Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2irw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A NH1 GLU 5.A OE1 no hydrogen 3.098 N/A MET 6.A N ARG 3.A O no hydrogen 2.942 N/A LEU 7.A N PRO 4.A O no hydrogen 3.228 N/A GLN 8.A N GLU 5.A O no hydrogen 2.834 N/A GLY 9.A N GLY 33.A O no hydrogen 2.973 N/A LYS 10.A N LEU 7.A O no hydrogen 3.029 N/A LYS 11.A N ASP 89.A OD2 no hydrogen 2.980 N/A LYS 11.A NZ MET 85.A O no hydrogen 3.427 N/A LYS 11.A NZ GLY 86.A O no hydrogen 3.066 N/A VAL 12.A N HIS 35.A O no hydrogen 2.845 N/A ILE 13.A N MET 90.A O no hydrogen 2.935 N/A VAL 14.A N VAL 37.A O no hydrogen 3.016 N/A THR 15.A N ILE 92.A O no hydrogen 3.194 N/A THR 15.A OG1 ILE 92.A O no hydrogen 3.515 N/A ALA 17.A N THR 39.A O no hydrogen 3.070 N/A ARG 23.A N LYS 19.A O no hydrogen 3.379 N/A GLU 24.A N GLY 20.A O no hydrogen 3.193 N/A MET 25.A N ILE 21.A O no hydrogen 3.116 N/A ALA 26.A N GLY 22.A O no hydrogen 3.122 N/A TYR 27.A N ARG 23.A O no hydrogen 3.112 N/A HIS 28.A N GLU 24.A O no hydrogen 2.996 N/A HIS 28.A NE2 GLU 214.A O no hydrogen 2.853 N/A LEU 29.A N MET 25.A O no hydrogen 2.983 N/A ALA 30.A N ALA 26.A O no hydrogen 2.969 N/A LYS 31.A N TYR 27.A O no hydrogen 2.988 N/A MET 32.A N HIS 28.A O no hydrogen 3.045 N/A GLY 33.A N ALA 30.A O no hydrogen 3.129 N/A ALA 34.A N LEU 29.A O no hydrogen 3.159 N/A HIS 35.A N LYS 10.A O no hydrogen 2.630 N/A HIS 35.A ND1 SER 60.A OG no hydrogen 2.638 N/A VAL 36.A N SER 60.A O no hydrogen 3.061 N/A VAL 37.A N VAL 12.A O no hydrogen 2.968 N/A VAL 38.A N HIS 62.A O no hydrogen 2.941 N/A THR 39.A N VAL 14.A O no hydrogen 3.197 N/A THR 39.A OG1 ILE 64.A O no hydrogen 2.857 N/A ARG 41.A NH1 ASN 98.A OD1 no hydrogen 3.232 N/A SER 42.A OG THR 45.A OG1 no hydrogen 2.914 N/A THR 45.A OG1 SER 42.A O no hydrogen 3.538 N/A THR 45.A OG1 SER 42.A OG no hydrogen 2.914 N/A LEU 46.A N SER 42.A O no hydrogen 3.187 N/A GLN 47.A N LYS 43.A O no hydrogen 2.993 N/A GLN 47.A NE2 TYR 63.A OH no hydrogen 3.103 N/A LYS 48.A N GLU 44.A O no hydrogen 3.318 N/A VAL 49.A N THR 45.A O no hydrogen 3.195 N/A VAL 50.A N LEU 46.A O no hydrogen 3.025 N/A SER 51.A N GLN 47.A O no hydrogen 3.026 N/A SER 51.A OG GLN 47.A O no hydrogen 3.184 N/A HIS 52.A N LYS 48.A O no hydrogen 3.215 N/A CYS 53.A N VAL 49.A O no hydrogen 2.993 N/A CYS 53.A SG ALA 26.A O no hydrogen 3.454 N/A CYS 53.A SG VAL 49.A O no hydrogen 3.199 N/A LEU 54.A N VAL 50.A O no hydrogen 2.937 N/A GLU 55.A N SER 51.A O no hydrogen 2.969 N/A LEU 56.A N HIS 52.A O no hydrogen 2.865 N/A GLY 57.A N LEU 54.A O no hydrogen 3.184 N/A ALA 58.A N CYS 53.A O no hydrogen 3.171 N/A ALA 59.A N ALA 34.A O no hydrogen 2.978 N/A SER 60.A OG HIS 35.A ND1 no hydrogen 2.638 N/A HIS 62.A N VAL 36.A O no hydrogen 3.058 N/A ILE 64.A N VAL 38.A O no hydrogen 3.148 N/A GLY 66.A N ALA 40.A O no hydrogen 2.941 N/A THR 67.A OG1 GLU 69.A OE1 no hydrogen 3.001 N/A GLU 69.A N THR 67.A OG1 no hydrogen 3.105 N/A ASP 70.A N THR 67.A O no hydrogen 3.310 N/A THR 72.A N ASP 70.A OD1 no hydrogen 3.123 N/A THR 72.A OG1 ASP 70.A OD1 no hydrogen 3.546 N/A PHE 73.A N ASP 70.A OD1 no hydrogen 3.220 N/A ALA 74.A N ASP 70.A O no hydrogen 3.194 N/A GLU 75.A N MET 71.A O no hydrogen 3.329 N/A GLN 76.A N THR 72.A O no hydrogen 3.001 N/A PHE 77.A N PHE 73.A O no hydrogen 2.747 N/A GLN 80.A N GLN 76.A O no hydrogen 3.015 N/A ALA 81.A N PHE 77.A O no hydrogen 2.896 N/A GLY 82.A N VAL 78.A O no hydrogen 2.911 N/A LYS 83.A N ALA 79.A O no hydrogen 3.011 N/A LEU 84.A N GLN 80.A O no hydrogen 2.971 N/A MET 85.A N ALA 81.A O no hydrogen 3.092 N/A GLY 86.A N LYS 83.A O no hydrogen 3.362 N/A GLY 87.A N GLY 82.A O no hydrogen 2.922 N/A ASP 89.A N LYS 11.A O no hydrogen 2.726 N/A MET 90.A N LYS 11.A O no hydrogen 3.105 N/A LEU 91.A N SER 139.A O no hydrogen 3.003 N/A ILE 92.A N ILE 13.A O no hydrogen 2.772 N/A LEU 93.A N VAL 141.A O no hydrogen 2.684 N/A ASN 94.A N THR 15.A OG1 no hydrogen 2.781 N/A HIS 95.A N THR 15.A OG1 no hydrogen 3.197 N/A THR 97.A N ASN 118.A OD1 no hydrogen 2.933 N/A ASN 102.A N MET 154.A O no hydrogen 3.129 N/A ILE 108.A N ASP 106.A O no hydrogen 2.852 N/A HIS 110.A N ASP 107.A O no hydrogen 3.184 N/A HIS 110.A N ASP 107.A OD1 no hydrogen 3.241 N/A VAL 111.A N ASP 107.A O no hydrogen 3.386 N/A ARG 112.A N ILE 108.A O no hydrogen 2.938 N/A LYS 113.A N HIS 109.A O no hydrogen 3.150 N/A SER 114.A N HIS 110.A O no hydrogen 2.846 N/A SER 114.A OG HIS 110.A O no hydrogen 2.808 N/A MET 115.A N VAL 111.A O no hydrogen 3.198 N/A GLU 116.A N ARG 112.A O no hydrogen 2.889 N/A VAL 117.A N LYS 113.A O no hydrogen 2.841 N/A ASN 118.A N SER 114.A O no hydrogen 2.773 N/A ASN 118.A ND2 SER 161.A OG no hydrogen 3.156 N/A PHE 119.A N MET 115.A O no hydrogen 3.166 N/A LEU 120.A N MET 115.A O no hydrogen 2.695 N/A SER 121.A N GLU 116.A O no hydrogen 3.145 N/A SER 121.A OG VAL 117.A O no hydrogen 2.518 N/A TYR 122.A OH HIS 95.A O no hydrogen 2.721 N/A VAL 123.A N PHE 119.A O no hydrogen 3.289 N/A VAL 124.A N LEU 120.A O no hydrogen 3.029 N/A LEU 125.A N SER 121.A O no hydrogen 2.861 N/A THR 126.A N TYR 122.A O no hydrogen 3.076 N/A THR 126.A OG1 TYR 122.A O no hydrogen 2.733 N/A VAL 127.A N VAL 123.A O no hydrogen 2.867 N/A ALA 128.A N VAL 124.A O no hydrogen 3.150 N/A ALA 129.A N LEU 125.A O no hydrogen 3.022 N/A LEU 133.A N ALA 129.A O no hydrogen 3.008 N/A LYS 134.A N LEU 130.A O no hydrogen 2.747 N/A GLN 135.A N PRO 131.A O no hydrogen 3.201 N/A SER 136.A N MET 132.A O no hydrogen 3.231 N/A SER 136.A OG LEU 88.A O no hydrogen 2.621 N/A SER 136.A OG MET 132.A O no hydrogen 3.185 N/A ASN 137.A N LYS 134.A O no hydrogen 3.371 N/A GLY 138.A N LEU 133.A O no hydrogen 2.855 N/A SER 139.A N ASP 89.A O no hydrogen 3.062 N/A SER 139.A OG SER 184.A OG no hydrogen 3.080 N/A SER 139.A OG GLY 224.A O no hydrogen 3.515 N/A ILE 140.A N SER 184.A O no hydrogen 2.772 N/A VAL 141.A N LEU 91.A O no hydrogen 2.864 N/A VAL 142.A N THR 186.A O no hydrogen 2.745 N/A VAL 143.A N LEU 93.A O no hydrogen 2.909 N/A SER 144.A N CYS 188.A O no hydrogen 2.702 N/A LEU 146.A N LEU 190.A O no hydrogen 2.819 N/A ALA 147.A N SER 145.A OG no hydrogen 2.884 N/A GLY 148.A N SER 145.A O no hydrogen 2.800 N/A LYS 149.A N LEU 146.A O no hydrogen 3.012 N/A LYS 149.A NZ ASP 166.A OD2 no hydrogen 2.725 N/A LYS 149.A NZ GLU 230.A OE1 no hydrogen 2.999 N/A VAL 150.A N LEU 146.A O no hydrogen 2.971 N/A SER 159.A N VAL 155.A O no hydrogen 2.674 N/A SER 159.A OG ALA 147.A O no hydrogen 2.640 N/A ALA 160.A N ALA 156.A O no hydrogen 2.950 N/A SER 161.A N ALA 157.A O no hydrogen 3.213 N/A SER 161.A OG TYR 158.A O no hydrogen 2.683 N/A LYS 162.A N TYR 158.A O no hydrogen 3.010 N/A LYS 162.A NZ VAL 143.A O no hydrogen 2.832 N/A PHE 163.A N SER 159.A O no hydrogen 2.811 N/A ALA 164.A N ALA 160.A O no hydrogen 2.926 N/A LEU 165.A N SER 161.A O no hydrogen 3.263 N/A GLY 167.A N PHE 163.A O no hydrogen 3.100 N/A PHE 168.A N ALA 164.A O no hydrogen 2.910 N/A PHE 169.A N LEU 165.A O no hydrogen 2.860 N/A SER 170.A N ASP 166.A O no hydrogen 2.852 N/A SER 170.A OG ASP 166.A O no hydrogen 2.676 N/A SER 170.A OG ASP 166.A OD1 no hydrogen 2.585 N/A SER 171.A N GLY 167.A O no hydrogen 3.278 N/A SER 171.A N PHE 168.A O no hydrogen 3.096 N/A ILE 172.A N PHE 168.A O no hydrogen 2.964 N/A ARG 173.A N PHE 169.A O no hydrogen 3.133 N/A ARG 173.A NE ILE 185.A O no hydrogen 3.384 N/A ARG 173.A NH2 ILE 185.A O no hydrogen 2.969 N/A LYS 174.A NZ GLU 252.A OE2 no hydrogen 2.896 N/A GLU 175.A N SER 171.A O no hydrogen 3.270 N/A TYR 176.A N ILE 172.A O no hydrogen 2.849 N/A SER 177.A N ARG 173.A O no hydrogen 2.946 N/A VAL 178.A N LYS 174.A O no hydrogen 3.413 N/A SER 179.A N GLU 175.A O no hydrogen 2.929 N/A SER 179.A OG GLU 175.A O no hydrogen 2.788 N/A VAL 181.A N TYR 176.A O no hydrogen 2.950 N/A SER 184.A N GLY 138.A O no hydrogen 3.262 N/A SER 184.A OG SER 139.A OG no hydrogen 3.080 N/A THR 186.A N ILE 140.A O no hydrogen 2.792 N/A THR 186.A OG1 GLN 228.A O no hydrogen 2.719 N/A LEU 187.A N GLU 229.A O no hydrogen 2.839 N/A CYS 188.A N VAL 142.A O no hydrogen 2.895 N/A CYS 188.A SG VAL 142.A O no hydrogen 3.799 N/A VAL 189.A N VAL 231.A O no hydrogen 2.655 N/A LEU 190.A N SER 144.A O no hydrogen 3.435 N/A GLY 191.A N TYR 233.A O no hydrogen 2.873 N/A ASP 194.A N ALA 211.A O no hydrogen 2.846 N/A THR 195.A N ILE 193.A O no hydrogen 2.797 N/A ALA 198.A N THR 195.A OG1 no hydrogen 3.262 N/A MET 199.A N THR 195.A O no hydrogen 3.023 N/A LYS 200.A N GLU 196.A O no hydrogen 2.954 N/A ALA 201.A N THR 197.A O no hydrogen 3.242 N/A VAL 202.A N ALA 198.A O no hydrogen 2.971 N/A SER 203.A N LYS 200.A O no hydrogen 3.396 N/A ILE 205.A N VAL 202.A O no hydrogen 3.039 N/A VAL 206.A N VAL 202.A O no hydrogen 2.867 N/A ALA 211.A N LEU 192.A O no hydrogen 2.861 N/A LYS 213.A N ASP 194.A OD2 no hydrogen 2.728 N/A CYS 216.A N PRO 212.A O no hydrogen 3.229 N/A ALA 217.A N LYS 213.A O no hydrogen 3.187 N/A LEU 218.A N GLU 214.A O no hydrogen 3.398 N/A GLU 219.A N GLU 215.A O no hydrogen 2.967 N/A ILE 220.A N CYS 216.A O no hydrogen 3.146 N/A ILE 221.A N ALA 217.A O no hydrogen 3.187 N/A LYS 222.A N LEU 218.A O no hydrogen 2.712 N/A LYS 222.A NZ GLU 219.A OE1 no hydrogen 3.356 N/A GLY 223.A N GLU 219.A O no hydrogen 3.089 N/A GLY 224.A N ILE 220.A O no hydrogen 3.072 N/A ALA 225.A N ILE 221.A O no hydrogen 3.116 N/A LEU 226.A N LYS 222.A O no hydrogen 3.058 N/A ARG 227.A N GLY 224.A O no hydrogen 2.976 N/A ARG 227.A NH1 ASN 137.A O no hydrogen 2.945 N/A ARG 227.A NH1 GLY 138.A O no hydrogen 3.246 N/A ARG 227.A NH2 ASN 137.A O no hydrogen 3.239 N/A ARG 227.A NH2 GLY 138.A O no hydrogen 3.054 N/A GLN 228.A N GLY 223.A O no hydrogen 2.892 N/A VAL 231.A N LEU 187.A O no hydrogen 3.085 N/A TYR 233.A N VAL 189.A O no hydrogen 3.003 N/A TYR 233.A OH GLU 215.A OE2 no hydrogen 2.323 N/A SER 235.A OG GLN 209.A O no hydrogen 3.269 N/A THR 239.A N SER 236.A OG no hydrogen 3.275 N/A THR 239.A OG1 ASP 234.A OD1 no hydrogen 2.860 N/A THR 240.A OG1 LEU 237.A O no hydrogen 2.816 N/A LEU 241.A N LEU 237.A O no hydrogen 2.769 N/A ILE 243.A N THR 239.A O no hydrogen 2.820 N/A ARG 244.A NE THR 240.A O no hydrogen 3.293 N/A ARG 244.A NH1 THR 240.A O no hydrogen 3.085 N/A ARG 248.A NE GLU 252.A OE1 no hydrogen 2.841 N/A ARG 248.A NH1 ASP 166.A OD2 no hydrogen 3.096 N/A ARG 248.A NH2 ASP 166.A OD1 no hydrogen 2.783 N/A ILE 250.A N PRO 246.A O no hydrogen 2.990 N/A LEU 251.A N SER 247.A O no hydrogen 2.860 N/A GLU 252.A N ARG 248.A O no hydrogen 2.825 N/A PHE 253.A N LYS 249.A O no hydrogen 3.237 N/A PHE 253.A N ILE 250.A O no hydrogen 2.955 N/A LEU 254.A N ILE 250.A O no hydrogen 2.871 N/A TYR 255.A N LEU 251.A O no hydrogen 2.975 N/A SER 256.A N PHE 253.A O no hydrogen 2.750 N/A SER 256.A OG PHE 253.A O no hydrogen 2.600 N/A SER 258.A OG THR 257.A O no hydrogen 2.985 N/A ASN 260.A ND2 ASP 262.A OD2 no hydrogen 3.197 N/A PHE 264.A N MET 261.A O no hydrogen 2.680 N/A