Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7xwl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A N GLY 27.A O no hydrogen 3.014 N/A THR 4.A N ASP 81.A OD2 no hydrogen 2.929 N/A TYR 5.A N LYS 29.A O no hydrogen 2.849 N/A PHE 6.A N VAL 82.A O no hydrogen 2.916 N/A ILE 7.A N ILE 31.A O no hydrogen 2.862 N/A SER 8.A N VAL 84.A O no hydrogen 3.199 N/A GLY 9.A N THR 33.A OG1 no hydrogen 3.165 N/A ALA 10.A N THR 33.A O no hydrogen 2.696 N/A PHE 16.A N ARG 12.A O no hydrogen 3.309 N/A SER 17.A N GLY 13.A O no hydrogen 3.214 N/A VAL 18.A N ILE 14.A O no hydrogen 2.744 N/A VAL 19.A N GLY 15.A O no hydrogen 3.035 N/A GLN 20.A N PHE 16.A O no hydrogen 2.823 N/A GLN 20.A NE2 GLN 20.A O no hydrogen 3.462 N/A ARG 21.A N SER 17.A O no hydrogen 2.858 N/A ARG 21.A NH1 ARG 21.A O no hydrogen 2.791 N/A LEU 22.A N VAL 18.A O no hydrogen 2.845 N/A ALA 23.A N VAL 19.A O no hydrogen 2.752 N/A ALA 24.A N ARG 21.A O no hydrogen 3.233 N/A LYS 25.A N LEU 22.A O no hydrogen 3.057 N/A LYS 29.A N GLN 3.A O no hydrogen 2.910 N/A LYS 29.A NZ TYR 76.A O no hydrogen 2.927 N/A VAL 30.A N GLN 52.A O no hydrogen 2.881 N/A ILE 31.A N TYR 5.A O no hydrogen 2.714 N/A ALA 32.A N LYS 54.A O no hydrogen 2.807 N/A THR 33.A N ILE 7.A O no hydrogen 3.054 N/A ALA 34.A N VAL 56.A O no hydrogen 3.196 N/A SER 39.A N ASP 36.A O no hydrogen 3.198 N/A SER 39.A OG ASP 36.A O no hydrogen 3.257 N/A SER 39.A OG ASP 36.A OD2 no hydrogen 3.120 N/A ALA 40.A N PRO 37.A O no hydrogen 2.924 N/A ASN 44.A N ALA 40.A O no hydrogen 2.862 N/A ASN 44.A ND2 PRO 37.A O no hydrogen 2.761 N/A GLU 45.A N THR 41.A O no hydrogen 3.035 N/A LEU 46.A N ALA 42.A O no hydrogen 3.001 N/A ALA 47.A N LEU 43.A O no hydrogen 3.009 N/A LYS 48.A N ASN 44.A O no hydrogen 2.673 N/A LYS 48.A NZ GLU 45.A OE1 no hydrogen 3.402 N/A GLU 49.A N GLU 45.A O no hydrogen 3.139 N/A ASN 50.A N LEU 46.A O no hydrogen 2.845 N/A ASN 50.A ND2 LEU 46.A O no hydrogen 2.981 N/A GLN 52.A NE2 ALA 23.A O no hydrogen 2.964 N/A VAL 53.A N ASN 50.A O no hydrogen 2.985 N/A LYS 54.A N VAL 30.A O no hydrogen 2.888 N/A LYS 54.A NZ PRO 51.A O no hydrogen 2.708 N/A VAL 56.A N ALA 32.A O no hydrogen 2.907 N/A GLN 57.A NE2.A ARG 35.A O no hydrogen 2.904 N/A GLN 57.A NE2.B ARG 35.A O no hydrogen 3.213 N/A LEU 58.A N ALA 34.A O no hydrogen 3.094 N/A ASP 59.A N SER 65.A OG no hydrogen 2.864 N/A SER 61.A N ASP 59.A OD1 no hydrogen 2.964 N/A SER 61.A OG ASP 59.A OD1 no hydrogen 2.699 N/A ASP 62.A N ASP 59.A O no hydrogen 3.017 N/A GLU 64.A N ASP 62.A OD1 no hydrogen 3.055 N/A SER 65.A OG GLN 57.A OE1.A no hydrogen 2.953 N/A ILE 66.A N ASP 62.A O no hydrogen 3.013 N/A LYS 67.A N GLU 63.A O no hydrogen 2.833 N/A LYS 67.A NZ GLU 63.A OE2 no hydrogen 2.574 N/A LYS 68.A N SER 65.A O no hydrogen 3.127 N/A ILE 69.A N ILE 66.A O no hydrogen 3.172 N/A ASN 72.A N LYS 68.A O no hydrogen 3.114 N/A VAL 73.A N ILE 69.A O no hydrogen 2.862 N/A SER 74.A N ALA 70.A O no hydrogen 2.985 N/A SER 74.A OG ALA 70.A O no hydrogen 2.765 N/A GLN 75.A N ASN 72.A O no hydrogen 3.167 N/A TYR 76.A N VAL 73.A O no hydrogen 2.962 N/A THR 77.A OG1 SER 79.A O no hydrogen 2.792 N/A SER 79.A N THR 77.A OG1 no hydrogen 3.306 N/A ILE 80.A N LEU 125.A O no hydrogen 2.979 N/A ASP 81.A N THR 4.A O no hydrogen 2.805 N/A VAL 82.A N THR 4.A O no hydrogen 3.246 N/A PHE 83.A N LYS 133.A O no hydrogen 2.887 N/A VAL 84.A N PHE 6.A O no hydrogen 2.797 N/A SER 85.A N PHE 135.A O no hydrogen 2.823 N/A ASN 86.A N SER 8.A OG no hydrogen 2.764 N/A ASN 86.A ND2 SER 8.A O no hydrogen 3.110 N/A ALA 87.A N SER 8.A O no hydrogen 3.153 N/A ALA 87.A N SER 8.A OG no hydrogen 3.024 N/A ILE 89.A N ASN 111.A OD1 no hydrogen 2.849 N/A LYS 91.A N HIS 107.A NE2 no hydrogen 3.099 N/A LYS 91.A NZ GLU 106.A OE2 no hydrogen 2.753 N/A SER 92.A OG GLN 103.A OE1 no hydrogen 2.542 N/A SER 92.A OG SER 153.A OG no hydrogen 2.970 N/A GLY 94.A N ASP 151.A O no hydrogen 3.206 N/A ASN 98.A N PRO 95.A O no hydrogen 3.109 N/A THR 99.A N LEU 96.A O no hydrogen 3.250 N/A THR 99.A OG1 PRO 95.A O no hydrogen 2.841 N/A THR 99.A OG1 SER 153.A OG no hydrogen 2.838 N/A GLU 102.A N GLU 102.A OE2 no hydrogen 2.827 N/A GLN 103.A N PRO 100.A O no hydrogen 3.106 N/A TRP 104.A NE1 THR 99.A O no hydrogen 3.017 N/A ILE 105.A N ARG 101.A O no hydrogen 3.135 N/A GLU 106.A N GLU 102.A O no hydrogen 2.933 N/A HIS 107.A N GLN 103.A O no hydrogen 3.196 N/A HIS 107.A ND1 GLN 103.A O no hydrogen 2.783 N/A PHE 108.A N TRP 104.A O no hydrogen 3.115 N/A PHE 109.A N ILE 105.A O no hydrogen 3.000 N/A THR 110.A N GLU 106.A O no hydrogen 2.944 N/A THR 110.A OG1 GLU 106.A O no hydrogen 3.250 N/A ASN 111.A N HIS 107.A O no hydrogen 2.761 N/A ASN 111.A ND2 ILE 89.A O no hydrogen 2.691 N/A ASN 111.A ND2 SER 158.A OG no hydrogen 2.962 N/A VAL 112.A N PHE 108.A O no hydrogen 2.936 N/A LEU 113.A N PHE 108.A O no hydrogen 3.004 N/A GLY 114.A N PHE 109.A O no hydrogen 2.896 N/A ILE 116.A N VAL 112.A O no hydrogen 3.213 N/A ARG 117.A N LEU 113.A O no hydrogen 2.766 N/A ARG 117.A NE GLU 63.A OE1 no hydrogen 2.948 N/A ARG 117.A NE GLU 63.A OE2 no hydrogen 3.392 N/A ARG 117.A NH1 GLN 120.A OE1 no hydrogen 2.902 N/A ARG 117.A NH1 GLU 121.A OE2 no hydrogen 3.066 N/A ARG 117.A NH2 GLU 63.A OE2 no hydrogen 2.764 N/A ARG 117.A NH2 GLU 121.A OE2 no hydrogen 3.137 N/A LEU 118.A N GLY 114.A O no hydrogen 2.794 N/A PHE 119.A N PRO 115.A O no hydrogen 2.854 N/A GLN 120.A N ILE 116.A O no hydrogen 2.907 N/A GLU 121.A N ARG 117.A O no hydrogen 2.976 N/A LEU 122.A N LEU 118.A O no hydrogen 3.101 N/A LEU 122.A N PHE 119.A O no hydrogen 3.065 N/A TYR 123.A OH GLU 176.A OE1 no hydrogen 2.359 N/A ILE 126.A N LEU 122.A O no hydrogen 3.035 N/A LYS 127.A N TYR 123.A O no hydrogen 2.646 N/A LYS 128.A N PRO 124.A O no hydrogen 3.150 N/A GLY 129.A N ILE 126.A O no hydrogen 2.898 N/A THR 130.A N ASP 81.A OD1 no hydrogen 3.097 N/A GLN 131.A N ASP 81.A OD1 no hydrogen 2.981 N/A LYS 132.A NZ LYS 127.A O no hydrogen 3.101 N/A LYS 132.A NZ GLY 129.A O no hydrogen 2.848 N/A LYS 133.A N ASP 81.A O no hydrogen 2.902 N/A LYS 133.A NZ PHE 204.A O no hydrogen 2.788 N/A LYS 133.A NZ GLU 205.A O no hydrogen 2.988 N/A LYS 133.A NZ LEU 207.A O no hydrogen 2.730 N/A VAL 134.A N ILE 179.A O no hydrogen 2.782 N/A PHE 135.A N PHE 83.A O no hydrogen 2.699 N/A PHE 136.A N ALA 181.A O no hydrogen 2.875 N/A ILE 137.A N SER 85.A O no hydrogen 2.894 N/A SER 138.A N VAL 183.A O no hydrogen 2.834 N/A SER 138.A OG SER 139.A O no hydrogen 3.331 N/A SER 138.A OG ASN 163.A OD1 no hydrogen 2.748 N/A SER 139.A N SER 138.A OG no hydrogen 2.697 N/A ASN 140.A N HIS 184.A ND1 no hydrogen 3.117 N/A ALA 141.A N SER 139.A OG no hydrogen 2.918 N/A GLY 142.A N SER 139.A O no hydrogen 3.149 N/A SER 143.A N ASN 140.A O no hydrogen 3.328 N/A SER 143.A OG PRO 222.A O no hydrogen 2.607 N/A LEU 144.A N TRP 223.A O no hydrogen 2.752 N/A ASN 145.A N SER 143.A OG no hydrogen 2.993 N/A GLY 149.A N ASP 147.A OD1 no hydrogen 2.959 N/A SER 153.A OG SER 92.A OG no hydrogen 2.970 N/A SER 153.A OG THR 99.A OG1 no hydrogen 2.838 N/A PHE 155.A N SER 92.A O no hydrogen 3.478 N/A GLY 156.A N PHE 152.A O no hydrogen 2.913 N/A GLN 157.A N SER 153.A O no hydrogen 3.040 N/A SER 158.A N ALA 154.A O no hydrogen 2.993 N/A SER 158.A OG ALA 154.A O no hydrogen 3.478 N/A SER 158.A OG PHE 155.A O no hydrogen 2.854 N/A LYS 159.A N PHE 155.A O no hydrogen 3.143 N/A LYS 159.A NZ ILE 137.A O no hydrogen 2.817 N/A ALA 160.A N GLY 156.A O no hydrogen 2.921 N/A ALA 161.A N GLN 157.A O no hydrogen 2.813 N/A LEU 162.A N SER 158.A O no hydrogen 2.920 N/A ASN 163.A N LYS 159.A O no hydrogen 2.920 N/A TYR 164.A N ALA 160.A O no hydrogen 2.885 N/A SER 165.A N ALA 161.A O no hydrogen 3.248 N/A THR 166.A N LEU 162.A O no hydrogen 2.734 N/A THR 166.A OG1 LEU 162.A O no hydrogen 2.665 N/A LYS 167.A N ASN 163.A O no hydrogen 2.964 N/A GLU 168.A N TYR 164.A O no hydrogen 3.225 N/A LEU 169.A N SER 165.A O no hydrogen 2.997 N/A ALA 170.A N THR 166.A O no hydrogen 2.930 N/A ARG 171.A N LYS 167.A O no hydrogen 3.410 N/A ARG 171.A NH2 GLU 168.A OE2 no hydrogen 3.429 N/A GLN 172.A N GLU 168.A O no hydrogen 2.952 N/A LEU 173.A N LEU 169.A O no hydrogen 2.902 N/A LYS 174.A N ARG 171.A O no hydrogen 3.329 N/A GLU 176.A N LEU 173.A O no hydrogen 3.193 N/A ASN 177.A N LYS 174.A O no hydrogen 2.935 N/A PHE 178.A N LEU 173.A O no hydrogen 3.155 N/A ILE 179.A N LYS 132.A O no hydrogen 2.918 N/A VAL 180.A N THR 210.A OG1 no hydrogen 2.759 N/A ALA 181.A N VAL 134.A O no hydrogen 2.992 N/A ALA 182.A N LYS 212.A O no hydrogen 3.184 N/A VAL 183.A N PHE 136.A O no hydrogen 2.862 N/A HIS 184.A N LEU 214.A O no hydrogen 2.675 N/A ILE 191.A N PHE 187.A O no hydrogen 2.870 N/A THR 192.A N GLU 195.A OE2 no hydrogen 3.004 N/A THR 192.A OG1 GLU 195.A OE2 no hydrogen 3.334 N/A GLU 194.A N GLU 194.A OE1 no hydrogen 2.745 N/A GLU 195.A N THR 192.A OG1 no hydrogen 3.097 N/A SER 196.A N THR 192.A O no hydrogen 2.989 N/A SER 196.A OG PRO 185.A O no hydrogen 2.675 N/A ALA 197.A N PRO 193.A O no hydrogen 2.819 N/A ALA 198.A N GLU 194.A O no hydrogen 2.981 N/A ALA 199.A N GLU 195.A O no hydrogen 3.098 N/A LEU 200.A N SER 196.A O no hydrogen 2.716 N/A CYS 201.A N ALA 197.A O no hydrogen 2.852 N/A CYS 201.A SG VAL 18.A O no hydrogen 4.044 N/A CYS 201.A SG ALA 197.A O no hydrogen 3.240 N/A LYS 202.A N ALA 198.A O no hydrogen 3.192 N/A LYS 202.A NZ TYR 216.A O no hydrogen 2.679 N/A LEU 203.A N ALA 199.A O no hydrogen 3.122 N/A PHE 204.A N LEU 200.A O no hydrogen 2.904 N/A GLU 205.A N CYS 201.A O no hydrogen 3.216 N/A SER 206.A N LYS 202.A O no hydrogen 2.963 N/A SER 206.A OG LYS 202.A O no hydrogen 3.005 N/A SER 206.A OG LEU 203.A O no hydrogen 3.411 N/A LEU 207.A N LEU 203.A O no hydrogen 2.795 N/A THR 210.A OG1 PHE 178.A O no hydrogen 3.527 N/A THR 210.A OG1 VAL 180.A O no hydrogen 3.384 N/A GLY 211.A N VAL 180.A O no hydrogen 2.848 N/A TYR 213.A OH SER 139.A O no hydrogen 2.538 N/A LEU 214.A N ALA 182.A O no hydrogen 2.845 N/A SER 215.A N THR 219.A O no hydrogen 2.876 N/A GLY 218.A N SER 215.A O no hydrogen 2.844 N/A THR 219.A N ASP 217.A OD1 no hydrogen 3.004 N/A THR 219.A OG1 ASP 217.A OD1 no hydrogen 2.549 N/A THR 219.A OG1 ASP 217.A OD2 no hydrogen 3.498 N/A LEU 221.A N TYR 213.A O no hydrogen 2.808 N/A