Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2ym3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 3.A N VAL 15.A O no hydrogen 2.940 N/A VAL 5.A N LEU 13.A O no hydrogen 2.813 N/A LEU 8.A N VAL 11.A O no hydrogen 2.729 N/A GLY 9.A N VAL 11.A O no hydrogen 3.317 N/A GLU 10.A N ILE 27.A O no hydrogen 3.245 N/A VAL 11.A N GLY 9.A O no hydrogen 3.102 N/A GLN 12.A N VAL 25.A O no hydrogen 2.839 N/A GLN 12.A NE2 GLU 10.A OE2 no hydrogen 2.761 N/A LEU 13.A N GLN 6.A O no hydrogen 2.746 N/A ALA 14.A N VAL 23.A O no hydrogen 2.783 N/A VAL 15.A N ASP 3.A O no hydrogen 2.844 N/A ASN 16.A N GLU 21.A O no hydrogen 2.774 N/A ARG 17.A N ASP 1.A O no hydrogen 2.913 N/A VAL 18.A N ASN 16.A OD1 no hydrogen 2.843 N/A THR 19.A N ASN 16.A OD1 no hydrogen 2.864 N/A GLU 20.A N ASN 16.A O no hydrogen 2.852 N/A GLU 21.A N THR 19.A OG1 no hydrogen 3.262 N/A VAL 23.A N ALA 14.A O no hydrogen 2.814 N/A ALA 24.A N LEU 61.A O no hydrogen 2.827 N/A VAL 25.A N GLN 12.A O no hydrogen 2.752 N/A LYS 26.A N LEU 59.A O no hydrogen 2.837 N/A LYS 26.A NZ GLU 34.A OE2 no hydrogen 2.756 N/A LYS 26.A NZ ASP 125.A OD1 no hydrogen 3.446 N/A ILE 27.A N GLU 10.A O no hydrogen 2.825 N/A VAL 28.A N GLN 57.A O no hydrogen 3.082 N/A ASN 30.A ND2 GLY 127.A O no hydrogen 3.465 N/A LYS 33.A NZ THR 130.A OG1 no hydrogen 2.945 N/A GLU 34.A N ASN 30.A O no hydrogen 3.289 N/A ILE 35.A N ILE 31.A O no hydrogen 3.164 N/A CYS 36.A N LYS 32.A O no hydrogen 3.060 N/A ILE 37.A N LYS 33.A O no hydrogen 2.805 N/A ASN 38.A N GLU 34.A O no hydrogen 2.919 N/A ASN 38.A ND2 GLU 34.A O no hydrogen 2.854 N/A LYS 39.A N ILE 35.A O no hydrogen 2.958 N/A LYS 39.A N CYS 36.A O no hydrogen 3.271 N/A LYS 39.A NZ HIS 52.A NE2 no hydrogen 3.367 N/A MET 40.A N ILE 37.A O no hydrogen 3.033 N/A LEU 41.A N ASN 38.A O no hydrogen 3.201 N/A ASN 42.A N TYR 97.A OH no hydrogen 2.734 N/A GLU 44.A N GLU 44.A OE1 no hydrogen 2.730 N/A ASN 45.A N HIS 43.A ND1 no hydrogen 2.990 N/A ASN 45.A ND2 LEU 121.A O no hydrogen 2.941 N/A VAL 46.A N HIS 43.A O no hydrogen 3.069 N/A VAL 47.A N ILE 123.A O no hydrogen 2.957 N/A LYS 48.A N GLU 62.A OE1 no hydrogen 3.008 N/A TYR 50.A N PHE 60.A O no hydrogen 2.817 N/A ARG 53.A N TYR 58.A O no hydrogen 2.918 N/A GLU 55.A N ILE 56.A O no hydrogen 3.082 N/A GLN 57.A N VAL 28.A O no hydrogen 2.637 N/A TYR 58.A N ARG 53.A O no hydrogen 2.880 N/A TYR 58.A OH GLU 55.A OE1 no hydrogen 2.906 N/A LEU 59.A N LYS 26.A O no hydrogen 3.044 N/A PHE 60.A N GLY 51.A O no hydrogen 2.893 N/A LEU 61.A N ALA 24.A O no hydrogen 2.748 N/A GLU 62.A N LYS 48.A O no hydrogen 2.823 N/A CYS 64.A SG GLU 62.A O no hydrogen 3.818 N/A GLY 66.A N LEU 115.A O no hydrogen 2.725 N/A GLY 67.A N CYS 64.A O no hydrogen 3.126 N/A LEU 69.A N LEU 113.A O no hydrogen 2.821 N/A PHE 70.A N PRO 110.A O no hydrogen 3.355 N/A ASP 71.A N GLU 68.A O no hydrogen 3.011 N/A ARG 72.A N LEU 69.A O no hydrogen 2.780 N/A ARG 72.A NH1 ASP 119.A OD1 no hydrogen 2.781 N/A ARG 72.A NH1 ASP 119.A OD2 no hydrogen 3.259 N/A ARG 72.A NH2 GLY 66.A O no hydrogen 3.154 N/A ARG 72.A NH2 ASP 119.A OD1 no hydrogen 2.712 N/A ILE 73.A N PHE 70.A O no hydrogen 3.346 N/A GLU 74.A N GLY 78.A O no hydrogen 2.904 N/A ASP 76.A N GLY 181.A O no hydrogen 2.919 N/A ILE 77.A N GLU 74.A O no hydrogen 2.895 N/A GLY 78.A N GLU 74.A O no hydrogen 2.656 N/A MET 79.A N MET 178.A O no hydrogen 2.851 N/A ALA 84.A N PRO 80.A O no hydrogen 3.110 N/A GLN 85.A N GLU 81.A O no hydrogen 2.855 N/A GLN 85.A NE2 TRP 241.A O no hydrogen 2.740 N/A GLN 85.A NE2 LYS 244.A O no hydrogen 2.800 N/A ARG 86.A N PRO 82.A O no hydrogen 3.067 N/A ARG 86.A NH1 ASP 119.A O no hydrogen 2.887 N/A ARG 86.A NH2 ARG 118.A O no hydrogen 3.165 N/A ARG 86.A NH2 ASP 119.A O no hydrogen 3.228 N/A PHE 87.A N ASP 83.A O no hydrogen 2.966 N/A PHE 88.A N ALA 84.A O no hydrogen 2.825 N/A HIS 89.A N GLN 85.A O no hydrogen 2.852 N/A HIS 89.A NE2 TYR 242.A O no hydrogen 2.752 N/A GLN 90.A N ARG 86.A O no hydrogen 3.181 N/A GLN 90.A NE2 ASN 120.A OD1 no hydrogen 3.206 N/A LEU 91.A N PHE 87.A O no hydrogen 2.910 N/A MET 92.A N PHE 88.A O no hydrogen 3.018 N/A ALA 93.A N HIS 89.A O no hydrogen 3.031 N/A GLY 94.A N GLN 90.A O no hydrogen 3.040 N/A VAL 95.A N LEU 91.A O no hydrogen 2.922 N/A VAL 96.A N MET 92.A O no hydrogen 2.776 N/A TYR 97.A N ALA 93.A O no hydrogen 3.161 N/A TYR 97.A OH MET 40.A O no hydrogen 3.412 N/A LEU 98.A N GLY 94.A O no hydrogen 3.097 N/A HIS 99.A N VAL 95.A O no hydrogen 2.962 N/A HIS 99.A NE2 ASP 167.A OD2 no hydrogen 2.800 N/A GLY 100.A N VAL 96.A O no hydrogen 2.865 N/A ILE 101.A N TYR 97.A O no hydrogen 3.118 N/A ILE 101.A N LEU 98.A O no hydrogen 2.979 N/A GLY 102.A N HIS 99.A O no hydrogen 3.069 N/A ILE 103.A N LEU 98.A O no hydrogen 2.894 N/A THR 104.A N THR 130.A O no hydrogen 3.017 N/A THR 104.A OG1 ASP 167.A OD1 no hydrogen 3.418 N/A THR 104.A OG1 ASP 167.A OD2 no hydrogen 2.642 N/A HIS 105.A NE2 SER 124.A O no hydrogen 2.883 N/A ARG 106.A N ASP 167.A OD1 no hydrogen 3.354 N/A ARG 106.A NE.B LEU 128.A O no hydrogen 2.656 N/A ARG 106.A NH2.A LYS 143.A O no hydrogen 2.589 N/A ARG 106.A NH2.B LEU 128.A O no hydrogen 2.920 N/A ASP 107.A N HIS 105.A ND1 no hydrogen 3.024 N/A LYS 109.A NZ THR 147.A OG1 no hydrogen 2.896 N/A GLU 111.A N GLU 111.A OE1 no hydrogen 2.657 N/A ASN 112.A N LYS 109.A O no hydrogen 2.814 N/A ASN 112.A ND2 ASP 107.A O no hydrogen 2.903 N/A ASN 112.A ND2 ASP 107.A OD2 no hydrogen 3.515 N/A LEU 113.A N PRO 110.A O no hydrogen 3.336 N/A LEU 114.A N LYS 122.A O no hydrogen 2.865 N/A LEU 115.A N GLY 67.A O no hydrogen 2.823 N/A ASP 116.A N ASN 120.A O no hydrogen 3.100 N/A ARG 118.A N ASP 116.A OD1 no hydrogen 2.805 N/A ASP 119.A N ASP 116.A O no hydrogen 2.951 N/A ASN 120.A N ASP 116.A OD1 no hydrogen 2.791 N/A ASN 120.A ND2 ASP 116.A OD2 no hydrogen 3.223 N/A LEU 121.A N GLN 90.A OE1 no hydrogen 2.760 N/A LYS 122.A N LEU 114.A O no hydrogen 2.655 N/A LYS 122.A NZ GLU 44.A O no hydrogen 2.960 N/A LYS 122.A NZ GLU 62.A OE2 no hydrogen 3.113 N/A ILE 123.A N ASN 45.A O no hydrogen 2.885 N/A SER 124.A N ASN 112.A O no hydrogen 2.814 N/A GLY 127.A N ASP 125.A OD1 no hydrogen 3.175 N/A ALA 129.A N PHE 126.A O no hydrogen 3.386 N/A THR 130.A N THR 104.A O no hydrogen 3.026 N/A PHE 132.A N GLY 102.A O no hydrogen 2.825 N/A ARG 133.A N GLY 102.A O no hydrogen 3.439 N/A ARG 133.A NH1 HIS 99.A O no hydrogen 2.815 N/A ARG 133.A NH2 HIS 99.A O no hydrogen 3.198 N/A TYR 134.A N ARG 137.A O no hydrogen 3.164 N/A ARG 137.A N TYR 134.A O no hydrogen 2.994 N/A ARG 139.A N PHE 132.A O no hydrogen 2.689 N/A LEU 141.A N PHE 161.A O no hydrogen 2.961 N/A THR 147.A OG1 ASP 107.A OD1 no hydrogen 2.877 N/A TYR 150.A N THR 147.A O no hydrogen 2.703 N/A VAL 151.A N LEU 148.A O no hydrogen 3.246 N/A GLU 154.A N GLU 154.A OE1 no hydrogen 2.763 N/A LEU 155.A N ALA 152.A O no hydrogen 3.197 N/A LEU 156.A N PRO 153.A O no hydrogen 3.130 N/A LYS 157.A N GLU 154.A O no hydrogen 3.087 N/A LYS 157.A NZ GLU 225.A OE2 no hydrogen 3.131 N/A ARG 158.A N GLU 154.A O no hydrogen 2.793 N/A PHE 161.A N LEU 141.A O no hydrogen 3.022 N/A HIS 162.A ND1 GLU 138.A OE2 no hydrogen 2.783 N/A VAL 166.A N ALA 163.A O no hydrogen 3.237 N/A ASP 167.A N ALA 163.A O no hydrogen 3.415 N/A VAL 168.A N GLU 164.A O no hydrogen 3.075 N/A TRP 169.A N PRO 165.A O no hydrogen 3.005 N/A SER 170.A N VAL 166.A O no hydrogen 3.151 N/A SER 170.A OG ASP 167.A O no hydrogen 2.785 N/A CYS 171.A N ASP 167.A O no hydrogen 3.064 N/A CYS 171.A SG ASP 167.A O no hydrogen 3.272 N/A GLY 172.A N VAL 168.A O no hydrogen 3.075 N/A ILE 173.A N TRP 169.A O no hydrogen 3.087 N/A VAL 174.A N SER 170.A O no hydrogen 2.999 N/A LEU 175.A N CYS 171.A O no hydrogen 3.035 N/A THR 176.A N GLY 172.A O no hydrogen 3.051 N/A THR 176.A OG1 GLY 172.A O no hydrogen 2.968 N/A ALA 177.A N ILE 173.A O no hydrogen 3.025 N/A MET 178.A N VAL 174.A O no hydrogen 2.939 N/A LEU 179.A N LEU 175.A O no hydrogen 3.009 N/A LEU 179.A N THR 176.A O no hydrogen 3.170 N/A ALA 180.A N THR 176.A O no hydrogen 2.856 N/A GLY 181.A N ALA 177.A O no hydrogen 2.773 N/A SER 189.A OG GLN 187.A OE1 no hydrogen 3.296 N/A SER 189.A OG SER 191.A OG no hydrogen 3.085 N/A SER 191.A OG SER 189.A OG no hydrogen 3.085 N/A CYS 192.A N SER 189.A O no hydrogen 2.979 N/A CYS 192.A SG GLN 187.A O no hydrogen 3.382 N/A CYS 192.A SG GLU 194.A OE1 no hydrogen 3.633 N/A GLN 193.A NE2 ASP 197.A OD1 no hydrogen 2.983 N/A GLU 194.A N GLU 194.A OE1 no hydrogen 2.729 N/A TYR 195.A OH GLU 225.A OE2 no hydrogen 3.419 N/A SER 196.A N CYS 192.A O no hydrogen 2.996 N/A SER 196.A OG CYS 192.A O no hydrogen 3.503 N/A ASP 197.A N GLN 193.A O no hydrogen 2.881 N/A TRP 198.A N GLU 194.A O no hydrogen 3.261 N/A TRP 198.A NE1 LEU 223.A O no hydrogen 3.001 N/A LYS 199.A N TYR 195.A O no hydrogen 3.050 N/A LYS 199.A NZ ASP 190.A OD1 no hydrogen 2.967 N/A LYS 199.A NZ GLU 225.A OE1 no hydrogen 3.241 N/A GLU 200.A N SER 196.A O no hydrogen 3.032 N/A GLU 200.A N ASP 197.A O no hydrogen 3.010 N/A LYS 201.A N TRP 198.A O no hydrogen 2.898 N/A LYS 202.A N ASP 197.A O no hydrogen 3.078 N/A LYS 202.A NZ ASP 197.A OD1 no hydrogen 3.530 N/A LYS 202.A NZ GLU 200.A OE1 no hydrogen 3.171 N/A THR 203.A N LYS 201.A O no hydrogen 2.885 N/A LEU 205.A N LYS 202.A O no hydrogen 3.314 N/A LYS 209.A N LEU 205.A O no hydrogen 2.948 N/A LYS 210.A N PRO 207.A O no hydrogen 3.046 N/A LYS 210.A NZ ASP 76.A O no hydrogen 3.020 N/A LYS 210.A NZ ASP 76.A OD1 no hydrogen 2.772 N/A LYS 210.A NZ ALA 180.A O no hydrogen 3.026 N/A LYS 210.A NZ GLU 182.A OE2 no hydrogen 2.694 N/A ILE 211.A N TRP 208.A O no hydrogen 3.141 N/A ALA 214.A N ASP 212.A OD2 no hydrogen 3.186 N/A LEU 216.A N ASP 212.A O no hydrogen 2.929 N/A ALA 217.A N SER 213.A O no hydrogen 2.907 N/A LEU 218.A N ALA 214.A O no hydrogen 3.338 N/A LEU 219.A N PRO 215.A O no hydrogen 3.008 N/A HIS 220.A N LEU 216.A O no hydrogen 2.961 N/A LYS 221.A N LEU 218.A O no hydrogen 2.956 N/A LYS 221.A NZ ASP 239.A OD1 no hydrogen 2.791 N/A ILE 222.A N LEU 218.A O no hydrogen 3.090 N/A LEU 223.A N LEU 219.A O no hydrogen 2.850 N/A SER 228.A N ASN 226.A OD1 no hydrogen 2.954 N/A ALA 229.A N ASN 226.A O no hydrogen 2.875 N/A ARG 230.A N ASN 226.A O no hydrogen 2.958 N/A ARG 230.A NE VAL 224.A O no hydrogen 2.936 N/A ARG 230.A NH1 GLU 154.A OE1 no hydrogen 3.515 N/A ARG 230.A NH1 GLU 154.A OE2 no hydrogen 2.831 N/A ARG 230.A NH1 PRO 165.A O no hydrogen 2.872 N/A ARG 230.A NH2 GLU 154.A OE1 no hydrogen 2.778 N/A ARG 230.A NH2 VAL 224.A O no hydrogen 2.943 N/A ARG 230.A NH2 GLU 225.A O no hydrogen 3.131 N/A ILE 231.A N LYS 221.A O no hydrogen 3.165 N/A ILE 236.A N THR 232.A O no hydrogen 2.895 N/A LYS 237.A N ILE 233.A O no hydrogen 3.014 N/A LYS 237.A NZ TYR 242.A OH no hydrogen 3.381 N/A LYS 238.A N ASP 235.A O no hydrogen 3.083 N/A ASP 239.A N ILE 236.A O no hydrogen 2.994 N/A TRP 241.A NE1 GLU 81.A OE2 no hydrogen 2.843 N/A TYR 242.A N ASP 239.A OD2 no hydrogen 2.920 N/A ASN 243.A N ASP 239.A O no hydrogen 3.228 N/A ASN 243.A N ARG 240.A O no hydrogen 3.280 N/A ASN 243.A ND2 LYS 237.A O no hydrogen 2.787 N/A ASN 243.A ND2 ASP 239.A O no hydrogen 2.856 N/A LYS 244.A N TRP 241.A O no hydrogen 2.982 N/A