Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7xwk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 3.A N GLY 27.A O no hydrogen 3.140 N/A THR 4.A N ASP 81.A OD2 no hydrogen 2.995 N/A TYR 5.A N LYS 29.A O no hydrogen 2.949 N/A PHE 6.A N VAL 82.A O no hydrogen 2.853 N/A ILE 7.A N ILE 31.A O no hydrogen 2.947 N/A SER 8.A N VAL 84.A O no hydrogen 3.144 N/A GLY 9.A N THR 33.A OG1 no hydrogen 3.373 N/A ALA 10.A N THR 33.A O no hydrogen 2.881 N/A PHE 16.A N ARG 12.A O no hydrogen 3.238 N/A SER 17.A N GLY 13.A O no hydrogen 3.097 N/A VAL 18.A N ILE 14.A O no hydrogen 2.685 N/A VAL 19.A N GLY 15.A O no hydrogen 3.022 N/A GLN 20.A N PHE 16.A O no hydrogen 2.775 N/A GLN 20.A NE2 GLN 20.A O no hydrogen 3.247 N/A ARG 21.A N SER 17.A O no hydrogen 2.786 N/A LEU 22.A N VAL 18.A O no hydrogen 2.682 N/A ALA 23.A N VAL 19.A O no hydrogen 2.703 N/A ALA 24.A N GLN 20.A O no hydrogen 3.395 N/A LYS 25.A N LEU 22.A O no hydrogen 2.996 N/A LYS 25.A NZ GLU 205.A OE1 no hydrogen 2.744 N/A LYS 29.A N GLN 3.A O no hydrogen 2.794 N/A LYS 29.A NZ TYR 76.A O no hydrogen 2.804 N/A VAL 30.A N GLN 52.A O no hydrogen 2.751 N/A ILE 31.A N TYR 5.A O no hydrogen 2.797 N/A ALA 32.A N LYS 54.A O no hydrogen 2.805 N/A THR 33.A N ILE 7.A O no hydrogen 3.154 N/A ALA 34.A N VAL 56.A O no hydrogen 3.071 N/A SER 39.A N ASP 36.A O no hydrogen 3.296 N/A SER 39.A OG ASP 36.A OD2 no hydrogen 3.351 N/A ALA 40.A N PRO 37.A O no hydrogen 2.839 N/A THR 41.A OG1 SER 39.A O no hydrogen 3.540 N/A ASN 44.A N ALA 40.A O no hydrogen 2.864 N/A ASN 44.A ND2 PRO 37.A O no hydrogen 2.650 N/A GLU 45.A N THR 41.A O no hydrogen 3.002 N/A LEU 46.A N ALA 42.A O no hydrogen 2.917 N/A ALA 47.A N LEU 43.A O no hydrogen 2.832 N/A LYS 48.A N ASN 44.A O no hydrogen 2.669 N/A LYS 48.A NZ GLU 45.A OE1 no hydrogen 2.933 N/A GLU 49.A N GLU 45.A O no hydrogen 3.054 N/A ASN 50.A N LEU 46.A O no hydrogen 2.797 N/A GLN 52.A N ASN 50.A OD1 no hydrogen 3.136 N/A VAL 53.A N ASN 50.A O no hydrogen 3.004 N/A LYS 54.A N VAL 30.A O no hydrogen 2.866 N/A LYS 54.A NZ PRO 51.A O no hydrogen 2.812 N/A VAL 56.A N ALA 32.A O no hydrogen 2.931 N/A GLN 57.A NE2 ARG 35.A O no hydrogen 2.827 N/A LEU 58.A N ALA 34.A O no hydrogen 3.109 N/A ASP 59.A N SER 65.A OG no hydrogen 2.936 N/A SER 61.A N ASP 59.A OD1 no hydrogen 2.944 N/A SER 61.A OG ASP 59.A OD1 no hydrogen 2.671 N/A SER 61.A OG ASP 59.A OD2 no hydrogen 3.453 N/A ASP 62.A N ASP 59.A O no hydrogen 3.196 N/A GLU 64.A N ASP 62.A OD1 no hydrogen 3.013 N/A SER 65.A OG GLN 57.A OE1 no hydrogen 3.004 N/A ILE 66.A N ASP 62.A O no hydrogen 2.937 N/A LYS 67.A N GLU 63.A O no hydrogen 2.745 N/A LYS 67.A NZ GLU 63.A OE2 no hydrogen 3.080 N/A LYS 68.A N SER 65.A O no hydrogen 3.053 N/A ILE 69.A N ILE 66.A O no hydrogen 3.193 N/A ASN 72.A N LYS 68.A O no hydrogen 3.076 N/A VAL 73.A N ILE 69.A O no hydrogen 2.980 N/A SER 74.A N ALA 70.A O no hydrogen 3.062 N/A SER 74.A OG ALA 70.A O no hydrogen 2.810 N/A GLN 75.A N ASN 72.A O no hydrogen 3.316 N/A TYR 76.A N VAL 73.A O no hydrogen 2.943 N/A THR 77.A OG1 SER 79.A O no hydrogen 2.964 N/A SER 79.A N THR 77.A OG1 no hydrogen 3.192 N/A ILE 80.A N LEU 125.A O no hydrogen 3.010 N/A ASP 81.A N THR 4.A O no hydrogen 2.752 N/A VAL 82.A N THR 4.A O no hydrogen 3.255 N/A PHE 83.A N LYS 133.A O no hydrogen 2.935 N/A VAL 84.A N PHE 6.A O no hydrogen 2.721 N/A SER 85.A N PHE 135.A O no hydrogen 2.912 N/A ASN 86.A N SER 8.A OG no hydrogen 2.700 N/A ASN 86.A ND2 SER 8.A O no hydrogen 3.116 N/A ALA 87.A N SER 8.A O no hydrogen 3.129 N/A ALA 87.A N SER 8.A OG no hydrogen 2.828 N/A ILE 89.A N ASN 111.A OD1 no hydrogen 2.937 N/A LYS 91.A N HIS 107.A NE2 no hydrogen 3.200 N/A LYS 91.A NZ GLU 106.A OE2 no hydrogen 3.070 N/A SER 92.A OG GLN 103.A OE1 no hydrogen 2.723 N/A SER 92.A OG SER 153.A OG no hydrogen 3.141 N/A GLY 94.A N ASP 151.A O no hydrogen 2.805 N/A ASN 98.A N PRO 95.A O no hydrogen 3.209 N/A THR 99.A N LEU 96.A O no hydrogen 3.299 N/A THR 99.A OG1 PRO 95.A O no hydrogen 2.875 N/A THR 99.A OG1 SER 153.A OG no hydrogen 2.683 N/A GLU 102.A N GLU 102.A OE2 no hydrogen 3.007 N/A GLN 103.A N PRO 100.A O no hydrogen 2.963 N/A TRP 104.A NE1 THR 99.A O no hydrogen 2.965 N/A ILE 105.A N ARG 101.A O no hydrogen 3.119 N/A GLU 106.A N GLU 102.A O no hydrogen 2.974 N/A HIS 107.A N GLN 103.A O no hydrogen 3.082 N/A HIS 107.A ND1 GLN 103.A O no hydrogen 2.615 N/A PHE 108.A N TRP 104.A O no hydrogen 2.920 N/A PHE 109.A N ILE 105.A O no hydrogen 2.942 N/A THR 110.A N GLU 106.A O no hydrogen 2.904 N/A THR 110.A OG1 GLU 106.A O no hydrogen 3.129 N/A ASN 111.A N HIS 107.A O no hydrogen 2.773 N/A ASN 111.A ND2 ILE 89.A O no hydrogen 2.794 N/A ASN 111.A ND2 SER 158.A OG no hydrogen 2.955 N/A VAL 112.A N PHE 108.A O no hydrogen 2.985 N/A LEU 113.A N PHE 108.A O no hydrogen 2.943 N/A GLY 114.A N PHE 109.A O no hydrogen 2.937 N/A ILE 116.A N VAL 112.A O no hydrogen 3.156 N/A ARG 117.A N LEU 113.A O no hydrogen 2.778 N/A ARG 117.A NE GLU 63.A OE1 no hydrogen 3.044 N/A ARG 117.A NE GLU 63.A OE2 no hydrogen 3.414 N/A ARG 117.A NH1 GLN 120.A OE1 no hydrogen 2.702 N/A ARG 117.A NH1 GLU 121.A OE2 no hydrogen 3.122 N/A ARG 117.A NH2 GLU 63.A OE2 no hydrogen 2.823 N/A ARG 117.A NH2 GLU 121.A OE2 no hydrogen 3.044 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 2.849 N/A GLN 120.A N ILE 116.A O no hydrogen 2.994 N/A GLU 121.A N ARG 117.A O no hydrogen 2.950 N/A LEU 122.A N LEU 118.A O no hydrogen 3.013 N/A LEU 122.A N PHE 119.A O no hydrogen 3.061 N/A TYR 123.A OH GLU 176.A OE1 no hydrogen 2.478 N/A ILE 126.A N LEU 122.A O no hydrogen 3.117 N/A LYS 127.A N TYR 123.A O no hydrogen 2.844 N/A LYS 128.A N PRO 124.A O no hydrogen 3.185 N/A LYS 128.A NZ ASP 78.A O no hydrogen 2.887 N/A GLY 129.A N ILE 126.A O no hydrogen 2.870 N/A THR 130.A N ASP 81.A OD1 no hydrogen 3.052 N/A GLN 131.A N ASP 81.A OD1 no hydrogen 3.058 N/A LYS 132.A NZ LYS 127.A O no hydrogen 2.786 N/A LYS 132.A NZ GLY 129.A O no hydrogen 2.617 N/A LYS 133.A N ASP 81.A O no hydrogen 2.916 N/A LYS 133.A NZ PHE 204.A O no hydrogen 3.015 N/A VAL 134.A N ILE 179.A O no hydrogen 2.678 N/A PHE 135.A N PHE 83.A O no hydrogen 2.789 N/A PHE 136.A N ALA 181.A O no hydrogen 2.999 N/A ILE 137.A N SER 85.A O no hydrogen 2.827 N/A SER 138.A N VAL 183.A O no hydrogen 2.763 N/A SER 138.A OG SER 139.A O no hydrogen 3.447 N/A SER 138.A OG ASN 163.A OD1 no hydrogen 2.768 N/A SER 139.A N SER 138.A OG no hydrogen 2.559 N/A ASN 140.A N HIS 184.A ND1 no hydrogen 3.243 N/A ALA 141.A N SER 139.A OG no hydrogen 3.065 N/A GLY 142.A N SER 139.A O no hydrogen 3.068 N/A SER 143.A N ASN 140.A O no hydrogen 3.135 N/A SER 143.A OG PRO 222.A O no hydrogen 2.609 N/A ASN 145.A N SER 143.A OG no hydrogen 2.991 N/A ASN 145.A ND2 TRP 223.A O no hydrogen 2.870 N/A GLY 149.A N ASP 147.A OD1 no hydrogen 2.879 N/A SER 153.A OG SER 92.A OG no hydrogen 3.141 N/A SER 153.A OG THR 99.A OG1 no hydrogen 2.683 N/A PHE 155.A N SER 92.A O no hydrogen 3.432 N/A GLY 156.A N PHE 152.A O no hydrogen 2.895 N/A GLN 157.A N SER 153.A O no hydrogen 3.041 N/A SER 158.A N ALA 154.A O no hydrogen 3.060 N/A SER 158.A OG ALA 154.A O no hydrogen 3.420 N/A SER 158.A OG PHE 155.A O no hydrogen 2.833 N/A LYS 159.A N PHE 155.A O no hydrogen 3.114 N/A LYS 159.A NZ ILE 137.A O no hydrogen 2.856 N/A ALA 160.A N GLY 156.A O no hydrogen 2.979 N/A ALA 161.A N GLN 157.A O no hydrogen 2.901 N/A LEU 162.A N SER 158.A O no hydrogen 2.919 N/A ASN 163.A N LYS 159.A O no hydrogen 2.852 N/A ASN 163.A ND2 TYR 213.A OH no hydrogen 3.305 N/A TYR 164.A N ALA 160.A O no hydrogen 2.934 N/A TYR 164.A OH GLU 168.A OE2 no hydrogen 3.390 N/A SER 165.A N ALA 161.A O no hydrogen 3.268 N/A SER 165.A OG ALA 161.A O no hydrogen 3.546 N/A THR 166.A N LEU 162.A O no hydrogen 2.870 N/A THR 166.A OG1 LEU 162.A O no hydrogen 2.457 N/A LYS 167.A N ASN 163.A O no hydrogen 3.021 N/A GLU 168.A N TYR 164.A O no hydrogen 3.207 N/A LEU 169.A N SER 165.A O no hydrogen 2.873 N/A ALA 170.A N THR 166.A O no hydrogen 2.805 N/A ARG 171.A N LYS 167.A O no hydrogen 3.261 N/A GLN 172.A N GLU 168.A O no hydrogen 2.840 N/A LEU 173.A N LEU 169.A O no hydrogen 2.891 N/A LYS 174.A N ARG 171.A O no hydrogen 3.361 N/A GLU 176.A N LEU 173.A O no hydrogen 3.149 N/A ASN 177.A N LYS 174.A O no hydrogen 2.967 N/A PHE 178.A N LEU 173.A O no hydrogen 3.202 N/A ILE 179.A N LYS 132.A O no hydrogen 2.830 N/A VAL 180.A N THR 210.A OG1 no hydrogen 2.878 N/A ALA 181.A N VAL 134.A O no hydrogen 2.932 N/A ALA 182.A N LYS 212.A O no hydrogen 3.200 N/A VAL 183.A N PHE 136.A O no hydrogen 2.951 N/A HIS 184.A N LEU 214.A O no hydrogen 2.796 N/A ILE 191.A N VAL 187.A O no hydrogen 2.723 N/A THR 192.A N GLU 195.A OE2 no hydrogen 2.832 N/A THR 192.A OG1 GLU 195.A OE2 no hydrogen 3.248 N/A GLU 194.A N GLU 194.A OE1 no hydrogen 2.654 N/A GLU 195.A N THR 192.A O no hydrogen 3.190 N/A GLU 195.A N THR 192.A OG1 no hydrogen 3.142 N/A SER 196.A N THR 192.A O no hydrogen 3.059 N/A SER 196.A OG PRO 185.A O no hydrogen 2.578 N/A ALA 197.A N PRO 193.A O no hydrogen 2.928 N/A ALA 198.A N GLU 194.A O no hydrogen 2.980 N/A ALA 199.A N GLU 195.A O no hydrogen 3.096 N/A LEU 200.A N SER 196.A O no hydrogen 2.825 N/A CYS 201.A N ALA 197.A O no hydrogen 2.886 N/A CYS 201.A SG ALA 197.A O no hydrogen 3.281 N/A LYS 202.A N ALA 198.A O no hydrogen 3.255 N/A LEU 203.A N ALA 199.A O no hydrogen 3.108 N/A PHE 204.A N LEU 200.A O no hydrogen 2.895 N/A GLU 205.A N CYS 201.A O no hydrogen 3.204 N/A SER 206.A N LYS 202.A O no hydrogen 3.020 N/A SER 206.A N LEU 203.A O no hydrogen 3.100 N/A SER 206.A OG LYS 202.A O no hydrogen 3.300 N/A SER 206.A OG LEU 203.A O no hydrogen 3.341 N/A LEU 207.A N LEU 203.A O no hydrogen 2.829 N/A THR 210.A OG1 PHE 178.A O no hydrogen 3.441 N/A THR 210.A OG1 VAL 180.A O no hydrogen 3.530 N/A GLY 211.A N VAL 180.A O no hydrogen 2.664 N/A TYR 213.A OH SER 139.A O no hydrogen 2.703 N/A LEU 214.A N ALA 182.A O no hydrogen 2.820 N/A SER 215.A N THR 219.A O no hydrogen 2.894 N/A GLY 218.A N SER 215.A O no hydrogen 2.881 N/A THR 219.A N ASP 217.A OD1 no hydrogen 3.017 N/A THR 219.A OG1 ASP 217.A OD1 no hydrogen 2.465 N/A LEU 221.A N TYR 213.A O no hydrogen 2.960 N/A