Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2w1g_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 3.A N ASP 6.A OD2 no hydrogen 2.978 N/A ASP 6.A N ALA 3.A O no hydrogen 2.765 N/A PHE 7.A N LEU 4.A O no hydrogen 3.085 N/A GLU 8.A N ARG 25.A O no hydrogen 2.753 N/A GLY 10.A N LEU 23.A O no hydrogen 2.760 N/A LEU 13.A N VAL 21.A O no hydrogen 2.687 N/A GLY 14.A N VAL 21.A O no hydrogen 3.236 N/A GLY 19.A N GLY 16.A O no hydrogen 3.150 N/A VAL 21.A N GLY 14.A O no hydrogen 2.999 N/A TYR 22.A N LEU 35.A O no hydrogen 2.707 N/A LEU 23.A N ARG 11.A O no hydrogen 3.007 N/A ALA 24.A N LEU 33.A O no hydrogen 2.866 N/A ARG 25.A N GLU 8.A O no hydrogen 2.808 N/A ARG 25.A NH2 GLU 8.A OE1 no hydrogen 2.718 N/A GLU 26.A N PHE 31.A O no hydrogen 2.898 N/A LYS 27.A N ASP 6.A O no hydrogen 2.663 N/A LYS 27.A NZ GLU 5.A O no hydrogen 2.854 N/A LYS 27.A NZ PHE 7.A O no hydrogen 2.875 N/A GLN 28.A N GLU 26.A OE1 no hydrogen 2.831 N/A LYS 30.A N GLU 26.A O no hydrogen 2.784 N/A LEU 33.A N ALA 24.A O no hydrogen 2.880 N/A ALA 34.A N LEU 84.A O no hydrogen 2.795 N/A LEU 35.A N TYR 22.A O no hydrogen 2.689 N/A LYS 36.A N LEU 82.A O no hydrogen 2.898 N/A VAL 37.A N ASN 20.A O no hydrogen 2.609 N/A LEU 38.A N VAL 80.A O no hydrogen 2.721 N/A PHE 39.A N PHE 18.A O no hydrogen 3.195 N/A LYS 40.A N THR 78.A O no hydrogen 3.201 N/A LYS 40.A NZ HIS 75.A ND1 no hydrogen 2.913 N/A LYS 40.A NZ ASP 76.A O no hydrogen 3.233 N/A LEU 43.A N PHE 39.A O no hydrogen 3.231 N/A LEU 43.A N LYS 40.A O no hydrogen 2.747 N/A GLU 44.A N LYS 40.A O no hydrogen 3.023 N/A LYS 45.A N ALA 41.A O no hydrogen 3.385 N/A ALA 46.A N GLN 42.A O no hydrogen 3.198 N/A GLY 47.A N GLU 44.A O no hydrogen 2.881 N/A VAL 48.A N LEU 43.A O no hydrogen 2.978 N/A GLU 49.A N GLU 49.A OE2 no hydrogen 3.152 N/A LEU 52.A N VAL 48.A O no hydrogen 2.850 N/A ARG 53.A N GLU 49.A O no hydrogen 3.212 N/A ARG 54.A N GLN 51.A O no hydrogen 3.016 N/A GLU 55.A N GLN 51.A O no hydrogen 2.912 N/A VAL 56.A N LEU 52.A O no hydrogen 3.029 N/A GLU 57.A N ARG 53.A O no hydrogen 3.402 N/A ILE 58.A N ARG 54.A O no hydrogen 3.064 N/A GLN 59.A N GLU 55.A O no hydrogen 3.175 N/A GLN 59.A NE2 LEU 68.A O no hydrogen 3.042 N/A SER 60.A N VAL 56.A O no hydrogen 3.031 N/A SER 60.A N GLU 57.A O no hydrogen 3.152 N/A HIS 61.A N GLU 57.A O no hydrogen 3.165 N/A ARG 63.A N TYR 120.A OH no hydrogen 3.109 N/A ASN 66.A N HIS 64.A ND1 no hydrogen 2.961 N/A ASN 66.A ND2 LEU 144.A O no hydrogen 2.912 N/A ILE 67.A N HIS 64.A O no hydrogen 2.954 N/A LEU 68.A N ILE 146.A O no hydrogen 2.993 N/A ARG 69.A N GLU 85.A OE2 no hydrogen 2.804 N/A TYR 71.A N ILE 83.A O no hydrogen 2.857 N/A PHE 74.A N TYR 81.A O no hydrogen 2.879 N/A ASP 76.A N ARG 79.A O no hydrogen 3.075 N/A ARG 79.A N ASP 76.A OD1 no hydrogen 3.351 N/A VAL 80.A N LEU 38.A O no hydrogen 2.349 N/A TYR 81.A N PHE 74.A O no hydrogen 2.549 N/A LEU 82.A N LYS 36.A O no hydrogen 2.941 N/A ILE 83.A N GLY 72.A O no hydrogen 3.203 N/A LEU 84.A N ALA 34.A O no hydrogen 2.743 N/A GLU 85.A N ARG 69.A O no hydrogen 2.999 N/A LEU 89.A N LEU 138.A O no hydrogen 3.014 N/A GLY 90.A N ALA 87.A O no hydrogen 3.452 N/A VAL 92.A N LEU 136.A O no hydrogen 2.773 N/A TYR 93.A N PRO 133.A O no hydrogen 3.310 N/A TYR 93.A OH GLN 97.A OE1 no hydrogen 3.394 N/A ARG 94.A N THR 91.A OG1 no hydrogen 2.996 N/A GLU 95.A N THR 91.A O no hydrogen 3.290 N/A LEU 96.A N VAL 92.A O no hydrogen 2.988 N/A LEU 96.A N TYR 93.A O no hydrogen 2.981 N/A GLN 97.A N TYR 93.A O no hydrogen 2.975 N/A LYS 98.A N ARG 94.A O no hydrogen 2.815 N/A LYS 98.A NZ GLU 95.A OE1 no hydrogen 3.528 N/A LYS 98.A NZ GLU 95.A OE2 no hydrogen 3.447 N/A LEU 99.A N GLU 95.A O no hydrogen 2.728 N/A SER 100.A OG LEU 99.A O no hydrogen 2.272 N/A PHE 102.A N PHE 187.A O no hydrogen 2.748 N/A ARG 106.A N ASP 103.A OD1 no hydrogen 2.806 N/A ARG 106.A NE TYR 110.A OH no hydrogen 2.841 N/A THR 107.A N ASP 103.A O no hydrogen 2.800 N/A THR 107.A OG1 ASP 103.A O no hydrogen 2.869 N/A ALA 108.A N GLU 104.A O no hydrogen 2.850 N/A THR 109.A N GLN 105.A O no hydrogen 3.223 N/A THR 109.A OG1 GLN 105.A O no hydrogen 2.289 N/A TYR 110.A N ARG 106.A O no hydrogen 3.125 N/A ILE 111.A N THR 107.A O no hydrogen 2.871 N/A THR 112.A N ALA 108.A O no hydrogen 2.893 N/A THR 112.A OG1 ALA 108.A O no hydrogen 3.004 N/A THR 112.A OG1 SER 252.A OG no hydrogen 2.517 N/A GLU 113.A N THR 109.A O no hydrogen 2.849 N/A LEU 114.A N TYR 110.A O no hydrogen 2.748 N/A ALA 115.A N ILE 111.A O no hydrogen 2.601 N/A ASN 116.A N THR 112.A O no hydrogen 2.845 N/A ALA 117.A N GLU 113.A O no hydrogen 3.082 N/A LEU 118.A N LEU 114.A O no hydrogen 2.950 N/A SER 119.A N ALA 115.A O no hydrogen 2.615 N/A TYR 120.A N ASN 116.A O no hydrogen 2.951 N/A CYS 121.A N ALA 117.A O no hydrogen 3.097 N/A CYS 121.A SG ALA 117.A O no hydrogen 2.774 N/A HIS 122.A N LEU 118.A O no hydrogen 2.914 N/A HIS 122.A NE2 ASP 176.A OD2 no hydrogen 2.987 N/A SER 123.A N SER 119.A O no hydrogen 3.291 N/A SER 123.A OG TYR 120.A O no hydrogen 2.589 N/A LYS 124.A N CYS 121.A O no hydrogen 3.086 N/A ARG 125.A N HIS 122.A O no hydrogen 2.469 N/A VAL 126.A N CYS 121.A O no hydrogen 2.992 N/A ILE 127.A N VAL 153.A O no hydrogen 2.707 N/A HIS 128.A N ASP 176.A OD2 no hydrogen 2.988 N/A HIS 128.A NE2 ALA 147.A O no hydrogen 3.039 N/A ARG 129.A N ASP 176.A OD1 no hydrogen 2.873 N/A ARG 129.A NE TRP 151.A O no hydrogen 3.169 N/A ARG 129.A NH1 HIS 171.A NE2 no hydrogen 3.435 N/A ARG 129.A NH2 TRP 151.A O no hydrogen 2.862 N/A LYS 132.A NZ ASP 130.A OD1 no hydrogen 3.281 N/A ASN 135.A N LYS 132.A O no hydrogen 2.668 N/A ASN 135.A ND2 ASP 130.A O no hydrogen 2.558 N/A ASN 135.A ND2 ASP 130.A OD2 no hydrogen 3.246 N/A LEU 136.A N PRO 133.A O no hydrogen 3.115 N/A LEU 137.A N LYS 145.A O no hydrogen 2.856 N/A GLY 139.A N GLU 143.A O no hydrogen 2.710 N/A GLY 142.A N GLY 139.A O no hydrogen 2.810 N/A GLU 143.A N GLU 143.A OE1 no hydrogen 2.464 N/A LEU 144.A N GLU 113.A OE1 no hydrogen 3.114 N/A LYS 145.A N LEU 137.A O no hydrogen 2.731 N/A LYS 145.A NZ PRO 65.A O no hydrogen 3.244 N/A LYS 145.A NZ GLU 85.A OE1 no hydrogen 2.435 N/A ILE 146.A N ASN 66.A O no hydrogen 3.217 N/A ALA 147.A N ASN 135.A O no hydrogen 2.883 N/A GLY 150.A N ASP 148.A OD2 no hydrogen 2.988 N/A SER 152.A N PHE 149.A O no hydrogen 3.166 N/A SER 152.A OG ILE 127.A O no hydrogen 3.120 N/A VAL 153.A N ILE 127.A O no hydrogen 2.955 N/A TYR 160.A OH GLU 186.A OE1 no hydrogen 2.369 N/A TYR 160.A OH GLU 186.A OE2 no hydrogen 3.112 N/A LEU 161.A N LEU 158.A O no hydrogen 3.004 N/A GLU 164.A N GLU 164.A OE1 no hydrogen 2.621 N/A MET 165.A N PRO 162.A O no hydrogen 3.225 N/A ILE 166.A N PRO 162.A O no hydrogen 3.273 N/A GLU 167.A N PRO 163.A O no hydrogen 2.914 N/A GLY 168.A N MET 165.A O no hydrogen 3.229 N/A ARG 169.A NH1 GLU 167.A OE1 no hydrogen 2.816 N/A LYS 174.A N ASP 172.A OD1 no hydrogen 3.321 N/A LYS 174.A NZ ARG 236.A O no hydrogen 2.262 N/A LYS 174.A NZ PRO 237.A O no hydrogen 2.977 N/A LEU 177.A N LYS 174.A O no hydrogen 2.930 N/A TRP 178.A N LYS 174.A O no hydrogen 3.228 N/A TRP 178.A N VAL 175.A O no hydrogen 2.764 N/A SER 179.A N VAL 175.A O no hydrogen 2.965 N/A SER 179.A OG TYR 160.A O no hydrogen 3.124 N/A LEU 180.A N ASP 176.A O no hydrogen 3.069 N/A GLY 181.A N LEU 177.A O no hydrogen 3.239 N/A VAL 182.A N TRP 178.A O no hydrogen 2.921 N/A LEU 183.A N SER 179.A O no hydrogen 2.838 N/A CYS 184.A N LEU 180.A O no hydrogen 2.785 N/A TYR 185.A N GLY 181.A O no hydrogen 2.986 N/A TYR 185.A OH THR 212.A O no hydrogen 2.697 N/A GLU 186.A N VAL 182.A O no hydrogen 2.909 N/A PHE 187.A N LEU 183.A O no hydrogen 2.939 N/A LEU 188.A N CYS 184.A O no hydrogen 3.461 N/A VAL 189.A N TYR 185.A O no hydrogen 2.924 N/A GLY 190.A N GLU 186.A O no hydrogen 2.670 N/A GLU 195.A N PRO 192.A O no hydrogen 3.180 N/A GLU 201.A N THR 198.A OG1 no hydrogen 2.879 N/A THR 202.A N THR 198.A O no hydrogen 2.985 N/A THR 202.A OG1 THR 198.A O no hydrogen 2.826 N/A TYR 203.A N TYR 199.A O no hydrogen 2.898 N/A LYS 204.A N GLN 200.A O no hydrogen 3.288 N/A ARG 205.A N GLU 201.A O no hydrogen 2.770 N/A ILE 206.A N THR 202.A O no hydrogen 2.783 N/A SER 207.A N TYR 203.A O no hydrogen 2.831 N/A SER 207.A OG GLU 167.A OE2 no hydrogen 3.270 N/A ARG 208.A N LYS 204.A O no hydrogen 2.987 N/A VAL 209.A N ILE 206.A O no hydrogen 2.967 N/A GLU 210.A N ARG 205.A O no hydrogen 3.003 N/A VAL 217.A N PRO 214.A O no hydrogen 3.224 N/A THR 218.A OG1 GLU 104.A OE2 no hydrogen 2.768 N/A ARG 222.A N THR 218.A O no hydrogen 2.915 N/A ARG 222.A NE VAL 217.A O no hydrogen 2.921 N/A ARG 222.A NH2 VAL 217.A O no hydrogen 3.223 N/A ASP 223.A N GLU 219.A O no hydrogen 2.936 N/A LEU 224.A N GLY 220.A O no hydrogen 3.092 N/A ILE 225.A N ALA 221.A O no hydrogen 2.935 N/A SER 226.A N ARG 222.A O no hydrogen 2.661 N/A SER 226.A OG ARG 222.A O no hydrogen 2.836 N/A ARG 227.A N ASP 223.A O no hydrogen 2.917 N/A ARG 227.A NE ASP 223.A OD2 no hydrogen 2.277 N/A LEU 228.A N LEU 224.A O no hydrogen 3.072 N/A LEU 228.A N ILE 225.A O no hydrogen 3.120 N/A LEU 229.A N ILE 225.A O no hydrogen 2.921 N/A HIS 231.A NE2 GLU 167.A OE2 no hydrogen 3.177 N/A SER 234.A OG ASN 232.A OD1 no hydrogen 3.227 N/A GLN 235.A N ASN 232.A O no hydrogen 3.136 N/A ARG 236.A N PRO 233.A O no hydrogen 2.981 N/A ARG 236.A NE LYS 230.A O no hydrogen 2.943 N/A ARG 236.A NH1 GLU 164.A OE2 no hydrogen 2.500 N/A ARG 236.A NH1 LYS 174.A O no hydrogen 3.208 N/A ARG 236.A NH2 GLU 164.A OE1 no hydrogen 2.941 N/A ARG 236.A NH2 GLU 164.A OE2 no hydrogen 3.116 N/A ARG 236.A NH2 LYS 230.A O no hydrogen 2.681 N/A MET 238.A N GLU 241.A OE1 no hydrogen 2.904 N/A GLU 241.A N MET 238.A O no hydrogen 2.915 N/A VAL 242.A N MET 238.A O no hydrogen 3.247 N/A LEU 243.A N LEU 239.A O no hydrogen 2.943 N/A GLU 244.A N ARG 240.A O no hydrogen 2.948 N/A HIS 245.A N VAL 242.A O no hydrogen 3.192 N/A HIS 245.A NE2 ASP 223.A OD2 no hydrogen 2.852 N/A TRP 247.A N HIS 245.A ND1 no hydrogen 3.181 N/A TRP 247.A NE1 GLU 104.A OE2 no hydrogen 2.516 N/A THR 249.A N HIS 245.A O no hydrogen 3.091 N/A THR 249.A OG1 HIS 245.A O no hydrogen 3.495 N/A ALA 250.A N PRO 246.A O no hydrogen 3.299 N/A ASN 251.A N ILE 248.A O no hydrogen 2.696 N/A ASN 251.A ND2 TRP 247.A O no hydrogen 2.655 N/A SER 252.A N ILE 248.A O no hydrogen 2.526 N/A SER 252.A OG ALA 108.A O no hydrogen 3.538 N/A SER 252.A OG THR 112.A OG1 no hydrogen 2.517 N/A SER 253.A N ASN 251.A O no hydrogen 2.801 N/A