Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1xo1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A N SER 34.A O no hydrogen 3.056 N/A ARG 1.A N SER 34.A OG no hydrogen 2.972 N/A ARG 2.A NH1 ASP 100.A OD2 no hydrogen 2.875 N/A ASN 3.A N SER 34.A O no hydrogen 3.002 N/A ASN 3.A ND2 TYR 33.A O no hydrogen 3.018 N/A LEU 4.A N HIS 101.A O no hydrogen 2.917 N/A MET 5.A N THR 37.A O no hydrogen 2.837 N/A ILE 6.A N TRP 103.A O no hydrogen 2.877 N/A VAL 7.A N ILE 39.A O no hydrogen 2.905 N/A ASP 8.A N ILE 105.A O no hydrogen 2.927 N/A GLY 9.A N LEU 41.A O no hydrogen 2.728 N/A THR 10.A OG1 ASP 43.A OD2 no hydrogen 3.265 N/A ASN 11.A ND2 THR 107.A OG1 no hydrogen 2.748 N/A LEU 12.A N ASP 8.A O no hydrogen 2.867 N/A GLY 13.A N GLY 9.A O no hydrogen 2.899 N/A PHE 14.A N THR 10.A O no hydrogen 3.147 N/A PHE 14.A N ASN 11.A O no hydrogen 3.203 N/A ARG 15.A N LEU 12.A O no hydrogen 3.085 N/A PHE 16.A N GLY 13.A O no hydrogen 3.073 N/A TYR 22.A N PHE 18.A O no hydrogen 2.787 N/A TYR 22.A OH GLY 9.A O no hydrogen 2.845 N/A VAL 23.A N ALA 19.A O no hydrogen 3.096 N/A SER 24.A N SER 20.A O no hydrogen 2.974 N/A SER 24.A OG SER 20.A O no hydrogen 2.970 N/A THR 25.A N SER 21.A O no hydrogen 2.957 N/A THR 25.A OG1 SER 21.A O no hydrogen 2.587 N/A ILE 26.A N TYR 22.A O no hydrogen 3.229 N/A GLN 27.A N VAL 23.A O no hydrogen 2.875 N/A SER 28.A N SER 24.A O no hydrogen 2.861 N/A LEU 29.A N THR 25.A O no hydrogen 2.924 N/A ALA 30.A N ILE 26.A O no hydrogen 2.852 N/A LYS 31.A N GLN 27.A O no hydrogen 3.166 N/A SER 32.A N SER 28.A O no hydrogen 3.100 N/A SER 32.A OG SER 28.A O no hydrogen 3.270 N/A SER 32.A OG LEU 29.A O no hydrogen 3.255 N/A TYR 33.A N LEU 29.A O no hydrogen 2.830 N/A TYR 33.A OH GLU 129.A OE2 no hydrogen 2.660 N/A SER 34.A N LYS 31.A O no hydrogen 3.185 N/A ALA 35.A N ALA 30.A O no hydrogen 2.843 N/A ARG 36.A N ASN 3.A O no hydrogen 2.984 N/A ARG 36.A NH2 LEU 98.A O no hydrogen 3.082 N/A THR 37.A OG1 TYR 99.A OH no hydrogen 2.695 N/A ILE 39.A N MET 5.A O no hydrogen 2.886 N/A VAL 40.A N PRO 75.A O no hydrogen 2.950 N/A LEU 41.A N VAL 7.A O no hydrogen 2.868 N/A GLY 42.A N PHE 77.A O no hydrogen 2.949 N/A ASP 43.A N THR 10.A OG1 no hydrogen 2.907 N/A LYS 44.A NZ THR 78.A OG1 no hydrogen 3.262 N/A VAL 48.A N GLY 81.A O no hydrogen 3.001 N/A ARG 50.A N SER 47.A OG no hydrogen 3.292 N/A ARG 50.A NE LEU 214.A O no hydrogen 2.959 N/A ARG 50.A NH1 ASP 86.A OD1 no hydrogen 3.476 N/A ARG 50.A NH1 ASP 86.A OD2 no hydrogen 2.697 N/A ARG 50.A NH2 ASP 86.A OD1 no hydrogen 2.902 N/A LEU 51.A N SER 47.A O no hydrogen 2.960 N/A GLU 52.A N VAL 48.A O no hydrogen 3.007 N/A HIS 53.A N ARG 50.A O no hydrogen 3.201 N/A LEU 54.A N ARG 50.A O no hydrogen 2.766 N/A GLU 56.A N GLU 56.A OE1 no hydrogen 2.708 N/A TYR 57.A N LEU 54.A O no hydrogen 2.936 N/A TYR 57.A OH GLU 83.A OE1 no hydrogen 3.183 N/A TYR 57.A OH GLU 83.A OE2 no hydrogen 2.663 N/A ALA 58.A N ASP 159.A O no hydrogen 2.817 N/A LEU 63.A N PHE 59.A O no hydrogen 2.715 N/A LYS 64.A N PHE 60.A O no hydrogen 3.248 N/A ASP 65.A N GLU 61.A O no hydrogen 2.943 N/A ALA 66.A N TYR 62.A O no hydrogen 2.857 N/A PHE 67.A N LEU 63.A O no hydrogen 2.965 N/A GLU 68.A N LYS 64.A O no hydrogen 2.953 N/A LEU 69.A N ASP 65.A O no hydrogen 2.903 N/A CYS 70.A N ALA 66.A O no hydrogen 2.853 N/A CYS 70.A SG THR 76.A OG1 no hydrogen 3.588 N/A LYS 71.A N PHE 67.A O no hydrogen 3.057 N/A LYS 71.A NZ GLU 68.A OE1 no hydrogen 3.186 N/A LYS 71.A NZ GLU 68.A OE2 no hydrogen 3.390 N/A THR 72.A N LEU 69.A O no hydrogen 3.212 N/A THR 72.A OG1 LEU 69.A O no hydrogen 2.636 N/A THR 73.A N CYS 70.A O no hydrogen 3.078 N/A PHE 74.A N CYS 70.A O no hydrogen 2.920 N/A THR 76.A OG1 PHE 74.A O no hydrogen 2.910 N/A PHE 77.A N VAL 40.A O no hydrogen 2.908 N/A GLY 81.A N LYS 44.A O no hydrogen 2.918 N/A VAL 82.A N ILE 79.A O no hydrogen 2.949 N/A ALA 84.A N ASP 43.A OD1 no hydrogen 2.985 N/A ASP 86.A N GLU 83.A O no hydrogen 3.042 N/A MET 87.A N GLU 83.A O no hydrogen 3.449 N/A ALA 88.A N ALA 84.A O no hydrogen 2.892 N/A ALA 89.A N ASP 85.A O no hydrogen 3.001 N/A TYR 90.A N ASP 86.A O no hydrogen 2.905 N/A TYR 90.A OH THR 237.A OG1 no hydrogen 2.669 N/A ILE 91.A N MET 87.A O no hydrogen 2.830 N/A VAL 92.A N ALA 88.A O no hydrogen 3.038 N/A LYS 93.A N ALA 89.A O no hydrogen 3.257 N/A LEU 94.A N TYR 90.A O no hydrogen 3.052 N/A ILE 95.A N ILE 91.A O no hydrogen 2.991 N/A GLY 96.A N VAL 92.A O no hydrogen 2.874 N/A LEU 98.A N ILE 95.A O no hydrogen 3.109 N/A TYR 99.A N GLY 96.A O no hydrogen 3.233 N/A TYR 99.A OH THR 37.A OG1 no hydrogen 2.695 N/A ASP 100.A N ARG 2.A O no hydrogen 2.962 N/A HIS 101.A NE2 SER 120.A OG no hydrogen 2.702 N/A VAL 102.A N LYS 118.A O no hydrogen 2.726 N/A TRP 103.A N LEU 4.A O no hydrogen 2.836 N/A LEU 104.A N SER 120.A O no hydrogen 2.928 N/A ILE 105.A N ILE 6.A O no hydrogen 2.841 N/A SER 106.A N PHE 122.A O no hydrogen 3.045 N/A SER 106.A OG ASP 8.A OD2 no hydrogen 2.673 N/A THR 107.A N ASN 11.A OD1 no hydrogen 3.031 N/A ASP 108.A N SER 106.A OG no hydrogen 3.058 N/A ASP 110.A N ASP 108.A OD1 no hydrogen 2.946 N/A TRP 111.A N ASP 108.A O no hydrogen 3.134 N/A TRP 111.A NE1 ASP 85.A OD1 no hydrogen 2.956 N/A ASP 112.A N GLY 109.A O no hydrogen 2.945 N/A THR 113.A N ASP 110.A O no hydrogen 3.264 N/A THR 113.A OG1 ASP 110.A O no hydrogen 3.023 N/A LEU 114.A N TRP 111.A O no hydrogen 3.112 N/A THR 116.A N VAL 119.A O no hydrogen 3.278 N/A LYS 118.A N THR 116.A OG1 no hydrogen 3.062 N/A LYS 118.A NZ GLY 96.A O no hydrogen 2.820 N/A LYS 118.A NZ TYR 99.A O no hydrogen 2.645 N/A VAL 119.A N THR 116.A O no hydrogen 3.306 N/A SER 120.A N VAL 102.A O no hydrogen 2.942 N/A SER 120.A OG HIS 101.A NE2 no hydrogen 2.702 N/A SER 120.A OG HIS 131.A ND1 no hydrogen 3.351 N/A ARG 121.A N TYR 130.A O no hydrogen 3.052 N/A ARG 121.A NE ASP 112.A OD1 no hydrogen 2.961 N/A ARG 121.A NH1 SER 106.A O no hydrogen 2.705 N/A ARG 121.A NH2 ASP 112.A OD2 no hydrogen 2.853 N/A PHE 122.A N LEU 104.A O no hydrogen 2.797 N/A SER 123.A N ARG 128.A O no hydrogen 3.171 N/A THR 126.A OG1 TYR 130.A OH no hydrogen 2.750 N/A ARG 127.A N SER 123.A O no hydrogen 2.764 N/A ARG 128.A N THR 126.A OG1 no hydrogen 3.204 N/A ARG 128.A NE TYR 130.A OH no hydrogen 2.821 N/A TYR 130.A N ARG 121.A O no hydrogen 2.694 N/A TYR 130.A OH THR 126.A OG1 no hydrogen 2.750 N/A ASP 134.A N HIS 131.A O no hydrogen 2.942 N/A MET 135.A N LEU 132.A O no hydrogen 3.042 N/A HIS 138.A N ASP 134.A O no hydrogen 3.199 N/A HIS 139.A N MET 135.A O no hydrogen 2.765 N/A HIS 139.A NE2 ASP 112.A OD2 no hydrogen 2.812 N/A ASN 140.A N TYR 136.A O no hydrogen 2.900 N/A ASP 142.A N GLN 146.A OE1 no hydrogen 3.089 N/A GLN 146.A N ASP 143.A OD1 no hydrogen 2.977 N/A PHE 147.A N ASP 143.A O no hydrogen 2.989 N/A ILE 148.A N VAL 144.A O no hydrogen 2.963 N/A SER 149.A N GLU 145.A O no hydrogen 3.045 N/A SER 149.A OG GLU 145.A O no hydrogen 3.446 N/A LEU 150.A N GLN 146.A O no hydrogen 2.873 N/A LYS 151.A N PHE 147.A O no hydrogen 3.080 N/A LYS 151.A NZ ASP 110.A OD1 no hydrogen 3.177 N/A ALA 152.A N ILE 148.A O no hydrogen 3.044 N/A ILE 153.A N SER 149.A O no hydrogen 2.928 N/A MET 154.A N LEU 150.A O no hydrogen 2.843 N/A GLY 155.A N LYS 151.A O no hydrogen 2.783 N/A GLY 158.A N ASP 156.A OD1 no hydrogen 2.996 N/A ASP 159.A N ASP 156.A O no hydrogen 2.952 N/A ASN 160.A N LEU 157.A O no hydrogen 3.063 N/A ASN 160.A ND2 GLU 56.A O no hydrogen 2.697 N/A ILE 161.A N ASP 156.A O no hydrogen 2.869 N/A VAL 164.A N ILE 153.A O no hydrogen 2.769 N/A ILE 167.A N VAL 164.A O no hydrogen 3.363 N/A GLY 172.A N GLY 168.A O no hydrogen 3.030 N/A TYR 173.A N ALA 169.A O no hydrogen 2.897 N/A TYR 173.A OH ASP 142.A OD2 no hydrogen 2.747 N/A ASN 174.A N LYS 170.A O no hydrogen 3.063 N/A ILE 175.A N ARG 171.A O no hydrogen 2.876 N/A ILE 176.A N GLY 172.A O no hydrogen 2.811 N/A ARG 177.A N TYR 173.A O no hydrogen 2.789 N/A ARG 177.A NH1 TYR 173.A OH no hydrogen 2.659 N/A GLU 178.A N ASN 174.A O no hydrogen 3.123 N/A PHE 179.A N ILE 175.A O no hydrogen 3.019 N/A GLY 180.A N ILE 176.A O no hydrogen 2.634 N/A ASN 181.A N ASP 184.A OD2 no hydrogen 3.038 N/A ASN 181.A ND2 GLU 145.A OE2 no hydrogen 3.254 N/A VAL 182.A N SER 149.A OG no hydrogen 2.969 N/A ASP 184.A N ASN 181.A OD1 no hydrogen 2.924 N/A ILE 185.A N ASN 181.A O no hydrogen 2.943 N/A ILE 186.A N VAL 182.A O no hydrogen 2.907 N/A ASP 187.A N LEU 183.A O no hydrogen 3.166 N/A GLN 188.A N ASP 184.A O no hydrogen 3.127 N/A GLN 188.A N ILE 185.A O no hydrogen 3.011 N/A GLN 188.A NE2 PHE 179.A O no hydrogen 2.779 N/A GLN 188.A NE2 ASP 184.A O no hydrogen 3.099 N/A LEU 189.A N ILE 186.A O no hydrogen 3.233 N/A LEU 191.A N ASN 202.A OD1 no hydrogen 2.794 N/A GLN 195.A N GLN 195.A OE1 no hydrogen 2.883 N/A ILE 198.A N GLN 195.A O no hydrogen 3.186 N/A GLN 199.A N GLN 195.A O no hydrogen 3.351 N/A ASN 200.A N LYS 196.A O no hydrogen 2.828 N/A LEU 201.A N TYR 197.A O no hydrogen 2.914 N/A ASN 202.A N ILE 198.A O no hydrogen 2.903 N/A ASN 202.A ND2 LEU 191.A O no hydrogen 3.399 N/A ALA 203.A N GLN 199.A O no hydrogen 3.220 N/A ALA 203.A N ASN 200.A O no hydrogen 3.210 N/A SER 204.A N LEU 201.A O no hydrogen 3.137 N/A SER 204.A OG ASN 200.A O no hydrogen 2.690 N/A LEU 208.A N SER 204.A O no hydrogen 2.831 N/A PHE 209.A N GLU 205.A O no hydrogen 3.107 N/A ARG 210.A N GLU 206.A O no hydrogen 2.891 N/A ARG 210.A NE ASN 211.A OD1 no hydrogen 3.095 N/A ARG 210.A NH2 ASN 211.A OD1 no hydrogen 2.756 N/A ASN 211.A N LEU 207.A O no hydrogen 2.830 N/A ASN 211.A ND2 ALA 152.A O no hydrogen 2.748 N/A ASN 211.A ND2 ARG 162.A O no hydrogen 2.880 N/A LEU 212.A N LEU 208.A O no hydrogen 3.139 N/A ILE 213.A N PHE 209.A O no hydrogen 3.437 N/A LEU 214.A N ARG 210.A O no hydrogen 3.223 N/A VAL 215.A N ASN 211.A O no hydrogen 2.936 N/A ASP 216.A N LEU 212.A O no hydrogen 2.854 N/A LEU 217.A N VAL 215.A O no hydrogen 3.039 N/A THR 219.A OG1 ASP 216.A OD1 no hydrogen 3.363 N/A THR 219.A OG1 ASP 216.A OD2 no hydrogen 2.685 N/A TYR 220.A N ASP 216.A O no hydrogen 3.199 N/A CYS 221.A N LEU 217.A O no hydrogen 2.838 N/A CYS 221.A SG PRO 218.A O no hydrogen 3.339 N/A ALA 224.A N TYR 220.A O no hydrogen 2.833 N/A ILE 225.A N CYS 221.A O no hydrogen 3.156 N/A ALA 226.A N VAL 222.A O no hydrogen 3.114 N/A VAL 228.A N ILE 225.A O no hydrogen 3.453 N/A GLY 229.A N ALA 226.A O no hydrogen 3.002 N/A LEU 233.A N GLY 229.A O no hydrogen 3.218 N/A ASP 234.A N GLN 230.A O no hydrogen 2.893 N/A LYS 235.A N ASP 231.A O no hydrogen 2.969 N/A PHE 236.A N VAL 232.A O no hydrogen 3.076 N/A THR 237.A N LEU 233.A O no hydrogen 2.932 N/A THR 237.A OG1 TYR 90.A OH no hydrogen 2.669 N/A THR 237.A OG1 LEU 233.A O no hydrogen 2.785 N/A LYS 238.A N ASP 234.A O no hydrogen 2.923 N/A ASP 239.A N LYS 235.A O no hydrogen 2.924 N/A ILE 240.A N PHE 236.A O no hydrogen 3.007 N/A LEU 241.A N THR 237.A O no hydrogen 3.164 N/A GLU 242.A N LYS 238.A O no hydrogen 3.043 N/A ILE 243.A N ASP 239.A O no hydrogen 3.110 N/A ALA 244.A N ILE 240.A O no hydrogen 3.090 N/A GLU 245.A N GLU 242.A O no hydrogen 2.995 N/A