Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4fr5_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 4.A N LEU 36.A O no hydrogen 3.055 N/A PHE 6.A N HIS 38.A O no hydrogen 2.716 N/A VAL 8.A N HIS 40.A O no hydrogen 3.130 N/A PHE 9.A N ASN 63.A O no hydrogen 2.967 N/A GLY 10.A N ILE 42.A O no hydrogen 3.229 N/A ILE 21.A N LYS 17.A O no hydrogen 3.368 N/A HIS 22.A N SER 18.A O no hydrogen 2.969 N/A HIS 22.A ND1 SER 18.A O no hydrogen 2.994 N/A ASN 23.A N PRO 19.A O no hydrogen 2.804 N/A ASN 23.A ND2 TYR 39.A O no hydrogen 2.956 N/A ALA 24.A N LEU 20.A O no hydrogen 3.015 N/A CYS 25.A N ILE 21.A O no hydrogen 3.372 N/A CYS 25.A SG ILE 21.A O no hydrogen 3.837 N/A CYS 25.A SG ALA 255.A O no hydrogen 3.719 N/A PHE 26.A N HIS 22.A O no hydrogen 2.667 N/A LEU 27.A N ASN 23.A O no hydrogen 2.885 N/A THR 28.A N ALA 24.A O no hydrogen 3.068 N/A THR 28.A OG1 ALA 24.A O no hydrogen 3.017 N/A PHE 29.A N CYS 25.A O no hydrogen 3.118 N/A GLU 32.A N GLU 32.A OE1 no hydrogen 2.960 N/A LEU 33.A N PHE 29.A O no hydrogen 3.056 N/A LEU 33.A N GLN 30.A O no hydrogen 3.216 N/A ARG 34.A N GLN 30.A O no hydrogen 2.853 N/A LEU 36.A N LYS 2.A O no hydrogen 2.857 N/A HIS 38.A N LYS 4.A O no hydrogen 2.943 N/A HIS 38.A ND1 HIS 40.A NE2 no hydrogen 2.816 N/A TYR 39.A N ASN 23.A OD1 no hydrogen 2.708 N/A HIS 40.A N PHE 6.A O no hydrogen 3.182 N/A HIS 40.A NE2 HIS 38.A ND1 no hydrogen 2.816 N/A ILE 42.A N VAL 8.A O no hydrogen 2.912 N/A LEU 44.A N GLY 10.A O no hydrogen 3.159 N/A GLU 47.A N GLU 47.A OE1 no hydrogen 3.084 N/A SER 48.A N PRO 45.A O no hydrogen 2.904 N/A LYS 51.A NZ ASP 77.A OD1 no hydrogen 2.473 N/A SER 52.A N HIS 49.A ND1 no hydrogen 3.183 N/A GLU 53.A N HIS 49.A O no hydrogen 2.840 N/A PHE 54.A N ILE 50.A O no hydrogen 2.978 N/A LEU 55.A N LYS 51.A O no hydrogen 3.015 N/A HIS 56.A N SER 52.A O no hydrogen 3.006 N/A LEU 57.A N GLU 53.A O no hydrogen 2.859 N/A GLY 58.A N LEU 55.A O no hydrogen 3.102 N/A LEU 59.A N PHE 54.A O no hydrogen 3.359 N/A SER 60.A N SER 5.A O no hydrogen 2.773 N/A ALA 62.A N LEU 92.A O no hydrogen 2.863 N/A ASN 63.A N GLY 7.A O no hydrogen 2.779 N/A ASN 63.A ND2 TYR 39.A OH no hydrogen 2.557 N/A VAL 64.A N ASN 90.A O no hydrogen 2.825 N/A THR 65.A N PHE 9.A O no hydrogen 2.983 N/A PHE 68.A N THR 65.A O no hydrogen 2.943 N/A LYS 69.A NZ ASP 105.A OD2 no hydrogen 2.552 N/A LYS 69.A NZ SER 129.A OG no hydrogen 3.062 N/A ARG 71.A NH1 LEU 46.A O no hydrogen 2.725 N/A ARG 71.A NH2 LEU 46.A O no hydrogen 2.839 N/A ALA 72.A N PHE 68.A O no hydrogen 2.725 N/A PHE 73.A N LYS 69.A O no hydrogen 3.312 N/A GLN 74.A N GLU 70.A O no hydrogen 3.192 N/A VAL 75.A N ARG 71.A O no hydrogen 3.127 N/A VAL 75.A N ALA 72.A O no hydrogen 3.369 N/A CYS 76.A N ALA 72.A O no hydrogen 3.283 N/A CYS 76.A SG ALA 72.A O no hydrogen 3.205 N/A ASP 77.A N LEU 99.A O no hydrogen 2.913 N/A LYS 78.A N LEU 99.A O no hydrogen 3.310 N/A LYS 80.A N GLY 101.A O no hydrogen 3.074 N/A LYS 80.A NZ GLU 95.A OE1 no hydrogen 3.448 N/A LEU 84.A N GLY 81.A O no hydrogen 3.136 N/A GLU 85.A N ILE 82.A O no hydrogen 2.698 N/A CYS 86.A N ILE 82.A O no hydrogen 3.172 N/A CYS 86.A N ALA 83.A O no hydrogen 2.936 N/A CYS 86.A SG ILE 82.A O no hydrogen 3.556 N/A VAL 89.A N LYS 69.A O no hydrogen 2.923 N/A ASN 90.A N TYR 102.A O no hydrogen 2.995 N/A ASN 90.A ND2 THR 104.A OG1 no hydrogen 3.209 N/A THR 91.A N TYR 102.A O no hydrogen 3.066 N/A THR 91.A OG1 ASN 63.A OD1 no hydrogen 3.535 N/A THR 91.A OG1 ASN 90.A OD1 no hydrogen 2.905 N/A THR 91.A OG1 SER 241.A OG no hydrogen 2.721 N/A LEU 92.A N ALA 62.A O no hydrogen 2.698 N/A VAL 93.A N VAL 100.A O no hydrogen 2.713 N/A LEU 94.A N SER 60.A O no hydrogen 3.128 N/A GLU 95.A N GLU 98.A O no hydrogen 2.893 N/A GLU 98.A N GLU 95.A O no hydrogen 3.120 N/A LEU 99.A N ASP 77.A OD2 no hydrogen 2.572 N/A VAL 100.A N VAL 93.A O no hydrogen 2.716 N/A GLY 101.A N LYS 78.A O no hydrogen 2.794 N/A TYR 102.A N THR 91.A O no hydrogen 2.693 N/A TYR 102.A OH GLU 95.A OE1 no hydrogen 3.260 N/A TYR 102.A OH GLU 95.A OE2 no hydrogen 2.489 N/A ASN 103.A ND2 ALA 88.A O no hydrogen 2.707 N/A THR 104.A N ASN 90.A OD1 no hydrogen 2.751 N/A THR 104.A OG1 ASN 90.A OD1 no hydrogen 3.343 N/A THR 104.A OG1 GLN 237.A O no hydrogen 2.975 N/A THR 104.A OG1 SER 241.A OG no hydrogen 3.412 N/A ALA 106.A N ASN 103.A OD1 no hydrogen 3.353 N/A GLY 108.A N THR 104.A O no hydrogen 2.867 N/A PHE 109.A N ASP 105.A O no hydrogen 2.757 N/A TYR 110.A N ALA 106.A O no hydrogen 2.965 N/A LEU 111.A N LEU 107.A O no hydrogen 2.867 N/A SER 112.A N GLY 108.A O no hydrogen 3.294 N/A SER 112.A N PHE 109.A O no hydrogen 3.080 N/A SER 112.A OG PHE 109.A O no hydrogen 2.767 N/A SER 112.A OG TYR 206.A OH no hydrogen 2.608 N/A LEU 113.A N TYR 110.A O no hydrogen 3.260 N/A TYR 118.A N LYS 116.A O no hydrogen 2.835 N/A GLN 119.A N ASP 174.A OD2 no hydrogen 2.701 N/A ASN 120.A ND2 ALA 172.A O no hydrogen 2.943 N/A ALA 121.A N GLN 143.A O no hydrogen 2.984 N/A LEU 122.A N LEU 175.A O no hydrogen 2.837 N/A ILE 123.A N SER 145.A O no hydrogen 2.818 N/A LEU 124.A N ILE 177.A O no hydrogen 2.941 N/A LYS 131.A N GLY 127.A O no hydrogen 3.160 N/A LYS 131.A NZ GLU 70.A OE2 no hydrogen 2.540 N/A LYS 131.A NZ ALA 126.A O no hydrogen 3.491 N/A ALA 132.A N GLY 128.A O no hydrogen 3.023 N/A LEU 133.A N SER 129.A O no hydrogen 2.956 N/A ALA 134.A N ALA 130.A O no hydrogen 2.806 N/A CYS 135.A N LYS 131.A O no hydrogen 3.137 N/A CYS 135.A SG GLU 85.A O no hydrogen 3.978 N/A CYS 135.A SG GLU 85.A OE1 no hydrogen 3.695 N/A GLU 136.A N ALA 132.A O no hydrogen 2.943 N/A LEU 137.A N LEU 133.A O no hydrogen 2.899 N/A LYS 138.A N ALA 134.A O no hydrogen 3.055 N/A LYS 139.A N CYS 135.A O no hydrogen 3.216 N/A LYS 139.A NZ GLU 85.A OE1 no hydrogen 2.578 N/A LYS 139.A NZ GLU 85.A OE2 no hydrogen 3.384 N/A GLN 140.A N GLU 136.A O no hydrogen 3.150 N/A GLY 141.A N LYS 138.A O no hydrogen 2.756 N/A LEU 142.A N LEU 137.A O no hydrogen 3.186 N/A GLN 143.A N GLN 119.A O no hydrogen 3.159 N/A GLN 143.A NE2 SER 145.A OG no hydrogen 3.343 N/A SER 145.A N ALA 121.A O no hydrogen 2.899 N/A SER 145.A OG GLN 143.A OE1 no hydrogen 3.091 N/A VAL 146.A N ASP 163.A O no hydrogen 2.975 N/A LEU 147.A N ILE 123.A O no hydrogen 2.902 N/A SER 150.A OG ARG 149.A O no hydrogen 2.552 N/A ARG 152.A N ASN 148.A OD1 no hydrogen 3.311 N/A PHE 157.A N GLY 153.A O no hydrogen 3.343 N/A GLN 158.A N LEU 154.A O no hydrogen 2.886 N/A ARG 159.A N ASP 155.A O no hydrogen 3.004 N/A ARG 159.A NE ASP 155.A OD1 no hydrogen 3.009 N/A ARG 159.A NE ASP 155.A OD2 no hydrogen 3.240 N/A ARG 159.A NH2 ASP 155.A OD1 no hydrogen 3.367 N/A LEU 160.A N PHE 156.A O no hydrogen 3.274 N/A LEU 160.A N PHE 157.A O no hydrogen 3.189 N/A GLY 161.A N GLN 158.A O no hydrogen 2.862 N/A CYS 162.A N PHE 157.A O no hydrogen 2.959 N/A ASP 163.A N VAL 144.A O no hydrogen 3.111 N/A CYS 164.A SG CYS 162.A O no hydrogen 3.995 N/A PHE 165.A N VAL 146.A O no hydrogen 3.024 N/A SER 171.A OG ALA 172.A O no hydrogen 3.528 N/A ASP 174.A N ASN 120.A OD1 no hydrogen 3.077 N/A LEU 175.A N ASN 120.A O no hydrogen 3.259 N/A ILE 176.A N LEU 204.A O no hydrogen 2.872 N/A ILE 177.A N LEU 122.A O no hydrogen 2.957 N/A ASN 178.A N TYR 206.A O no hydrogen 2.889 N/A ASN 178.A ND2 ASP 207.A OD2 no hydrogen 2.995 N/A ALA 179.A N LEU 124.A O no hydrogen 2.899 N/A THR 180.A N ASN 178.A OD1 no hydrogen 3.123 N/A THR 180.A OG1 ASN 178.A OD1 no hydrogen 2.774 N/A SER 181.A OG HIS 185.A NE2 no hydrogen 3.066 N/A ALA 182.A N THR 180.A OG1 no hydrogen 2.971 N/A SER 183.A OG ASP 207.A OD2 no hydrogen 2.883 N/A HIS 185.A N ALA 182.A O no hydrogen 2.844 N/A HIS 185.A NE2 SER 181.A OG no hydrogen 3.066 N/A ASN 186.A N SER 183.A O no hydrogen 2.772 N/A GLU 187.A N ALA 182.A O no hydrogen 3.012 N/A GLU 193.A N ASN 191.A OD1 no hydrogen 2.618 N/A VAL 194.A N ASN 191.A OD1 no hydrogen 3.253 N/A LEU 195.A N ASN 191.A O no hydrogen 3.220 N/A LYS 196.A N LYS 192.A O no hydrogen 2.925 N/A LYS 196.A NZ GLU 193.A OE1 no hydrogen 2.299 N/A GLY 197.A N GLU 193.A O no hydrogen 3.159 N/A TYR 198.A N VAL 194.A O no hydrogen 3.123 N/A TYR 198.A OH PRO 169.A O no hydrogen 2.547 N/A PHE 199.A N LEU 195.A O no hydrogen 2.784 N/A LYS 200.A N LYS 196.A O no hydrogen 2.893 N/A GLU 201.A N TYR 198.A O no hydrogen 3.351 N/A GLY 202.A N PHE 199.A O no hydrogen 3.121 N/A LYS 203.A N ASP 174.A O no hydrogen 2.581 N/A LEU 204.A N ASP 174.A O no hydrogen 2.911 N/A ALA 205.A N PRO 226.A O no hydrogen 2.878 N/A TYR 206.A N ILE 176.A O no hydrogen 2.772 N/A TYR 206.A OH SER 112.A OG no hydrogen 2.608 N/A ASP 207.A N GLN 228.A O no hydrogen 2.905 N/A LEU 208.A N ASN 178.A O no hydrogen 3.401 N/A ALA 209.A N ASP 207.A OD1 no hydrogen 2.901 N/A THR 214.A OG1 ASP 207.A OD2 no hydrogen 2.602 N/A LEU 217.A N THR 214.A OG1 no hydrogen 3.272 N/A SER 218.A N THR 214.A O no hydrogen 2.829 N/A LEU 219.A N PRO 215.A O no hydrogen 3.055 N/A ALA 220.A N PHE 216.A O no hydrogen 3.211 N/A LYS 221.A N LEU 217.A O no hydrogen 2.853 N/A GLU 222.A N SER 218.A O no hydrogen 2.890 N/A LEU 223.A N LEU 219.A O no hydrogen 3.029 N/A LYS 224.A N LYS 221.A O no hydrogen 3.203 N/A THR 225.A N ALA 220.A O no hydrogen 2.983 N/A THR 225.A OG1 PRO 226.A O no hydrogen 3.394 N/A GLN 228.A N ALA 205.A O no hydrogen 2.952 N/A GLY 230.A N ALA 209.A O no hydrogen 2.784 N/A LYS 231.A N ASP 229.A OD1 no hydrogen 3.126 N/A LYS 231.A NZ ASP 229.A OD2 no hydrogen 2.692 N/A LEU 234.A N GLY 230.A O no hydrogen 2.802 N/A ILE 235.A N LYS 231.A O no hydrogen 3.112 N/A TYR 236.A N ASP 232.A O no hydrogen 3.060 N/A GLN 237.A N MET 233.A O no hydrogen 2.955 N/A GLN 237.A NE2 THR 104.A OG1 no hydrogen 3.273 N/A ALA 238.A N LEU 234.A O no hydrogen 3.065 N/A ALA 239.A N ILE 235.A O no hydrogen 3.029 N/A LEU 240.A N TYR 236.A O no hydrogen 2.915 N/A SER 241.A N GLN 237.A O no hydrogen 2.756 N/A SER 241.A OG ASN 63.A OD1 no hydrogen 2.606 N/A SER 241.A OG THR 91.A OG1 no hydrogen 2.721 N/A SER 241.A OG THR 104.A OG1 no hydrogen 3.412 N/A SER 241.A OG GLN 237.A O no hydrogen 3.311 N/A PHE 242.A N ALA 238.A O no hydrogen 2.647 N/A GLU 243.A N ALA 239.A O no hydrogen 3.069 N/A LYS 244.A N LEU 240.A O no hydrogen 3.439 N/A PHE 245.A N SER 241.A O no hydrogen 2.941 N/A SER 246.A N PHE 242.A O no hydrogen 2.803 N/A SER 246.A OG PHE 242.A O no hydrogen 3.425 N/A SER 246.A OG GLU 243.A O no hydrogen 2.737 N/A SER 246.A OG ILE 250.A O no hydrogen 3.497 N/A ALA 247.A N LYS 244.A O no hydrogen 2.849 N/A SER 248.A N GLU 243.A O no hydrogen 2.871 N/A GLN 249.A N SER 246.A O no hydrogen 2.919 N/A GLN 249.A NE2 SER 246.A O no hydrogen 2.818 N/A ILE 250.A N SER 246.A OG no hydrogen 3.028 N/A TYR 252.A N GLU 243.A OE1 no hydrogen 3.037 N/A LYS 254.A N PRO 251.A O no hydrogen 3.015 N/A ALA 255.A N PRO 251.A O no hydrogen 3.338 N/A PHE 256.A N TYR 252.A O no hydrogen 2.777 N/A GLU 257.A N SER 253.A O no hydrogen 3.321 N/A MET 259.A N ALA 255.A O no hydrogen 2.965 N/A ARG 260.A N PHE 256.A O no hydrogen 2.702 N/A SER 261.A N GLU 257.A O no hydrogen 3.299 N/A VAL 262.A N VAL 258.A O no hydrogen 2.999 N/A PHE 263.A N MET 259.A O no hydrogen 3.013 N/A