Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3uic_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 2.A N GLU 30.A OE1 no hydrogen 3.068 N/A LEU 3.A N GLU 30.A O no hydrogen 2.853 N/A ALA 4.A N GLY 1.A O no hydrogen 3.361 N/A GLY 5.A N GLY 31.A O no hydrogen 3.317 N/A LYS 6.A N LEU 3.A O no hydrogen 2.963 N/A LYS 6.A NZ ASP 234.A OD1 no hydrogen 2.864 N/A LYS 7.A N ASP 84.A OD2 no hydrogen 2.710 N/A ILE 8.A N GLU 33.A O no hydrogen 2.882 N/A LEU 9.A N ALA 85.A O no hydrogen 2.843 N/A ILE 10.A N ALA 35.A O no hydrogen 2.657 N/A THR 11.A N VAL 87.A O no hydrogen 2.960 N/A THR 11.A OG1 VAL 87.A O no hydrogen 2.811 N/A LEU 14.A N SER 18.A OG no hydrogen 3.017 N/A SER 15.A N SER 18.A OG no hydrogen 2.813 N/A LYS 17.A N SER 15.A OG no hydrogen 2.792 N/A SER 18.A N SER 15.A O no hydrogen 3.243 N/A SER 18.A OG SER 15.A O no hydrogen 3.292 N/A TYR 21.A N SER 18.A O no hydrogen 3.075 N/A TYR 21.A OH GLU 52.A OE1 no hydrogen 3.229 N/A TYR 21.A OH GLU 52.A OE2 no hydrogen 3.055 N/A ILE 23.A N ILE 19.A O no hydrogen 2.902 N/A ALA 24.A N ALA 20.A O no hydrogen 2.778 N/A LYS 25.A N TYR 21.A O no hydrogen 2.744 N/A ALA 26.A N GLY 22.A O no hydrogen 3.083 N/A MET 27.A N ILE 23.A O no hydrogen 2.940 N/A HIS 28.A N ALA 24.A O no hydrogen 2.789 N/A ARG 29.A N LYS 25.A O no hydrogen 3.001 N/A ARG 29.A NE GLU 30.A OE2 no hydrogen 3.019 N/A ARG 29.A NH1 ASN 226.A OD1 no hydrogen 2.931 N/A ARG 29.A NH2 GLU 30.A OE2 no hydrogen 2.816 N/A ARG 29.A NH2 ASN 226.A OD1 no hydrogen 2.759 N/A GLU 30.A N ALA 26.A O no hydrogen 3.101 N/A GLU 30.A N MET 27.A O no hydrogen 3.058 N/A GLY 31.A N HIS 28.A O no hydrogen 2.876 N/A ALA 32.A N MET 27.A O no hydrogen 3.022 N/A GLU 33.A N LYS 6.A O no hydrogen 2.764 N/A ALA 35.A N ILE 8.A O no hydrogen 3.004 N/A PHE 36.A N ALA 57.A O no hydrogen 3.029 N/A THR 37.A N ILE 10.A O no hydrogen 3.231 N/A TYR 38.A N LEU 59.A O no hydrogen 3.067 N/A PHE 42.A N VAL 39.A O no hydrogen 2.931 N/A VAL 46.A N PHE 42.A O no hydrogen 3.043 N/A GLU 47.A N LYS 43.A O no hydrogen 3.121 N/A LYS 48.A N ASP 44.A O no hydrogen 3.128 N/A LEU 49.A N ARG 45.A O no hydrogen 3.059 N/A CYS 50.A N VAL 46.A O no hydrogen 2.902 N/A CYS 50.A SG VAL 46.A O no hydrogen 3.234 N/A ALA 51.A N LYS 48.A O no hydrogen 3.456 N/A PHE 53.A N CYS 50.A O no hydrogen 3.027 N/A ASN 54.A N ALA 51.A O no hydrogen 2.981 N/A ALA 56.A N LEU 34.A O no hydrogen 2.772 N/A LEU 59.A N PHE 36.A O no hydrogen 2.946 N/A CYS 61.A N TYR 38.A O no hydrogen 2.837 N/A ASP 62.A N GLU 68.A OE1 no hydrogen 2.760 N/A ILE 64.A N ASP 62.A OD1 no hydrogen 3.172 N/A SER 65.A N ASP 62.A O no hydrogen 2.925 N/A GLN 67.A NE2 ASP 71.A OD2 no hydrogen 3.284 N/A GLU 68.A N SER 65.A OG no hydrogen 2.972 N/A ILE 69.A N SER 65.A O no hydrogen 3.340 N/A LYS 70.A N ASP 66.A O no hydrogen 3.055 N/A ASP 71.A N GLN 67.A O no hydrogen 2.852 N/A LEU 72.A N GLU 68.A O no hydrogen 2.813 N/A LEU 72.A N ILE 69.A O no hydrogen 3.245 N/A PHE 73.A N ILE 69.A O no hydrogen 3.404 N/A VAL 74.A N LYS 70.A O no hydrogen 3.160 N/A GLU 75.A N ASP 71.A O no hydrogen 2.953 N/A LEU 76.A N LEU 72.A O no hydrogen 3.004 N/A GLY 77.A N PHE 73.A O no hydrogen 2.847 N/A LYS 78.A N GLU 75.A O no hydrogen 3.159 N/A LYS 78.A NZ GLU 75.A OE2 no hydrogen 3.214 N/A VAL 79.A N LEU 76.A O no hydrogen 2.899 N/A TRP 80.A N LEU 76.A O no hydrogen 2.866 N/A LEU 83.A N MET 132.A O no hydrogen 2.731 N/A ASP 84.A N LYS 7.A O no hydrogen 2.690 N/A ALA 85.A N LYS 7.A O no hydrogen 3.164 N/A ILE 86.A N SER 139.A O no hydrogen 2.922 N/A VAL 87.A N LEU 9.A O no hydrogen 2.889 N/A HIS 88.A N VAL 141.A O no hydrogen 2.791 N/A HIS 88.A NE2 SER 121.A OG no hydrogen 2.797 N/A SER 89.A N THR 11.A OG1 no hydrogen 3.132 N/A PHE 92.A N SER 118.A OG no hydrogen 3.149 N/A GLN 97.A N PRO 94.A O no hydrogen 2.838 N/A GLN 97.A NE2 ASP 96.A OD1 no hydrogen 2.988 N/A GLN 97.A NE2 CYS 105.A O no hydrogen 3.026 N/A LEU 98.A N ARG 95.A O no hydrogen 3.173 N/A ASP 104.A N ASN 101.A OD1 no hydrogen 2.982 N/A CYS 105.A N ASN 101.A O no hydrogen 3.067 N/A CYS 105.A SG GLU 99.A O no hydrogen 3.132 N/A CYS 105.A SG ASN 101.A O no hydrogen 3.452 N/A VAL 106.A N PHE 102.A O no hydrogen 2.817 N/A THR 107.A N GLN 97.A OE1 no hydrogen 3.356 N/A GLY 110.A N THR 107.A OG1 no hydrogen 3.034 N/A PHE 111.A N THR 107.A O no hydrogen 2.917 N/A SER 112.A N ARG 108.A O no hydrogen 3.041 N/A ILE 113.A N GLU 109.A O no hydrogen 2.940 N/A ALA 114.A N GLY 110.A O no hydrogen 2.986 N/A HIS 115.A N PHE 111.A O no hydrogen 3.112 N/A HIS 115.A ND1 PHE 111.A O no hydrogen 2.738 N/A ASP 116.A N SER 112.A O no hydrogen 2.760 N/A ILE 117.A N ILE 113.A O no hydrogen 3.036 N/A SER 118.A N ALA 114.A O no hydrogen 2.938 N/A SER 118.A OG PHE 92.A O no hydrogen 3.211 N/A SER 118.A OG ALA 114.A O no hydrogen 3.024 N/A ALA 119.A N HIS 115.A O no hydrogen 2.949 N/A TYR 120.A N HIS 115.A O no hydrogen 2.836 N/A SER 121.A N ASP 116.A O no hydrogen 3.136 N/A SER 121.A OG HIS 88.A NE2 no hydrogen 2.797 N/A SER 121.A OG ILE 117.A O no hydrogen 2.562 N/A PHE 122.A N ALA 119.A O no hydrogen 3.039 N/A ALA 124.A N TYR 120.A O no hydrogen 2.973 N/A LEU 125.A N SER 121.A O no hydrogen 2.962 N/A ALA 126.A N PHE 122.A O no hydrogen 3.036 N/A LYS 127.A N ALA 123.A O no hydrogen 2.914 N/A GLU 128.A N ALA 124.A O no hydrogen 3.045 N/A GLY 129.A N LEU 125.A O no hydrogen 2.897 N/A ARG 130.A NE ASP 179.A OD2 no hydrogen 2.966 N/A ARG 130.A NH1 ASP 179.A OD2 no hydrogen 3.105 N/A MET 133.A N ARG 130.A O no hydrogen 3.138 N/A LYS 134.A N ARG 130.A O no hydrogen 3.111 N/A ASN 135.A N ASP 179.A O no hydrogen 2.898 N/A ARG 136.A NH1 ASP 84.A OD1 no hydrogen 2.722 N/A SER 139.A N ASP 84.A O no hydrogen 2.788 N/A MET 140.A N LYS 182.A O no hydrogen 2.673 N/A VAL 141.A N ILE 86.A O no hydrogen 3.034 N/A ALA 142.A N ASN 184.A O no hydrogen 2.869 N/A LEU 143.A N HIS 88.A O no hydrogen 3.046 N/A THR 144.A N VAL 186.A O no hydrogen 2.859 N/A THR 144.A OG1 GLU 166.A OE2 no hydrogen 2.672 N/A TYR 145.A N THR 144.A OG1 no hydrogen 2.756 N/A ALA 148.A N TYR 145.A O no hydrogen 2.985 N/A GLU 149.A N ILE 146.A O no hydrogen 2.947 N/A LYS 150.A N ILE 146.A O no hydrogen 3.170 N/A TYR 155.A N PRO 153.A O no hydrogen 2.776 N/A ASN 156.A ND2 GLN 97.A O no hydrogen 3.651 N/A ASN 156.A ND2 GLU 99.A O no hydrogen 3.670 N/A ASN 156.A ND2 GLY 100.A O no hydrogen 3.160 N/A THR 157.A OG1 GLN 97.A OE1 no hydrogen 2.918 N/A MET 158.A N TYR 155.A O no hydrogen 3.004 N/A GLY 159.A N ASN 156.A O no hydrogen 2.896 N/A VAL 160.A N ASN 156.A O no hydrogen 3.296 N/A ALA 161.A N THR 157.A O no hydrogen 2.841 N/A LYS 162.A N MET 158.A O no hydrogen 2.703 N/A LYS 162.A NZ LEU 143.A O no hydrogen 2.893 N/A ALA 163.A N GLY 159.A O no hydrogen 2.931 N/A SER 164.A N VAL 160.A O no hydrogen 3.078 N/A LEU 165.A N ALA 161.A O no hydrogen 2.664 N/A GLU 166.A N LYS 162.A O no hydrogen 2.969 N/A ALA 167.A N ALA 163.A O no hydrogen 3.139 N/A THR 168.A N SER 164.A O no hydrogen 2.863 N/A THR 168.A OG1 SER 164.A O no hydrogen 2.826 N/A VAL 169.A N LEU 165.A O no hydrogen 2.768 N/A ARG 170.A N GLU 166.A O no hydrogen 3.115 N/A TYR 171.A N ALA 167.A O no hydrogen 2.957 N/A THR 172.A N THR 168.A O no hydrogen 2.731 N/A THR 172.A OG1 THR 168.A O no hydrogen 2.813 N/A ALA 173.A N VAL 169.A O no hydrogen 2.868 N/A LEU 174.A N ARG 170.A O no hydrogen 2.972 N/A ALA 175.A N TYR 171.A O no hydrogen 2.871 N/A LEU 176.A N THR 172.A O no hydrogen 2.786 N/A ASP 179.A N LEU 176.A O no hydrogen 3.051 N/A GLY 180.A N GLY 177.A O no hydrogen 2.880 N/A ILE 181.A N LEU 176.A O no hydrogen 3.339 N/A LYS 182.A N ALA 138.A O no hydrogen 2.878 N/A LYS 182.A NZ ALA 138.A O no hydrogen 3.551 N/A LYS 182.A NZ SER 139.A OG no hydrogen 2.576 N/A VAL 183.A N THR 240.A OG1 no hydrogen 2.827 N/A ASN 184.A N MET 140.A O no hydrogen 3.022 N/A ASN 184.A ND2 ILE 239.A O no hydrogen 3.110 N/A ALA 185.A N GLU 242.A O no hydrogen 2.821 N/A VAL 186.A N ALA 142.A O no hydrogen 2.939 N/A SER 187.A N VAL 244.A O no hydrogen 2.852 N/A ALA 188.A N THR 144.A O no hydrogen 3.205 N/A GLY 189.A N VAL 246.A O no hydrogen 3.003 N/A SER 197.A N LEU 194.A O no hydrogen 3.028 N/A SER 197.A OG LEU 194.A O no hydrogen 2.918 N/A GLY 198.A N ALA 195.A O no hydrogen 3.360 N/A ILE 199.A N ALA 196.A O no hydrogen 3.211 N/A LYS 204.A N ASN 201.A O no hydrogen 2.938 N/A MET 205.A N ASN 201.A O no hydrogen 3.402 N/A LEU 206.A N PHE 202.A O no hydrogen 2.900 N/A ASP 207.A N LYS 203.A O no hydrogen 2.928 N/A TYR 208.A N LYS 204.A O no hydrogen 2.737 N/A ASN 209.A N MET 205.A O no hydrogen 2.865 N/A ASN 209.A ND2 MET 205.A O no hydrogen 3.244 N/A ALA 210.A N LEU 206.A O no hydrogen 3.070 N/A MET 211.A N ASP 207.A O no hydrogen 3.132 N/A VAL 212.A N TYR 208.A O no hydrogen 2.900 N/A SER 213.A N ASN 209.A O no hydrogen 2.825 N/A SER 213.A OG ASN 209.A O no hydrogen 2.949 N/A LEU 215.A N ALA 248.A O no hydrogen 3.151 N/A LYS 216.A N SER 213.A O no hydrogen 2.976 N/A LYS 216.A NZ MET 211.A O no hydrogen 3.070 N/A LYS 216.A NZ SER 213.A O no hydrogen 3.215 N/A LYS 217.A NZ GLU 223.A OE2 no hydrogen 3.125 N/A ASN 218.A ND2 LEU 206.A O no hydrogen 2.762 N/A ASP 220.A N GLU 223.A OE1 no hydrogen 3.238 N/A GLU 223.A N ASP 220.A OD2 no hydrogen 2.951 N/A VAL 224.A N ASP 220.A O no hydrogen 3.210 N/A GLY 225.A N ILE 221.A O no hydrogen 2.725 N/A ASN 226.A N MET 222.A O no hydrogen 2.792 N/A THR 227.A N GLU 223.A O no hydrogen 3.330 N/A THR 227.A OG1 GLU 223.A O no hydrogen 2.861 N/A VAL 228.A N VAL 224.A O no hydrogen 2.883 N/A ALA 229.A N GLY 225.A O no hydrogen 2.838 N/A PHE 230.A N ASN 226.A O no hydrogen 2.956 N/A LEU 231.A N THR 227.A O no hydrogen 2.958 N/A CYS 232.A N VAL 228.A O no hydrogen 3.043 N/A CYS 232.A N ALA 229.A O no hydrogen 2.889 N/A CYS 232.A SG VAL 228.A O no hydrogen 3.680 N/A SER 233.A N PHE 230.A O no hydrogen 2.949 N/A SER 233.A OG PHE 230.A O no hydrogen 2.922 N/A MET 235.A N SER 233.A OG no hydrogen 3.144 N/A ALA 236.A N SER 233.A O no hydrogen 3.017 N/A THR 237.A N ASP 234.A O no hydrogen 3.497 N/A THR 237.A OG1 ASP 234.A O no hydrogen 3.257 N/A ILE 239.A N ALA 236.A O no hydrogen 2.888 N/A THR 240.A OG1 VAL 183.A O no hydrogen 3.344 N/A GLY 241.A N VAL 183.A O no hydrogen 2.592 N/A GLU 242.A N ASN 184.A OD1 no hydrogen 2.954 N/A VAL 243.A N GLU 242.A OE1 no hydrogen 2.951 N/A VAL 244.A N ALA 185.A O no hydrogen 2.771 N/A HIS 245.A NE2 GLU 149.A OE2 no hydrogen 2.724 N/A VAL 246.A N SER 187.A O no hydrogen 2.778 N/A GLY 249.A N ASP 247.A OD1 no hydrogen 2.854 N/A TYR 250.A N ASP 247.A O no hydrogen 3.252 N/A HIS 251.A N ASP 247.A OD2 no hydrogen 2.806 N/A CYS 252.A N GLY 249.A O no hydrogen 2.965 N/A CYS 252.A SG GLY 249.A O no hydrogen 3.280 N/A VAL 253.A N TYR 250.A O no hydrogen 3.319 N/A