Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3dcl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A NE ASP 139.A OD1 no hydrogen 3.453 N/A ARG 3.A NE ASP 139.A OD2 no hydrogen 3.547 N/A ARG 3.A NH2 ASP 139.A OD1 no hydrogen 3.109 N/A ASN 5.A N LYS 136.A O no hydrogen 3.320 N/A ASN 5.A ND2 GLY 134.A O no hydrogen 2.701 N/A LYS 6.A N THR 4.A OG1 no hydrogen 3.315 N/A LYS 6.A NZ GLU 153.A OE2 no hydrogen 3.166 N/A ARG 8.A N ASN 5.A O no hydrogen 2.785 N/A LEU 9.A N LYS 6.A O no hydrogen 3.220 N/A ILE 12.A N ALA 130.A O no hydrogen 3.058 N/A VAL 14.A N ILE 128.A O no hydrogen 2.824 N/A GLY 16.A N ILE 126.A O no hydrogen 3.028 N/A ILE 18.A N ASP 124.A O no hydrogen 2.932 N/A ALA 19.A N SER 66.A O no hydrogen 2.794 N/A LYS 22.A N LEU 40.A O no hydrogen 2.970 N/A LYS 22.A NZ HIS 108.A NE2 no hydrogen 2.779 N/A TYR 26.A N SER 24.A OG no hydrogen 3.108 N/A SER 27.A N ARG 35.A O no hydrogen 2.813 N/A THR 29.A N THR 33.A O no hydrogen 2.777 N/A THR 29.A OG1 THR 33.A O no hydrogen 3.219 N/A THR 29.A OG1 THR 33.A OG1 no hydrogen 2.599 N/A THR 30.A OG1 GLU 31.A OE1 no hydrogen 2.962 N/A THR 30.A OG1 GLU 31.A OE2 no hydrogen 2.599 N/A GLU 31.A N THR 29.A OG1 no hydrogen 3.275 N/A GLY 32.A N THR 29.A O no hydrogen 3.091 N/A THR 33.A N THR 29.A OG1 no hydrogen 3.030 N/A THR 33.A OG1 THR 29.A OG1 no hydrogen 2.599 N/A ARG 35.A N SER 27.A O no hydrogen 2.974 N/A GLY 41.A N GLU 62.A OE1 no hydrogen 2.885 N/A THR 44.A N GLY 64.A O no hydrogen 2.927 N/A THR 44.A OG1 GLU 62.A O no hydrogen 3.141 N/A LYS 48.A N ASP 51.A OD2 no hydrogen 2.886 N/A GLY 50.A N LEU 205.A O no hydrogen 2.776 N/A ASP 51.A N LYS 48.A O no hydrogen 2.974 N/A SER 52.A OG TYR 54.A O no hydrogen 3.133 N/A SER 52.A OG ASP 202.A OD1 no hydrogen 2.574 N/A SER 52.A OG ASP 202.A OD2 no hydrogen 3.512 N/A ALA 53.A N LEU 203.A O no hydrogen 2.859 N/A TYR 54.A N SER 52.A OG no hydrogen 2.937 N/A TYR 54.A OH ALA 192.A O no hydrogen 2.943 N/A TRP 56.A NE1 SER 52.A O no hydrogen 3.018 N/A ASP 59.A N PRO 38.A O no hydrogen 3.044 N/A HIS 60.A N ALA 237.A O no hydrogen 3.365 N/A HIS 60.A ND1 ASP 59.A OD2 no hydrogen 2.659 N/A VAL 61.A N SER 236.A OG no hydrogen 2.804 N/A GLY 64.A N VAL 47.A O no hydrogen 3.048 N/A VAL 65.A N VAL 111.A O no hydrogen 2.922 N/A SER 66.A N GLY 42.A O no hydrogen 3.046 N/A SER 66.A OG GLY 42.A O no hydrogen 3.511 N/A SER 66.A OG GLU 62.A OE1 no hydrogen 2.592 N/A VAL 67.A N VAL 109.A O no hydrogen 2.752 N/A ARG 69.A NE GLU 73.A OE1 no hydrogen 2.808 N/A ARG 69.A NH2 GLU 73.A OE1 no hydrogen 3.389 N/A ARG 69.A NH2 GLU 73.A OE2 no hydrogen 2.934 N/A ARG 70.A NH1 GLU 73.A OE2 no hydrogen 2.773 N/A GLU 72.A N GLU 72.A OE1 no hydrogen 2.766 N/A GLU 73.A N ARG 70.A O no hydrogen 3.026 N/A GLU 74.A N LYS 71.A O no hydrogen 3.028 N/A LEU 77.A N GLU 73.A O no hydrogen 3.362 N/A THR 78.A OG1 ILE 75.A O no hydrogen 2.518 N/A LEU 79.A N PRO 76.A O no hydrogen 2.948 N/A SER 80.A OG LEU 77.A O no hydrogen 2.621 N/A CYS 81.A N ASN 84.A OD1 no hydrogen 2.780 N/A CYS 81.A SG LEU 79.A O no hydrogen 3.706 N/A ILE 82.A N ASN 146.A O no hydrogen 2.893 N/A GLY 83.A N VAL 99.A O no hydrogen 2.779 N/A ASN 84.A N CYS 81.A O no hydrogen 2.930 N/A ASN 84.A ND2 TRP 131.A O no hydrogen 2.807 N/A ASN 84.A ND2 ASP 148.A OD2 no hydrogen 2.819 N/A VAL 86.A N GLY 97.A O no hydrogen 2.944 N/A ILE 87.A N LEU 127.A O no hydrogen 2.813 N/A VAL 88.A N SER 95.A O no hydrogen 2.898 N/A LYS 93.A N GLY 90.A O no hydrogen 3.263 N/A GLY 94.A N VAL 88.A O no hydrogen 2.700 N/A SER 95.A N ALA 92.A O no hydrogen 2.963 N/A SER 95.A OG ALA 92.A O no hydrogen 2.790 N/A ARG 96.A NE GLU 85.A OE2 no hydrogen 2.549 N/A ARG 96.A NH2 GLU 85.A OE2 no hydrogen 3.039 N/A GLY 97.A N VAL 86.A O no hydrogen 2.762 N/A PHE 98.A N HIS 112.A O no hydrogen 2.942 N/A VAL 99.A N ASN 84.A O no hydrogen 2.950 N/A THR 100.A N LEU 110.A O no hydrogen 2.847 N/A THR 100.A OG1 LEU 110.A O no hydrogen 3.199 N/A LYS 102.A NZ SER 80.A O no hydrogen 2.786 N/A LYS 102.A NZ ASN 146.A OD1 no hydrogen 2.821 N/A LYS 102.A NZ ALA 185.A O no hydrogen 2.786 N/A HIS 103.A N HIS 108.A O no hydrogen 2.827 N/A HIS 103.A ND1 ASP 188.A OD2 no hydrogen 2.781 N/A GLY 104.A N ASP 188.A OD1 no hydrogen 2.919 N/A GLY 105.A N ASN 107.A OD1 no hydrogen 3.235 N/A ASN 107.A ND2 GLU 74.A OE1 no hydrogen 2.679 N/A HIS 108.A N HIS 103.A O no hydrogen 2.997 N/A HIS 108.A ND1 GLU 62.A OE1 no hydrogen 2.902 N/A VAL 109.A N VAL 67.A O no hydrogen 2.834 N/A LEU 110.A N GLY 101.A O no hydrogen 2.825 N/A VAL 111.A N VAL 65.A O no hydrogen 2.840 N/A HIS 112.A N PHE 98.A O no hydrogen 2.768 N/A HIS 112.A NE2 GLU 114.A OE2 no hydrogen 2.999 N/A VAL 117.A N GLU 114.A O no hydrogen 2.901 N/A LEU 118.A N GLU 115.A O no hydrogen 3.084 N/A LYS 120.A N VAL 117.A O no hydrogen 3.031 N/A LEU 121.A N LEU 118.A O no hydrogen 3.308 N/A GLY 123.A N ILE 18.A O no hydrogen 2.897 N/A LYS 125.A N SER 89.A OG no hydrogen 2.832 N/A ILE 126.A N GLY 16.A O no hydrogen 2.945 N/A LEU 127.A N ILE 87.A O no hydrogen 2.952 N/A ILE 128.A N VAL 14.A O no hydrogen 2.659 N/A LYS 129.A N GLU 85.A O no hydrogen 3.011 N/A ALA 130.A N ILE 12.A O no hydrogen 2.897 N/A TRP 131.A N ASN 84.A OD1 no hydrogen 3.194 N/A GLN 133.A NE2 THR 78.A O no hydrogen 2.771 N/A GLN 133.A NE2 ASN 146.A OD1 no hydrogen 2.805 N/A LEU 135.A N GLY 132.A O no hydrogen 3.155 N/A LYS 136.A N ASN 5.A OD1 no hydrogen 2.829 N/A LEU 138.A N ARG 3.A O no hydrogen 2.911 N/A HIS 140.A N LEU 137.A O no hydrogen 3.009 N/A HIS 140.A NE2 GLU 159.A OE2 no hydrogen 2.862 N/A VAL 143.A N HIS 140.A O no hydrogen 2.985 N/A LYS 144.A N THR 251.A O no hydrogen 2.897 N/A LYS 144.A NZ PRO 141.A O no hydrogen 3.239 N/A ASN 146.A N GLN 133.A OE1 no hydrogen 3.011 N/A ASN 146.A ND2 SER 184.A O no hydrogen 2.807 N/A ASN 146.A ND2 VAL 249.A O no hydrogen 2.885 N/A ASP 148.A N ILE 82.A O no hydrogen 2.821 N/A ASP 150.A N ASP 148.A OD1 no hydrogen 2.823 N/A LEU 151.A N ASP 148.A OD1 no hydrogen 3.308 N/A PHE 152.A N ASP 148.A O no hydrogen 2.850 N/A GLU 153.A N PRO 149.A O no hydrogen 3.344 N/A LYS 154.A N LEU 151.A O no hydrogen 2.976 N/A LEU 155.A N PHE 152.A O no hydrogen 3.385 N/A GLN 158.A N HIS 165.A O no hydrogen 2.980 N/A LYS 160.A N LYS 163.A O no hydrogen 2.738 N/A LYS 163.A N LYS 160.A O no hydrogen 2.701 N/A ILE 164.A N LYS 256.A O no hydrogen 2.721 N/A HIS 165.A N GLN 158.A O no hydrogen 2.756 N/A HIS 165.A ND1 GLU 260.A OE2 no hydrogen 2.988 N/A VAL 166.A N LEU 258.A O no hydrogen 3.076 N/A VAL 168.A N GLU 260.A O no hydrogen 2.965 N/A VAL 169.A N ILE 208.A O no hydrogen 2.865 N/A ILE 172.A N ALA 210.A O no hydrogen 2.768 N/A GLY 176.A N ASP 190.A O no hydrogen 2.877 N/A SER 177.A N GLY 242.A O no hydrogen 2.908 N/A SER 177.A OG HIS 243.A NE2 no hydrogen 3.081 N/A ILE 179.A N GLY 176.A O no hydrogen 3.232 N/A GLY 180.A N VAL 220.A O no hydrogen 2.775 N/A ALA 181.A N GLY 178.A O no hydrogen 3.227 N/A SER 184.A N TYR 218.A O no hydrogen 2.942 N/A SER 184.A OG ASN 216.A O no hydrogen 2.501 N/A SER 184.A OG TYR 218.A O no hydrogen 3.400 N/A ALA 185.A N SER 183.A OG no hydrogen 3.064 N/A SER 186.A N SER 183.A O no hydrogen 3.142 N/A SER 186.A OG SER 183.A O no hydrogen 3.319 N/A THR 187.A OG1 ASP 188.A O no hydrogen 2.971 N/A THR 187.A OG1 ASP 188.A OD1 no hydrogen 3.358 N/A TYR 189.A N VAL 247.A O no hydrogen 2.907 N/A TYR 189.A OH HIS 214.A ND1 no hydrogen 2.643 N/A ASP 190.A N SER 177.A O no hydrogen 2.853 N/A ILE 191.A N PRO 245.A O no hydrogen 2.851 N/A ASN 194.A N ASP 197.A OD2 no hydrogen 3.016 N/A ASP 197.A N ASN 194.A O no hydrogen 2.984 N/A LEU 198.A N PRO 195.A O no hydrogen 2.770 N/A GLY 199.A N GLU 196.A O no hydrogen 2.936 N/A VAL 200.A N PRO 195.A O no hydrogen 3.434 N/A LYS 204.A N ASP 207.A OD2 no hydrogen 2.960 N/A LYS 204.A NZ ASP 202.A OD2 no hydrogen 2.662 N/A LEU 205.A N ASP 51.A O no hydrogen 2.753 N/A GLY 206.A N VAL 233.A O no hydrogen 2.825 N/A ASP 207.A N LYS 204.A O no hydrogen 3.022 N/A ILE 208.A N ALA 265.A O no hydrogen 2.817 N/A VAL 209.A N GLY 231.A O no hydrogen 2.954 N/A ALA 210.A N ALA 170.A O no hydrogen 2.932 N/A ILE 211.A N SER 229.A O no hydrogen 2.707 N/A GLN 212.A N ILE 172.A O no hydrogen 2.795 N/A ASP 213.A N ALA 227.A O no hydrogen 2.742 N/A HIS 214.A ND1 TYR 189.A OH no hydrogen 2.643 N/A ASP 215.A N LYS 222.A O no hydrogen 2.763 N/A ASN 216.A N THR 251.A OG1 no hydrogen 3.014 N/A ASN 216.A ND2 TYR 189.A OH no hydrogen 3.077 N/A ASN 216.A ND2 SER 229.A OG no hydrogen 2.829 N/A SER 217.A N ASP 215.A OD2 no hydrogen 2.953 N/A SER 217.A OG ASP 215.A OD1 no hydrogen 2.592 N/A SER 217.A OG ASP 215.A OD2 no hydrogen 3.347 N/A VAL 220.A N ALA 181.A O no hydrogen 3.006 N/A GLY 221.A N ASN 216.A OD1 no hydrogen 2.981 N/A LYS 222.A N ASP 215.A O no hydrogen 3.183 N/A LYS 222.A NZ TYR 223.A O no hydrogen 2.823 N/A ARG 224.A N ASP 213.A O no hydrogen 2.854 N/A ARG 224.A NH2 ASP 253.A OD2 no hydrogen 2.873 N/A LYS 225.A NZ ASP 213.A OD1 no hydrogen 3.121 N/A GLY 226.A N ASP 213.A OD1 no hydrogen 2.870 N/A ALA 227.A N ARG 224.A O no hydrogen 3.003 N/A VAL 228.A N GLY 252.A O no hydrogen 2.875 N/A SER 229.A N ILE 211.A O no hydrogen 2.943 N/A SER 229.A OG HIS 214.A O no hydrogen 2.725 N/A SER 229.A OG THR 251.A OG1 no hydrogen 2.943 N/A GLY 231.A N VAL 209.A O no hydrogen 2.898 N/A VAL 232.A N VAL 248.A O no hydrogen 2.857 N/A VAL 233.A N ASP 207.A O no hydrogen 2.848 N/A VAL 234.A N GLY 246.A O no hydrogen 2.854 N/A SER 236.A N VAL 61.A O no hydrogen 2.958 N/A SER 236.A OG ALA 237.A O no hydrogen 3.068 N/A ALA 237.A N ALA 53.A O no hydrogen 2.767 N/A CYS 238.A SG HIS 235.A NE2 no hydrogen 3.636 N/A CYS 238.A SG SER 236.A O no hydrogen 3.539 N/A CYS 238.A SG GLY 244.A O no hydrogen 3.794 N/A VAL 239.A N ASP 59.A OD1 no hydrogen 2.719 N/A SER 240.A OG VAL 28.A O no hydrogen 2.545 N/A HIS 243.A N SER 240.A O no hydrogen 3.135 N/A GLY 244.A N ASP 190.A OD2 no hydrogen 3.120 N/A VAL 247.A N TYR 189.A O no hydrogen 2.731 N/A VAL 248.A N VAL 232.A O no hydrogen 2.916 N/A ILE 250.A N ILE 230.A O no hydrogen 2.847 N/A THR 251.A OG1 VAL 228.A O no hydrogen 3.511 N/A THR 251.A OG1 SER 229.A OG no hydrogen 2.943 N/A GLY 252.A N VAL 228.A O no hydrogen 3.042 N/A GLU 254.A N GLY 226.A O no hydrogen 2.811 N/A SER 255.A N ASP 253.A OD1 no hydrogen 2.818 N/A SER 255.A OG ASP 253.A OD1 no hydrogen 2.662 N/A LYS 256.A N ASP 253.A O no hydrogen 2.924 N/A ILE 257.A N ASP 253.A O no hydrogen 2.975 N/A LEU 258.A N ILE 164.A O no hydrogen 2.760 N/A GLU 260.A N VAL 166.A O no hydrogen 2.855 N/A VAL 262.A N VAL 168.A O no hydrogen 2.772 N/A ARG 264.A NE ASP 269.A OD1 no hydrogen 3.186 N/A ARG 264.A NE ASP 269.A OD2 no hydrogen 2.975 N/A ARG 264.A NH2 ASP 269.A OD1 no hydrogen 3.135 N/A ASN 266.A ND2 LEU 205.A O no hydrogen 3.021 N/A ASN 266.A ND2 ASP 207.A OD1 no hydrogen 2.561 N/A ILE 267.A N GLY 206.A O no hydrogen 2.916 N/A SER 268.A N ASN 266.A OD1 no hydrogen 3.013 N/A SER 268.A OG ASN 266.A OD1 no hydrogen 2.860 N/A ASP 269.A N ASN 266.A O no hydrogen 3.153 N/A TYR 270.A N ILE 267.A O no hydrogen 2.852 N/A LEU 271.A N SER 268.A O no hydrogen 3.346 N/A VAL 272.A N SER 268.A O no hydrogen 3.037 N/A