Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3f8w_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A OG THR 91.A OG1 no hydrogen 2.983 N/A ALA 4.A N ASP 90.A OD1 no hydrogen 2.864 N/A GLU 7.A N GLU 7.A OE1 no hydrogen 3.017 N/A ASN 8.A N ASN 5.A OD1 no hydrogen 2.851 N/A ASN 8.A ND2 THR 3.A O no hydrogen 2.640 N/A VAL 9.A N ASN 5.A O no hydrogen 2.932 N/A LYS 10.A N ILE 6.A O no hydrogen 2.948 N/A LYS 11.A N GLU 7.A O no hydrogen 3.150 N/A LYS 11.A NZ ASN 8.A OD1 no hydrogen 3.448 N/A VAL 12.A N ASN 8.A O no hydrogen 3.183 N/A ALA 13.A N VAL 9.A O no hydrogen 2.954 N/A HIS 14.A N LYS 10.A O no hydrogen 2.880 N/A HIS 15.A N LYS 11.A O no hydrogen 3.020 N/A HIS 15.A ND1.B LYS 11.A O no hydrogen 3.025 N/A ILE 16.A N VAL 12.A O no hydrogen 3.087 N/A GLN 17.A N ALA 13.A O no hydrogen 3.066 N/A LYS 18.A N HIS 15.A O no hydrogen 2.876 N/A LYS 18.A NZ HIS 14.A O no hydrogen 3.407 N/A LEU 19.A N HIS 15.A O no hydrogen 3.386 N/A LEU 19.A N ILE 16.A O no hydrogen 2.987 N/A ILE 22.A N THR 20.A OG1 no hydrogen 3.035 N/A GLU 25.A N LYS 73.A O no hydrogen 2.832 N/A ILE 26.A N LYS 73.A O no hydrogen 3.234 N/A GLY 27.A N ILE 106.A O no hydrogen 2.754 N/A ILE 28.A N VAL 75.A O no hydrogen 2.817 N/A ILE 29.A N MET 108.A O no hydrogen 3.007 N/A CYS 30.A N MET 77.A O no hydrogen 3.305 N/A CYS 30.A SG MET 77.A O no hydrogen 3.679 N/A GLY 31.A N SER 110.A OG no hydrogen 2.930 N/A LEU 34.A N GLY 31.A O no hydrogen 2.999 N/A LEU 37.A N LEU 34.A O no hydrogen 3.233 N/A ASP 39.A N LYS 36.A O no hydrogen 3.029 N/A LYS 42.A N THR 68.A O no hydrogen 2.926 N/A LYS 44.A NZ ALA 38.A O no hydrogen 3.170 N/A ILE 45.A N PHE 66.A O no hydrogen 2.683 N/A ILE 47.A N LEU 64.A O no hydrogen 2.774 N/A TYR 49.A OH GLY 79.A O no hydrogen 2.821 N/A LYS 51.A N PRO 48.A O no hydrogen 2.934 N/A ILE 52.A N TYR 49.A O no hydrogen 3.099 N/A ASN 63.A N GLN 78.A O no hydrogen 3.199 N/A ASN 63.A ND2 GLN 78.A OE1 no hydrogen 3.271 N/A LEU 64.A N ILE 47.A O no hydrogen 2.767 N/A ILE 65.A N VAL 76.A O no hydrogen 2.868 N/A PHE 66.A N ILE 45.A O no hydrogen 2.875 N/A GLY 67.A N VAL 74.A O no hydrogen 3.282 N/A THR 68.A N LYS 42.A O no hydrogen 2.979 N/A LEU 69.A N ARG 72.A O no hydrogen 2.731 N/A SER 70.A OG GLU 272.A O no hydrogen 2.736 N/A ARG 72.A N LEU 69.A O no hydrogen 2.895 N/A ARG 72.A NE GLU 25.A OE2 no hydrogen 3.173 N/A ARG 72.A NH1 LEU 278.A O no hydrogen 2.959 N/A ARG 72.A NH1 PRO 279.A O no hydrogen 3.499 N/A ARG 72.A NH2 GLU 25.A OE2 no hydrogen 3.040 N/A ARG 72.A NH2 PRO 279.A O no hydrogen 3.070 N/A LYS 73.A N GLU 25.A OE1 no hydrogen 3.360 N/A VAL 74.A N GLY 67.A O no hydrogen 3.005 N/A VAL 75.A N ILE 26.A O no hydrogen 2.838 N/A VAL 76.A N ILE 65.A O no hydrogen 2.780 N/A MET 77.A N ILE 28.A O no hydrogen 2.710 N/A GLN 78.A N ASN 63.A O no hydrogen 2.776 N/A GLN 78.A NE2 GLY 35.A O no hydrogen 3.247 N/A ARG 80.A NE GLU 220.A OE1 no hydrogen 3.126 N/A ARG 80.A NE GLU 220.A OE2 no hydrogen 3.359 N/A ARG 80.A NH1 SER 110.A O no hydrogen 2.947 N/A ARG 80.A NH2 GLU 220.A OE2 no hydrogen 2.893 N/A GLU 85.A N HIS 82.A O no hydrogen 2.990 N/A GLY 86.A N MET 83.A O no hydrogen 2.858 N/A SER 88.A OG THR 91.A OG1 no hydrogen 3.029 N/A THR 91.A N SER 88.A OG no hydrogen 3.074 N/A THR 91.A OG1 SER 1.A OG no hydrogen 2.983 N/A THR 91.A OG1 SER 88.A OG no hydrogen 3.029 N/A VAL 92.A N SER 88.A O no hydrogen 3.169 N/A ALA 93.A N ASN 89.A O no hydrogen 2.912 N/A LEU 94.A N ASP 90.A O no hydrogen 2.973 N/A ILE 96.A N ALA 93.A O no hydrogen 3.161 N/A ARG 97.A N ALA 93.A O no hydrogen 3.163 N/A ARG 97.A NH1 ALA 4.A O no hydrogen 2.957 N/A ARG 97.A NH2 HIS 226.A ND1 no hydrogen 3.385 N/A VAL 98.A N LEU 94.A O no hydrogen 2.836 N/A MET 99.A N PRO 95.A O no hydrogen 2.974 N/A LYS 100.A N ILE 96.A O no hydrogen 3.134 N/A LYS 100.A NZ CYS 227.A O no hydrogen 2.955 N/A LEU 101.A N ARG 97.A O no hydrogen 3.096 N/A LEU 102.A N VAL 98.A O no hydrogen 2.831 N/A GLY 103.A N LYS 100.A O no hydrogen 3.206 N/A VAL 104.A N MET 99.A O no hydrogen 2.982 N/A LYS 105.A N GLU 25.A O no hydrogen 2.701 N/A ILE 106.A N GLU 25.A O no hydrogen 3.185 N/A LEU 107.A N GLN 230.A O no hydrogen 2.721 N/A MET 108.A N GLY 27.A O no hydrogen 2.808 N/A VAL 109.A N PHE 232.A O no hydrogen 2.719 N/A SER 110.A N ILE 29.A O no hydrogen 3.099 N/A ASN 111.A N VAL 234.A O no hydrogen 3.048 N/A ASN 111.A ND2 THR 217.A OG1 no hydrogen 2.827 N/A ALA 113.A N LEU 236.A O no hydrogen 2.912 N/A GLY 114.A N VAL 213.A O no hydrogen 2.814 N/A GLY 115.A N ASN 239.A O no hydrogen 2.825 N/A LEU 116.A N ASP 211.A O no hydrogen 2.814 N/A ASN 117.A N ASP 211.A O no hydrogen 3.120 N/A ASN 117.A ND2 ASP 211.A OD1 no hydrogen 2.982 N/A ARG 118.A NE LEU 116.A O no hydrogen 2.856 N/A ARG 118.A NH1 SER 241.A O no hydrogen 3.354 N/A ARG 118.A NH2 GLY 115.A O no hydrogen 3.102 N/A ARG 118.A NH2 LEU 116.A O no hydrogen 3.126 N/A ARG 118.A NH2 SER 241.A O no hydrogen 2.947 N/A SER 119.A N ASN 117.A OD1 no hydrogen 2.707 N/A SER 119.A OG ASN 117.A OD1 no hydrogen 2.748 N/A LEU 120.A N ASN 117.A O no hydrogen 3.135 N/A LYS 121.A N ASP 124.A OD2 no hydrogen 2.745 N/A GLY 123.A N VAL 237.A O no hydrogen 2.791 N/A ASP 124.A N LYS 121.A O no hydrogen 3.045 N/A PHE 125.A N LEU 182.A O no hydrogen 2.840 N/A VAL 126.A N SER 235.A O no hydrogen 2.856 N/A ILE 127.A N HIS 184.A O no hydrogen 2.835 N/A LEU 128.A N ALA 233.A O no hydrogen 2.853 N/A LYS 129.A N GLY 186.A O no hydrogen 2.866 N/A HIS 131.A N ASP 130.A OD1 no hydrogen 2.989 N/A HIS 131.A ND1 TYR 162.A OH no hydrogen 2.280 N/A ILE 132.A N TYR 188.A O no hydrogen 2.845 N/A LEU 137.A N TYR 133.A O no hydrogen 2.910 N/A GLY 138.A N LEU 134.A O no hydrogen 3.129 N/A GLY 138.A N PRO 135.A O no hydrogen 3.061 N/A LEU 139.A N GLY 136.A O no hydrogen 3.370 N/A ASN 140.A N PRO 135.A O no hydrogen 2.700 N/A ILE 142.A N TYR 133.A OH no hydrogen 2.980 N/A LEU 143.A N ASN 141.A OD1 no hydrogen 2.793 N/A VAL 144.A N ASN 141.A O no hydrogen 3.124 N/A ASN 147.A ND2 GLY 152.A O no hydrogen 2.808 N/A PHE 151.A N GLN 148.A O no hydrogen 2.919 N/A GLY 152.A N GLN 148.A O no hydrogen 3.370 N/A ARG 154.A NE ARG 154.A O no hydrogen 2.833 N/A ARG 154.A NH1 GLY 145.A O no hydrogen 2.778 N/A ARG 154.A NH2 LEU 143.A O no hydrogen 3.064 N/A ARG 154.A NH2 GLY 145.A O no hydrogen 3.074 N/A TYR 162.A OH HIS 131.A ND1 no hydrogen 2.280 N/A ASP 163.A N VAL 231.A O no hydrogen 3.292 N/A ARG 164.A N ASN 160.A OD1 no hydrogen 2.932 N/A LEU 166.A N ASP 163.A OD2 no hydrogen 3.063 N/A ARG 167.A N ASP 163.A O no hydrogen 3.117 N/A ARG 167.A NH1 TYR 162.A O no hydrogen 3.395 N/A LYS 168.A N ARG 164.A O no hydrogen 3.002 N/A LEU 169.A N ASP 165.A O no hydrogen 3.060 N/A ALA 170.A N LEU 166.A O no hydrogen 2.939 N/A VAL 171.A N ARG 167.A O no hydrogen 3.017 N/A GLN 172.A N LYS 168.A O no hydrogen 3.023 N/A VAL 173.A N LEU 169.A O no hydrogen 2.863 N/A ALA 174.A N ALA 170.A O no hydrogen 3.080 N/A GLU 175.A N VAL 171.A O no hydrogen 2.893 N/A GLU 176.A N GLN 172.A O no hydrogen 2.978 N/A ASN 177.A N VAL 173.A O no hydrogen 3.193 N/A ASN 177.A N ALA 174.A O no hydrogen 3.184 N/A GLY 178.A N GLU 175.A O no hydrogen 3.262 N/A PHE 179.A N ALA 174.A O no hydrogen 3.032 N/A LEU 182.A N PHE 179.A O no hydrogen 3.047 N/A VAL 183.A N GLY 180.A O no hydrogen 3.099 N/A HIS 184.A N PHE 125.A O no hydrogen 2.813 N/A HIS 184.A NE2 ASP 124.A OD2 no hydrogen 2.940 N/A GLY 186.A N ILE 127.A O no hydrogen 2.934 N/A VAL 187.A N ASP 211.A OD2 no hydrogen 2.867 N/A TYR 188.A N ASP 130.A O no hydrogen 3.068 N/A TYR 188.A OH SER 216.A O no hydrogen 2.983 N/A VAL 189.A N VAL 212.A O no hydrogen 2.857 N/A MET 190.A N ILE 132.A O no hydrogen 3.073 N/A ASN 191.A N GLY 214.A O no hydrogen 2.934 N/A ASN 191.A ND2 CYS 195.A O no hydrogen 3.120 N/A ASN 191.A ND2 GLU 197.A OE2 no hydrogen 2.958 N/A GLY 193.A N ASN 191.A OD1 no hydrogen 2.928 N/A THR 198.A N GLU 201.A OE1 no hydrogen 2.944 N/A GLU 201.A N THR 198.A OG1 no hydrogen 3.024 N/A CYS 202.A N THR 198.A O no hydrogen 2.869 N/A CYS 202.A SG GLU 197.A O no hydrogen 3.998 N/A CYS 202.A SG THR 198.A O no hydrogen 3.354 N/A THR 203.A N PRO 199.A O no hydrogen 2.936 N/A THR 203.A OG1 PRO 199.A O no hydrogen 2.843 N/A MET 204.A N ALA 200.A O no hydrogen 3.027 N/A LEU 205.A N GLU 201.A O no hydrogen 2.812 N/A LEU 206.A N CYS 202.A O no hydrogen 2.860 N/A ASN 207.A N THR 203.A O no hydrogen 3.025 N/A MET 208.A N MET 204.A O no hydrogen 3.045 N/A MET 208.A N LEU 205.A O no hydrogen 3.156 N/A GLY 209.A N LEU 206.A O no hydrogen 2.944 N/A CYS 210.A N LEU 205.A O no hydrogen 3.246 N/A CYS 210.A SG LEU 205.A O no hydrogen 3.312 N/A ASP 211.A N VAL 187.A O no hydrogen 2.831 N/A VAL 212.A N VAL 187.A O no hydrogen 3.124 N/A VAL 213.A N GLY 114.A O no hydrogen 2.983 N/A GLY 214.A N VAL 189.A O no hydrogen 3.225 N/A SER 216.A N TYR 188.A OH no hydrogen 3.116 N/A SER 216.A OG THR 217.A OG1 no hydrogen 2.842 N/A THR 217.A OG1 SER 216.A OG no hydrogen 2.842 N/A ILE 218.A N SER 216.A O no hydrogen 2.847 N/A VAL 221.A N THR 217.A O no hydrogen 3.024 N/A VAL 222.A N ILE 218.A O no hydrogen 2.957 N/A ILE 223.A N PRO 219.A O no hydrogen 3.181 N/A ALA 224.A N GLU 220.A O no hydrogen 2.973 N/A ARG 225.A N VAL 221.A O no hydrogen 2.928 N/A ARG 225.A NH1 ILE 229.A O no hydrogen 2.855 N/A HIS 226.A N VAL 222.A O no hydrogen 2.923 N/A HIS 226.A NE2 ASN 147.A OD1 no hydrogen 2.904 N/A HIS 226.A NE2 THR 153.A O no hydrogen 2.786 N/A CYS 227.A N ILE 223.A O no hydrogen 3.196 N/A CYS 227.A SG ILE 223.A O no hydrogen 3.426 N/A CYS 227.A SG ALA 224.A O no hydrogen 3.755 N/A GLY 228.A N ARG 225.A O no hydrogen 3.064 N/A ILE 229.A N ALA 224.A O no hydrogen 2.908 N/A GLN 230.A N LYS 105.A O no hydrogen 2.983 N/A PHE 232.A N LEU 107.A O no hydrogen 2.806 N/A VAL 234.A N VAL 109.A O no hydrogen 2.898 N/A SER 235.A N VAL 126.A O no hydrogen 2.872 N/A SER 235.A OG ASN 111.A OD1 no hydrogen 2.766 N/A LEU 236.A N ASN 111.A O no hydrogen 2.828 N/A VAL 237.A N ASP 124.A O no hydrogen 2.901 N/A THR 238.A N ALA 113.A O no hydrogen 3.041 N/A THR 238.A OG1 ALA 113.A O no hydrogen 3.227 N/A SER 241.A N GLY 115.A O no hydrogen 2.870 N/A SER 241.A OG GLY 115.A O no hydrogen 2.926 N/A GLU 246.A N ASP 244.A OD2 no hydrogen 3.257 N/A SER 247.A N ASP 244.A O no hydrogen 3.322 N/A LEU 249.A N SER 247.A OG no hydrogen 3.248 N/A ASN 252.A ND2 LYS 250.A O no hydrogen 3.215 N/A ASN 252.A ND2 GLU 255.A OE1 no hydrogen 2.245 N/A VAL 256.A N ASN 252.A O no hydrogen 3.359 N/A LEU 257.A N HIS 253.A O no hydrogen 2.911 N/A ALA 258.A N GLU 254.A O no hydrogen 2.861 N/A THR 259.A N GLU 255.A O no hydrogen 2.993 N/A THR 259.A OG1 GLU 255.A O no hydrogen 3.123 N/A GLY 260.A N VAL 256.A O no hydrogen 2.977 N/A ALA 261.A N LEU 257.A O no hydrogen 2.947 N/A GLN 262.A N ALA 258.A O no hydrogen 3.076 N/A ARG 263.A N THR 259.A O no hydrogen 3.073 N/A ARG 263.A N GLY 260.A O no hydrogen 3.232 N/A ARG 263.A NE GLY 123.A O no hydrogen 2.783 N/A ARG 263.A NH2 GLY 123.A O no hydrogen 3.321 N/A MET 267.A N ARG 263.A O no hydrogen 2.876 N/A GLN 268.A N ALA 264.A O no hydrogen 2.826 N/A SER 269.A N GLU 265.A O no hydrogen 3.017 N/A TRP 270.A N LEU 266.A O no hydrogen 2.939 N/A TRP 270.A NE1 ALA 170.A O no hydrogen 2.965 N/A PHE 271.A N MET 267.A O no hydrogen 2.879 N/A GLU 272.A N GLN 268.A O no hydrogen 2.984 N/A LYS 273.A N SER 269.A O no hydrogen 2.992 N/A ILE 274.A N TRP 270.A O no hydrogen 2.937 N/A ILE 275.A N PHE 271.A O no hydrogen 2.871 N/A GLU 276.A N GLU 272.A O no hydrogen 3.075 N/A LYS 277.A N ILE 274.A O no hydrogen 2.976 N/A LYS 277.A NZ GLU 176.A OE1 no hydrogen 3.402 N/A LEU 278.A N ILE 275.A O no hydrogen 3.234 N/A