Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3vzs_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 1.A NE2 GLY 25.A O no hydrogen 2.973 N/A ILE 3.A N ASP 81.A OD2 no hydrogen 2.999 N/A ALA 4.A N ARG 27.A O no hydrogen 2.866 N/A TYR 5.A N VAL 82.A O no hydrogen 2.754 N/A TYR 5.A OH SER 56.A OG no hydrogen 2.742 N/A VAL 6.A N VAL 29.A O no hydrogen 2.910 N/A THR 7.A N ILE 84.A O no hydrogen 3.066 N/A THR 7.A OG1 ILE 84.A O no hydrogen 3.403 N/A GLY 9.A N GLY 31.A O no hydrogen 3.052 N/A THR 15.A N GLY 11.A O no hydrogen 2.957 N/A THR 15.A OG1 GLY 11.A O no hydrogen 2.656 N/A ILE 17.A N ILE 13.A O no hydrogen 3.110 N/A CYS 18.A N GLY 14.A O no hydrogen 2.913 N/A CYS 18.A SG GLY 9.A O no hydrogen 3.600 N/A CYS 18.A SG GLY 14.A O no hydrogen 3.287 N/A GLN 19.A N THR 15.A O no hydrogen 2.817 N/A GLN 19.A NE2 GLN 46.A OE1 no hydrogen 2.632 N/A ARG 20.A N ALA 16.A O no hydrogen 2.955 N/A LEU 21.A N ILE 17.A O no hydrogen 2.989 N/A ALA 22.A N CYS 18.A O no hydrogen 2.957 N/A LYS 23.A N GLN 19.A O no hydrogen 3.003 N/A ASP 24.A N ARG 20.A O no hydrogen 3.031 N/A GLY 25.A N ALA 22.A O no hydrogen 3.017 N/A PHE 26.A N LEU 21.A O no hydrogen 2.959 N/A ARG 27.A N ARG 2.A O no hydrogen 2.980 N/A VAL 29.A N ALA 4.A O no hydrogen 2.772 N/A ALA 30.A N ILE 54.A O no hydrogen 2.769 N/A GLY 31.A N VAL 6.A O no hydrogen 2.796 N/A CYS 32.A N SER 56.A O no hydrogen 3.041 N/A CYS 32.A SG GLY 33.A O no hydrogen 3.482 N/A ASN 35.A N GLU 57.A OE1 no hydrogen 3.037 N/A SER 36.A N GLU 57.A OE2 no hydrogen 3.305 N/A ARG 38.A N SER 36.A OG no hydrogen 3.269 N/A TRP 42.A N ARG 38.A O no hydrogen 2.900 N/A TRP 42.A NE1 THR 15.A OG1 no hydrogen 2.977 N/A LEU 43.A N ARG 39.A O no hydrogen 2.971 N/A GLU 44.A N GLU 40.A O no hydrogen 3.439 N/A GLN 45.A N LYS 41.A O no hydrogen 2.977 N/A GLN 46.A N TRP 42.A O no hydrogen 2.960 N/A LYS 47.A N LEU 43.A O no hydrogen 2.886 N/A LYS 47.A NZ ASP 52.A OD1 no hydrogen 2.808 N/A ALA 48.A N GLU 44.A O no hydrogen 2.984 N/A LEU 49.A N GLN 45.A O no hydrogen 3.277 N/A LEU 49.A N GLN 46.A O no hydrogen 3.091 N/A GLY 50.A N LYS 47.A O no hydrogen 3.022 N/A PHE 51.A N GLN 46.A O no hydrogen 2.938 N/A ILE 54.A N VAL 28.A O no hydrogen 3.184 N/A SER 56.A N ALA 30.A O no hydrogen 2.918 N/A SER 56.A OG TYR 5.A OH no hydrogen 2.742 N/A GLY 58.A N CYS 32.A O no hydrogen 3.073 N/A ASN 59.A N SER 65.A OG no hydrogen 2.728 N/A ALA 61.A N ASN 59.A OD1 no hydrogen 3.005 N/A ASP 62.A N ASN 59.A O no hydrogen 2.878 N/A SER 65.A N ASP 62.A OD1 no hydrogen 2.754 N/A THR 66.A N ASP 62.A O no hydrogen 3.021 N/A THR 66.A OG1 ASN 59.A O no hydrogen 2.818 N/A THR 66.A OG1 ASP 62.A O no hydrogen 2.800 N/A LYS 67.A N TRP 63.A O no hydrogen 2.725 N/A THR 68.A N ASP 64.A O no hydrogen 2.979 N/A THR 68.A OG1 ASP 64.A O no hydrogen 2.787 N/A ALA 69.A N SER 65.A O no hydrogen 3.141 N/A PHE 70.A N THR 66.A O no hydrogen 3.052 N/A ASP 71.A N LYS 67.A O no hydrogen 2.851 N/A LYS 72.A N THR 68.A O no hydrogen 2.952 N/A LYS 72.A NZ GLU 76.A OE1 no hydrogen 3.475 N/A LYS 72.A NZ GLU 76.A OE2 no hydrogen 2.766 N/A VAL 73.A N ALA 69.A O no hydrogen 3.130 N/A LYS 74.A N PHE 70.A O no hydrogen 2.921 N/A LYS 74.A NZ GLN 120.A O no hydrogen 2.840 N/A SER 75.A N ASP 71.A O no hydrogen 3.151 N/A SER 75.A OG ASP 71.A O no hydrogen 3.342 N/A SER 75.A OG LYS 72.A O no hydrogen 3.214 N/A GLU 76.A N LYS 72.A O no hydrogen 2.998 N/A VAL 77.A N VAL 73.A O no hydrogen 2.726 N/A GLY 78.A N VAL 73.A O no hydrogen 2.879 N/A ASP 81.A N ILE 3.A O no hydrogen 2.862 N/A VAL 82.A N ILE 3.A O no hydrogen 3.076 N/A LEU 83.A N ARG 132.A O no hydrogen 2.846 N/A ILE 84.A N TYR 5.A O no hydrogen 2.810 N/A ASN 85.A N VAL 134.A O no hydrogen 2.906 N/A ASN 85.A ND2 THR 118.A OG1 no hydrogen 3.257 N/A ASN 85.A ND2 ASN 135.A OD1 no hydrogen 2.824 N/A ASN 86.A N THR 7.A OG1 no hydrogen 2.968 N/A ASN 86.A ND2 GLY 8.A O no hydrogen 2.947 N/A ALA 87.A N THR 7.A OG1 no hydrogen 3.022 N/A ILE 89.A N THR 109.A OG1 no hydrogen 3.236 N/A ARG 91.A NE ASP 102.A OD1 no hydrogen 3.143 N/A ARG 91.A NH2 ASP 102.A OD1 no hydrogen 2.695 N/A VAL 93.A N GLY 147.A O no hydrogen 2.923 N/A LYS 97.A N VAL 94.A O no hydrogen 2.971 N/A MET 98.A N PHE 95.A O no hydrogen 3.275 N/A THR 99.A N ASP 102.A OD2 no hydrogen 3.158 N/A ARG 100.A NE ASP 104.A OD1 no hydrogen 3.125 N/A ARG 100.A NE ASP 104.A OD2 no hydrogen 3.136 N/A ARG 100.A NH2 ASP 104.A OD2 no hydrogen 3.114 N/A ASP 102.A N THR 99.A OG1 no hydrogen 3.243 N/A TRP 103.A N THR 99.A O no hydrogen 3.118 N/A ASP 104.A N ARG 100.A O no hydrogen 2.709 N/A ALA 105.A N ALA 101.A O no hydrogen 3.108 N/A ILE 107.A N TRP 103.A O no hydrogen 3.078 N/A ASP 108.A N ASP 104.A O no hydrogen 2.743 N/A THR 109.A N ALA 105.A O no hydrogen 3.273 N/A THR 109.A OG1 ALA 105.A O no hydrogen 2.884 N/A THR 109.A OG1 VAL 106.A O no hydrogen 3.438 N/A ASN 110.A N VAL 106.A O no hydrogen 3.073 N/A ASN 110.A ND2 ILE 89.A O no hydrogen 3.255 N/A ASN 110.A ND2 VAL 106.A O no hydrogen 2.690 N/A LEU 111.A N ILE 107.A O no hydrogen 2.805 N/A THR 112.A N ILE 107.A O no hydrogen 3.203 N/A THR 112.A OG1 ASP 108.A OD1 no hydrogen 3.341 N/A SER 113.A OG THR 109.A O no hydrogen 2.729 N/A ASN 116.A N THR 112.A O no hydrogen 2.968 N/A ASN 116.A ND2 VAL 60.A O no hydrogen 2.968 N/A VAL 117.A N SER 113.A O no hydrogen 2.805 N/A THR 118.A N LEU 114.A O no hydrogen 3.364 N/A THR 118.A OG1 LEU 114.A O no hydrogen 2.686 N/A LYS 119.A N PHE 115.A O no hydrogen 3.090 N/A GLN 120.A N VAL 117.A O no hydrogen 3.087 N/A GLN 120.A NE2 ASN 116.A O no hydrogen 3.103 N/A VAL 121.A N THR 118.A O no hydrogen 3.189 N/A ILE 122.A N THR 118.A O no hydrogen 3.057 N/A MET 125.A N VAL 121.A O no hydrogen 3.292 N/A ALA 126.A N ILE 122.A O no hydrogen 3.148 N/A ASP 127.A N ASP 123.A O no hydrogen 2.909 N/A ARG 128.A N GLY 124.A O no hydrogen 3.008 N/A ARG 128.A NH1 GLU 79.A OE1 no hydrogen 3.182 N/A GLY 129.A N MET 125.A O no hydrogen 2.984 N/A GLY 129.A N ALA 126.A O no hydrogen 3.236 N/A TRP 130.A N MET 125.A O no hydrogen 3.165 N/A GLY 131.A N GLY 173.A O no hydrogen 3.254 N/A ARG 132.A N ASP 81.A O no hydrogen 3.025 N/A ARG 132.A NE LEU 222.A O no hydrogen 3.044 N/A ARG 132.A NE SER 224.A O no hydrogen 3.240 N/A ARG 132.A NE SER 227.A OG no hydrogen 3.392 N/A ARG 132.A NH1 GLY 131.A O no hydrogen 3.032 N/A ARG 132.A NH2 SER 224.A O no hydrogen 3.114 N/A ILE 133.A N THR 175.A O no hydrogen 2.918 N/A VAL 134.A N LEU 83.A O no hydrogen 2.862 N/A ASN 135.A N ASN 177.A O no hydrogen 2.841 N/A ASN 135.A ND2 THR 162.A OG1 no hydrogen 2.789 N/A ILE 136.A N ASN 85.A O no hydrogen 3.075 N/A SER 137.A N VAL 179.A O no hydrogen 2.735 N/A SER 137.A OG LYS 155.A O no hydrogen 2.700 N/A VAL 139.A N PRO 181.A O no hydrogen 3.038 N/A ASN 140.A N SER 138.A OG no hydrogen 3.049 N/A ASN 140.A ND2 GLN 148.A OE1 no hydrogen 2.632 N/A ASN 140.A ND2 TYR 183.A OH no hydrogen 3.248 N/A GLY 141.A N SER 138.A O no hydrogen 2.953 N/A GLN 142.A N VAL 139.A O no hydrogen 2.985 N/A GLN 142.A NE2 ASP 234.A OD2 no hydrogen 2.696 N/A GLN 142.A NE2 SER 236.A OG no hydrogen 3.072 N/A LYS 143.A N VAL 139.A O no hydrogen 2.950 N/A LYS 143.A NZ ASN 140.A OD1 no hydrogen 3.173 N/A LYS 143.A NZ GLY 144.A O no hydrogen 3.125 N/A GLY 144.A N ASN 140.A O no hydrogen 2.846 N/A GLN 148.A N GLN 145.A O no hydrogen 2.907 N/A GLN 148.A NE2 ASP 92.A OD1 no hydrogen 3.033 N/A ASN 150.A ND2 ARG 91.A O no hydrogen 2.972 N/A ASN 150.A ND2 ASP 102.A O no hydrogen 3.172 N/A TYR 151.A N ASN 150.A OD1 no hydrogen 2.685 N/A SER 152.A N GLN 148.A O no hydrogen 2.768 N/A SER 152.A OG ASN 140.A O no hydrogen 3.097 N/A SER 152.A OG GLN 148.A O no hydrogen 2.888 N/A THR 153.A N THR 149.A O no hydrogen 3.381 N/A THR 153.A OG1 THR 149.A O no hydrogen 2.537 N/A ALA 154.A N ASN 150.A O no hydrogen 3.049 N/A LYS 155.A N TYR 151.A O no hydrogen 2.919 N/A LYS 155.A NZ ASN 110.A OD1 no hydrogen 3.001 N/A LYS 155.A NZ ILE 136.A O no hydrogen 2.934 N/A ALA 156.A N SER 152.A O no hydrogen 3.056 N/A GLY 157.A N THR 153.A O no hydrogen 2.953 N/A LEU 158.A N ALA 154.A O no hydrogen 3.045 N/A HIS 159.A N ALA 156.A O no hydrogen 3.163 N/A HIS 159.A ND1 THR 178.A OG1 no hydrogen 2.970 N/A PHE 161.A N GLY 157.A O no hydrogen 3.105 N/A THR 162.A N LEU 158.A O no hydrogen 3.048 N/A THR 162.A OG1 LEU 158.A O no hydrogen 3.333 N/A THR 162.A OG1 THR 178.A OG1 no hydrogen 2.657 N/A MET 163.A N HIS 159.A O no hydrogen 2.917 N/A ALA 164.A N GLY 160.A O no hydrogen 3.053 N/A LEU 165.A N PHE 161.A O no hydrogen 2.898 N/A ALA 166.A N THR 162.A O no hydrogen 3.009 N/A GLN 167.A N MET 163.A O no hydrogen 3.374 N/A GLN 167.A N ALA 164.A O no hydrogen 3.275 N/A GLN 167.A NE2 MET 163.A O no hydrogen 3.496 N/A GLU 168.A N LEU 165.A O no hydrogen 3.037 N/A LYS 172.A N VAL 169.A O no hydrogen 3.040 N/A THR 175.A N GLY 131.A O no hydrogen 3.204 N/A VAL 176.A N THR 231.A OG1 no hydrogen 3.033 N/A ASN 177.A N ILE 133.A O no hydrogen 2.939 N/A ASN 177.A ND2 SER 230.A O no hydrogen 2.812 N/A THR 178.A N ALA 233.A O no hydrogen 2.839 N/A THR 178.A OG1 HIS 159.A ND1 no hydrogen 2.970 N/A THR 178.A OG1 THR 162.A OG1 no hydrogen 2.657 N/A VAL 179.A N ASN 135.A O no hydrogen 2.962 N/A SER 180.A N PHE 235.A O no hydrogen 2.758 N/A SER 180.A OG ASP 234.A OD1 no hydrogen 2.816 N/A SER 180.A OG ASP 234.A OD2 no hydrogen 3.409 N/A GLY 182.A N LEU 237.A O no hydrogen 2.848 N/A ALA 185.A N GLY 210.A O no hydrogen 2.636 N/A THR 186.A N ILE 184.A O no hydrogen 2.740 N/A LYS 190.A N THR 186.A O no hydrogen 2.808 N/A ALA 191.A N MET 188.A O no hydrogen 3.208 N/A ILE 192.A N VAL 189.A O no hydrogen 3.073 N/A GLN 194.A NE2 ASP 198.A OD2 no hydrogen 3.401 N/A LEU 197.A N ARG 193.A O no hydrogen 2.768 N/A ASP 198.A N GLN 194.A O no hydrogen 2.790 N/A LYS 199.A N ASP 195.A O no hydrogen 3.429 N/A ILE 200.A N VAL 196.A O no hydrogen 3.286 N/A VAL 201.A N LEU 197.A O no hydrogen 3.002 N/A ALA 202.A N ASP 198.A O no hydrogen 3.048 N/A THR 203.A N LYS 199.A O no hydrogen 3.219 N/A THR 203.A N ILE 200.A O no hydrogen 3.036 N/A THR 203.A OG1 ILE 200.A O no hydrogen 2.278 N/A ILE 204.A N VAL 201.A O no hydrogen 2.999 N/A LYS 207.A N ILE 204.A O no hydrogen 2.762 N/A LYS 207.A NZ ALA 202.A O no hydrogen 2.603 N/A ARG 208.A NH1 LEU 209.A O no hydrogen 3.042 N/A ARG 208.A NH1 GLU 214.A OE1 no hydrogen 3.188 N/A ARG 208.A NH2 GLU 214.A OE2 no hydrogen 2.794 N/A GLY 210.A N TYR 183.A O no hydrogen 2.792 N/A LEU 211.A N GLU 214.A OE1 no hydrogen 2.847 N/A GLU 214.A N LEU 211.A O no hydrogen 2.954 N/A ILE 215.A N LEU 211.A O no hydrogen 3.457 N/A ALA 216.A N PRO 212.A O no hydrogen 2.942 N/A SER 217.A N GLU 213.A O no hydrogen 2.857 N/A CYS 219.A N ILE 215.A O no hydrogen 3.277 N/A CYS 219.A SG ILE 215.A O no hydrogen 3.347 N/A ALA 220.A N ALA 216.A O no hydrogen 2.919 N/A TRP 221.A N SER 217.A O no hydrogen 3.125 N/A LEU 222.A N ILE 218.A O no hydrogen 3.011 N/A SER 223.A N CYS 219.A O no hydrogen 2.876 N/A SER 223.A OG CYS 219.A O no hydrogen 2.784 N/A SER 224.A N TRP 221.A O no hydrogen 3.252 N/A SER 224.A OG TRP 221.A O no hydrogen 2.656 N/A GLU 226.A N SER 224.A OG no hydrogen 3.343 N/A SER 227.A OG TRP 221.A O no hydrogen 3.305 N/A SER 227.A OG LEU 222.A O no hydrogen 2.665 N/A SER 227.A OG SER 224.A O no hydrogen 3.181 N/A SER 230.A N SER 227.A O no hydrogen 3.114 N/A SER 230.A OG ASN 177.A OD1 no hydrogen 3.366 N/A GLY 232.A N VAL 176.A O no hydrogen 2.648 N/A ALA 233.A N ASN 177.A OD1 no hydrogen 3.060 N/A PHE 235.A N THR 178.A O no hydrogen 2.701 N/A LEU 237.A N SER 180.A O no hydrogen 3.229 N/A ASN 238.A ND2 HIS 242.A O no hydrogen 3.066 N/A GLY 240.A N ASN 238.A OD1 no hydrogen 2.803 N/A LEU 241.A N ASN 238.A O no hydrogen 3.259 N/A