Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5k52_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A OH HIS 119.A O no hydrogen 2.832 N/A GLN 4.A NE2 TYR 3.A O no hydrogen 2.942 N/A GLN 4.A NE2 LEU 65.A O no hydrogen 2.755 N/A SER 5.A N ASP 2.A O no hydrogen 3.222 N/A TYR 8.A N SER 5.A OG no hydrogen 3.378 N/A LYS 9.A N SER 5.A O no hydrogen 3.106 N/A LYS 9.A NZ ASN 66.A O no hydrogen 2.988 N/A ASP 10.A N GLU 6.A O no hydrogen 3.107 N/A ALA 11.A N THR 7.A O no hydrogen 2.941 N/A TYR 12.A N TYR 8.A O no hydrogen 2.737 N/A TYR 12.A OH TYR 116.A OH no hydrogen 2.714 N/A SER 13.A N LYS 9.A O no hydrogen 2.927 N/A SER 13.A OG ASP 10.A O no hydrogen 2.860 N/A ARG 14.A N ALA 11.A O no hydrogen 3.079 N/A ARG 14.A NE ASP 178.A OD2 no hydrogen 2.484 N/A ARG 14.A NH1 ASP 10.A OD1 no hydrogen 2.949 N/A ARG 14.A NH2 ASP 10.A OD2 no hydrogen 3.237 N/A ARG 14.A NH2 ASP 178.A OD1 no hydrogen 2.848 N/A ILE 15.A N ALA 11.A O no hydrogen 3.114 N/A ASN 16.A N TYR 12.A O no hydrogen 2.641 N/A ASN 16.A ND2 PHE 58.A O no hydrogen 2.857 N/A ILE 18.A N ARG 14.A O no hydrogen 3.034 N/A VAL 19.A N ILE 15.A O no hydrogen 3.119 N/A ILE 20.A N ASN 16.A O no hydrogen 2.815 N/A GLU 21.A N ALA 17.A O no hydrogen 2.667 N/A GLY 22.A N ILE 18.A O no hydrogen 2.784 N/A GLU 23.A N VAL 19.A O no hydrogen 3.063 N/A ASP 24.A N ILE 20.A O no hydrogen 3.156 N/A GLU 25.A N GLU 21.A O no hydrogen 2.832 N/A ALA 26.A N GLY 22.A O no hydrogen 3.015 N/A ALA 27.A N GLU 23.A O no hydrogen 2.989 N/A ASN 28.A N ASP 24.A O no hydrogen 3.018 N/A ASN 29.A N GLU 25.A O no hydrogen 2.939 N/A ASN 29.A ND2 GLN 101.A OE1 no hydrogen 2.839 N/A TYR 30.A N ALA 26.A O no hydrogen 2.814 N/A TYR 30.A OH HIS 138.A O.B no hydrogen 2.693 N/A VAL 31.A N ALA 27.A O no hydrogen 3.133 N/A ARG 32.A N ASN 28.A O no hydrogen 2.932 N/A ARG 32.A NH1 GLU 35.A OE1 no hydrogen 3.172 N/A LEU 33.A N ASN 29.A O no hydrogen 2.952 N/A ALA 34.A N TYR 30.A O no hydrogen 2.966 N/A GLU 35.A N VAL 31.A O no hydrogen 3.345 N/A GLU 35.A N ARG 32.A O no hydrogen 3.148 N/A MET 37.A N LEU 33.A O no hydrogen 2.821 N/A GLN 40.A N MET 37.A O no hydrogen 2.846 N/A SER 41.A N PRO 38.A O no hydrogen 3.226 N/A SER 41.A OG PRO 38.A O no hydrogen 2.854 N/A LEU 44.A N GLN 40.A O no hydrogen 3.338 N/A ALA 45.A N SER 41.A O no hydrogen 3.008 N/A SER 46.A N GLU 42.A O no hydrogen 3.141 N/A LEU 47.A N GLU 43.A O no hydrogen 2.741 N/A ALA 48.A N LEU 44.A O no hydrogen 2.963 N/A LYS 49.A N ALA 45.A O no hydrogen 3.150 N/A MET 50.A N SER 46.A O no hydrogen 3.170 N/A GLU 51.A N LEU 47.A O no hydrogen 3.024 N/A ALA 52.A N ALA 48.A O no hydrogen 2.997 N/A ARG 53.A N LYS 49.A O no hydrogen 2.861 N/A HIS 54.A N MET 50.A O no hydrogen 3.030 N/A LYS 55.A N GLU 51.A O no hydrogen 2.921 N/A LYS 56.A N ARG 53.A O no hydrogen 3.107 N/A GLY 57.A N ARG 53.A O no hydrogen 3.267 N/A PHE 58.A N HIS 54.A O no hydrogen 2.836 N/A THR 59.A N LYS 55.A O no hydrogen 2.882 N/A THR 59.A OG1 LYS 55.A O no hydrogen 2.983 N/A ALA 60.A N LYS 56.A O no hydrogen 3.153 N/A CYS 61.A N GLY 57.A O no hydrogen 3.278 N/A CYS 61.A N PHE 58.A O no hydrogen 3.175 N/A CYS 61.A SG GLY 57.A O no hydrogen 3.301 N/A ASN 64.A N ALA 60.A O no hydrogen 3.151 N/A LEU 65.A N GLY 62.A O no hydrogen 2.667 N/A ASN 66.A N LYS 63.A O no hydrogen 3.079 N/A VAL 67.A N GLY 62.A O no hydrogen 3.124 N/A ASP 70.A N SER 13.A O no hydrogen 3.104 N/A PHE 73.A N ASP 70.A O no hydrogen 3.172 N/A PHE 73.A N ASP 70.A OD1 no hydrogen 2.748 N/A ALA 74.A N ASP 70.A O no hydrogen 3.183 N/A LYS 75.A N MET 71.A O no hydrogen 2.763 N/A LYS 76.A N ASP 72.A O no hydrogen 3.040 N/A PHE 77.A N PHE 73.A O no hydrogen 2.605 N/A PHE 78.A N ALA 74.A O no hydrogen 3.149 N/A HIS 82.A N PHE 78.A O no hydrogen 2.776 N/A GLY 83.A N SER 79.A O no hydrogen 2.827 N/A ASN 84.A N ASP 80.A O no hydrogen 2.984 N/A ASN 84.A ND2 ASN 164.A OD1 no hydrogen 3.101 N/A PHE 85.A N LEU 81.A O no hydrogen 3.070 N/A GLN 86.A N HIS 82.A O no hydrogen 2.868 N/A VAL 87.A N GLY 83.A O no hydrogen 2.814 N/A ALA 88.A N ASN 84.A O no hydrogen 2.886 N/A ALA 89.A N PHE 85.A O no hydrogen 2.700 N/A ALA 90.A N GLN 86.A O no hydrogen 2.727 N/A GLY 92.A N ALA 89.A O no hydrogen 2.989 N/A ASN 93.A N ALA 88.A O no hydrogen 2.750 N/A ILE 94.A N GLY 92.A O no hydrogen 2.918 N/A THR 96.A OG1 GLU 156.A OE2 no hydrogen 2.783 N/A CYS 97.A N ASN 93.A O no hydrogen 3.121 N/A CYS 97.A SG PHE 85.A O no hydrogen 3.897 N/A CYS 97.A SG ASN 93.A O no hydrogen 3.396 N/A LEU 98.A N ILE 94.A O no hydrogen 2.917 N/A LEU 99.A N VAL 95.A O no hydrogen 3.041 N/A ILE 100.A N THR 96.A O no hydrogen 3.048 N/A GLN 101.A N CYS 97.A O no hydrogen 3.218 N/A ALA 102.A N LEU 98.A O no hydrogen 2.686 N/A LEU 103.A N LEU 99.A O no hydrogen 3.394 N/A ILE 104.A N LEU 99.A O no hydrogen 2.968 N/A ILE 105.A N ILE 100.A O no hydrogen 2.989 N/A ALA 107.A N LEU 103.A O no hydrogen 2.982 N/A PHE 108.A N ILE 104.A O no hydrogen 3.125 N/A ALA 109.A N ILE 105.A O no hydrogen 2.771 N/A ILE 110.A N GLU 106.A O no hydrogen 2.831 N/A SER 111.A N ALA 107.A O no hydrogen 2.931 N/A SER 111.A OG ALA 107.A O no hydrogen 2.872 N/A ALA 112.A N PHE 108.A O no hydrogen 3.008 N/A TYR 113.A N ALA 109.A O no hydrogen 2.996 N/A TYR 113.A OH GLU 23.A OE2 no hydrogen 2.502 N/A ASN 114.A N ILE 110.A O no hydrogen 2.972 N/A ASN 114.A ND2 TYR 136.A OH.A no hydrogen 3.153 N/A VAL 115.A N SER 111.A O no hydrogen 2.866 N/A TYR 116.A N ALA 112.A O no hydrogen 2.794 N/A ILE 117.A N TYR 113.A O no hydrogen 3.118 N/A HIS 119.A N TYR 116.A O no hydrogen 3.103 N/A ALA 120.A N ILE 117.A O no hydrogen 3.391 N/A ALA 124.A N ASP 121.A OD2 no hydrogen 3.045 N/A ARG 125.A N ASP 121.A O no hydrogen 2.750 N/A ARG 125.A NE GLU 129.A OE2 no hydrogen 3.307 N/A LYS 126.A N ASP 122.A O no hydrogen 3.170 N/A ILE 127.A N PHE 123.A O no hydrogen 3.216 N/A THR 128.A N ALA 124.A O no hydrogen 2.883 N/A THR 128.A OG1 ALA 124.A O no hydrogen 2.603 N/A GLU 129.A N ARG 125.A O no hydrogen 2.949 N/A ASN 130.A N LYS 126.A O no hydrogen 3.132 N/A VAL 131.A N ILE 127.A O no hydrogen 3.030 N/A VAL 132.A N THR 128.A O no hydrogen 2.791 N/A LYS 133.A N GLU 129.A O no hydrogen 3.012 N/A ASP 134.A N ASN 130.A O no hydrogen 2.963 N/A GLU 135.A N VAL 131.A O no hydrogen 2.649 N/A TYR 136.A N.A VAL 132.A O no hydrogen 2.841 N/A LEU 137.A N.A ASP 134.A O no hydrogen 2.743 N/A LEU 137.A N.B GLU 135.A O no hydrogen 2.434 N/A ASN 140.A ND2 ALA 102.A O no hydrogen 3.161 N/A GLU 143.A N ASN 140.A OD1 no hydrogen 3.074 N/A GLN 144.A N ASN 140.A O no hydrogen 3.124 N/A TRP 145.A N PHE 141.A O no hydrogen 3.256 N/A LEU 146.A N GLY 142.A O no hydrogen 3.126 N/A LYS 147.A N GLU 143.A O no hydrogen 2.857 N/A LYS 147.A NZ ASN 203.A OD1 no hydrogen 2.850 N/A ALA 148.A N GLN 144.A O no hydrogen 3.013 N/A ASN 149.A N LEU 146.A O no hydrogen 3.344 N/A ASN 149.A ND2 TRP 145.A O no hydrogen 2.675 N/A ALA 153.A N ASN 149.A O no hydrogen 2.981 N/A LYS 154.A N PHE 150.A O no hydrogen 2.676 N/A LYS 154.A NZ GLU 210.A OE2 no hydrogen 2.527 N/A LEU 157.A N ALA 153.A O no hydrogen 2.929 N/A GLU 158.A N LYS 154.A O no hydrogen 3.301 N/A ARG 159.A N ASP 155.A O no hydrogen 3.332 N/A ALA 160.A N GLU 156.A O no hydrogen 2.722 N/A ASN 161.A N LEU 157.A O no hydrogen 2.970 N/A ASN 161.A ND2 MET 214.A O no hydrogen 2.713 N/A ARG 162.A N GLU 158.A O no hydrogen 3.183 N/A GLU 163.A N ARG 159.A O no hydrogen 3.269 N/A ASN 164.A N ALA 160.A O no hydrogen 2.850 N/A ASN 164.A ND2 ALA 160.A O no hydrogen 3.180 N/A LEU 165.A N ASN 161.A O no hydrogen 2.954 N/A VAL 168.A N ASN 164.A O no hydrogen 3.273 N/A TRP 169.A N LEU 165.A O no hydrogen 2.935 N/A ARG 170.A N ALA 166.A O no hydrogen 3.058 N/A MET 171.A N ILE 167.A O no hydrogen 2.859 N/A LEU 172.A N VAL 168.A O no hydrogen 3.061 N/A ASP 173.A N TRP 169.A O no hydrogen 3.216 N/A GLU 174.A N ARG 170.A O no hydrogen 3.158 N/A VAL 175.A N LEU 172.A O no hydrogen 3.189 N/A ALA 176.A N LEU 172.A O no hydrogen 2.730 N/A ALA 179.A N VAL 175.A O no hydrogen 2.689 N/A LEU 180.A N ALA 176.A O no hydrogen 2.915 N/A LEU 180.A N GLY 177.A O no hydrogen 3.163 N/A VAL 181.A N GLY 177.A O no hydrogen 3.436 N/A GLY 183.A N LEU 180.A O no hydrogen 2.927 N/A MET 184.A N ALA 179.A O no hydrogen 3.004 N/A LYS 186.A NZ ASP 173.A OD1 no hydrogen 2.537 N/A LEU 189.A N GLU 185.A O no hydrogen 3.423 N/A MET 190.A N LYS 186.A O no hydrogen 3.009 N/A GLU 191.A N GLU 187.A O no hydrogen 2.912 N/A ASP 192.A N ALA 188.A O no hydrogen 3.012 N/A PHE 193.A N LEU 189.A O no hydrogen 3.249 N/A THR 194.A N MET 190.A O no hydrogen 3.007 N/A THR 194.A OG1 MET 190.A O no hydrogen 2.632 N/A ILE 195.A N GLU 191.A O no hydrogen 2.971 N/A ALA 196.A N ASP 192.A O no hydrogen 3.009 N/A TYR 197.A N PHE 193.A O no hydrogen 2.744 N/A TYR 197.A OH ASN 161.A OD1 no hydrogen 3.087 N/A GLN 198.A N THR 194.A O no hydrogen 2.920 N/A GLN 198.A NE2 GLN 202.A OE1 no hydrogen 2.969 N/A GLN 198.A NE2 THR 211.A OG1 no hydrogen 2.973 N/A GLU 199.A N ILE 195.A O no hydrogen 2.907 N/A ALA 200.A N ALA 196.A O no hydrogen 2.949 N/A LEU 201.A N TYR 197.A O no hydrogen 2.973 N/A GLN 202.A N GLN 198.A O no hydrogen 2.944 N/A ASN 203.A N GLU 199.A O no hydrogen 2.898 N/A ASN 203.A ND2 GLU 143.A OE2 no hydrogen 2.737 N/A ILE 204.A N ALA 200.A O no hydrogen 3.162 N/A GLY 205.A N LEU 201.A O no hydrogen 3.378 N/A GLY 205.A N GLN 202.A O no hydrogen 2.814 N/A PHE 206.A N LEU 201.A O no hydrogen 3.308 N/A SER 207.A N GLU 210.A OE1 no hydrogen 3.040 N/A THR 208.A OG1 GLN 202.A OE1 no hydrogen 2.867 N/A GLU 210.A N SER 207.A OG no hydrogen 2.997 N/A THR 211.A N SER 207.A O no hydrogen 2.848 N/A THR 211.A OG1 THR 208.A O no hydrogen 2.476 N/A LEU 212.A N THR 208.A O no hydrogen 2.970 N/A ARG 213.A N ARG 209.A O no hydrogen 3.192 N/A MET 214.A N GLU 210.A O no hydrogen 2.949 N/A LEU 215.A N THR 211.A O no hydrogen 2.723 N/A THR 216.A N LEU 212.A O no hydrogen 3.088 N/A THR 216.A OG1 LEU 212.A O no hydrogen 2.782 N/A ALA 217.A N ARG 213.A O no hydrogen 3.093 N/A LEU 219.A N LEU 215.A O no hydrogen 3.519 N/A