG 157.A NH2 TRP 225.A O no hydrogen 3.331 N/A ARG 157.A NH2 TRP 225.A OXT no hydrogen 2.768 N/A LEU 158.A N VAL 154.A O no hydrogen 3.182 N/A TRP 159.A N GLN 155.A O no hydrogen 2.887 N/A LEU 160.A N ARG 156.A O no hydrogen 2.891 N/A ALA 161.A N ARG 157.A O no hydrogen 2.885 N/A SER 162.A N TRP 159.A O no hydrogen 3.092 N/A SER 162.A OG LEU 158.A O no hydrogen 2.571 N/A GLY 163.A N LEU 160.A O no hydrogen 3.322 N/A LYS 164.A N TRP 159.A O no hydrogen 2.897 N/A GLU 165.A N SER 162.A O no hydrogen 3.243 N/A LYS 168.A N GLU 165.A O no hydrogen 3.035 N/A LYS 168.A NZ GLU 165.A OE1 no hydrogen 3.454 N/A LEU 169.A N GLU 165.A O no hydrogen 3.135 N/A TRP 170.A N PHE 166.A O no hydrogen 3.044 N/A LYS 172.A NZ SER 162.A OG no hydrogen 2.622 N/A ILE 173.A N LEU 169.A O no hydrogen 3.172 N/A TRP 175.A N TRP 170.A O no hydrogen 2.890 N/A TRP 175.A NE1 HIS 198.A O no hydrogen 2.867 N/A SER 177.A N VAL 180.A O no hydrogen 2.950 N/A THR 182.A N TRP 175.A O no hydrogen 2.897 N/A THR 182.A OG1 GLY 174.A O no hydrogen 2.662 N/A GLY 187.A N ARG 183.A O no hydrogen 2.732 N/A PHE 188.A N PRO 185.A O no hydrogen 3.367 N/A THR 189.A N HIS 198.A NE2 no hydrogen 3.011 N/A SER 193.A N ASP 191.A OD2 no hydrogen 2.928 N/A SER 193.A OG ASP 191.A OD2 no hydrogen 2.296 N/A ALA 194.A N ASP 191.A O no hydrogen 3.124 N/A GLY 197.A N ASN 149.A O no hydrogen 2.850 N/A HIS 198.A N PRO 195.A O no hydrogen 3.138 N/A HIS 198.A ND1 ILE 173.A O no hydrogen 2.706 N/A LEU 201.A N ASP 101.A OD1 no hydrogen 2.828 N/A GLN 204.A NE2 LEU 202.A O no hydrogen 2.975 N/A LEU 205.A N ASN 203.A OD1 no hydrogen 3.291 N/A GLY 207.A N GLN 204.A O no hydrogen 3.099 N/A GLU 212.A N VAL 208.A O no hydrogen 2.836 N/A SER 213.A N ARG 209.A O no hydrogen 3.052 N/A SER 213.A OG ARG 209.A O no hydrogen 3.089 N/A LEU 214.A N VAL 210.A O no hydrogen 2.950 N/A TYR 215.A N ALA 211.A O no hydrogen 2.922 N/A TYR 215.A OH GLN 155.A OE1 no hydrogen 2.651 N/A ARG 216.A N GLU 212.A O no hydrogen 2.933 N/A ARG 216.A NE GLU 212.A OE1 no hydrogen 2.937 N/A ARG 216.A NH2 GLU 212.A OE1 no hydrogen 3.477 N/A HIS 217.A N LEU 214.A O no hydrogen 3.226 N/A HIS 217.A NE2 PHE 130.A O no hydrogen 2.703 N/A VAL 219.A N HIS 217.A ND1 no hydrogen 2.979 N/A TRP 220.A NE1 LEU 214.A O no hydrogen 2.667 N/A SER 221.A OG.A PRO 218.A O no hydrogen 3.110 N/A GLN 222.A N PRO 218.A O no hydrogen 3.012 N/A TYR 223.A N VAL 219.A O no hydrogen 2.906 N/A GLY 224.A N SER 221.A O no hydrogen 3.365 N/A TRP 225.A N TRP 220.A O no hydrogen 2.662 N/A TRP 225.A NE1 HIS 136.A ND1 no hydrogen 2.884 N/A