Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4r8m_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A NE LEU 5.A O no hydrogen 2.661 N/A ARG 3.A NH2 LEU 5.A O no hydrogen 3.534 N/A ARG 3.A NH2 ASP 6.A O no hydrogen 3.419 N/A THR 9.A OG1 GLU 11.A OE1 no hydrogen 3.073 N/A GLY 12.A N THR 9.A OG1 no hydrogen 3.042 N/A VAL 13.A N THR 9.A O no hydrogen 3.086 N/A ALA 14.A N LEU 10.A O no hydrogen 2.795 N/A ARG 15.A N GLU 11.A O no hydrogen 2.885 N/A ARG 15.A NH1 ASP 6.A OD2 no hydrogen 3.163 N/A ARG 15.A NH1 GLU 7.A OE2 no hydrogen 3.059 N/A ARG 15.A NH2 GLU 7.A OE2 no hydrogen 2.563 N/A TYR 16.A N GLY 12.A O no hydrogen 2.990 N/A TYR 16.A OH ASP 199.A O no hydrogen 2.502 N/A MET 17.A N VAL 13.A O no hydrogen 2.871 N/A GLN 18.A N ALA 14.A O no hydrogen 3.116 N/A GLN 18.A NE2 ALA 14.A O no hydrogen 3.552 N/A SER 19.A N TYR 16.A O no hydrogen 2.910 N/A SER 19.A OG TYR 16.A O no hydrogen 2.615 N/A ARG 21.A NH1 GLU 2.A OE1 no hydrogen 2.657 N/A ARG 21.A NH2 GLU 2.A OE1 no hydrogen 3.212 N/A CYS 22.A N SER 19.A O no hydrogen 3.268 N/A ARG 23.A N ASP 199.A OD2 no hydrogen 2.720 N/A ARG 24.A N ASP 199.A OD2 no hydrogen 3.016 N/A ARG 24.A NE ARG 23.A O no hydrogen 2.989 N/A ARG 24.A NH2 ARG 23.A O no hydrogen 3.482 N/A ARG 24.A NH2 GLY 103.A O no hydrogen 3.085 N/A VAL 25.A N LEU 104.A O no hydrogen 2.817 N/A ILE 26.A N LEU 200.A O no hydrogen 2.938 N/A CYS 27.A N ARG 107.A O no hydrogen 3.003 N/A LEU 28.A N LEU 202.A O no hydrogen 2.850 N/A VAL 29.A N TYR 109.A O no hydrogen 2.834 N/A GLY 30.A N MET 204.A O no hydrogen 3.070 N/A GLY 32.A N GLY 205.A O no hydrogen 2.744 N/A ILE 33.A N GLY 30.A O no hydrogen 3.382 N/A SER 34.A N ALA 31.A O no hydrogen 3.155 N/A SER 34.A OG ALA 31.A O no hydrogen 3.108 N/A SER 34.A OG ASP 114.A OD2 no hydrogen 3.564 N/A THR 35.A OG1.B GLY 32.A O no hydrogen 3.151 N/A SER 36.A OG ASP 256.A OD2 no hydrogen 2.792 N/A ALA 37.A N SER 34.A O no hydrogen 3.128 N/A GLY 38.A N THR 35.A O.A no hydrogen 3.040 N/A GLY 38.A N THR 35.A O.B no hydrogen 2.837 N/A ILE 39.A N SER 34.A O no hydrogen 3.329 N/A ARG 43.A N ASP 41.A OD1 no hydrogen 3.048 N/A SER 44.A N ASP 41.A O no hydrogen 3.274 N/A SER 44.A N ASP 41.A OD1 no hydrogen 3.248 N/A THR 47.A N SER 44.A O no hydrogen 3.327 N/A THR 47.A OG1 ASP 41.A O no hydrogen 2.969 N/A TYR 50.A OH PHE 42.A O no hydrogen 3.080 N/A LEU 53.A N TYR 50.A O no hydrogen 2.990 N/A LYS 55.A NZ TYR 56.A OH no hydrogen 3.461 N/A TYR 56.A N LEU 53.A O no hydrogen 3.135 N/A HIS 57.A N GLU 54.A O no hydrogen 3.207 N/A TYR 60.A OH GLU 66.A OE1 no hydrogen 2.563 N/A TYR 60.A OH GLU 66.A OE2 no hydrogen 2.827 N/A ALA 63.A N TYR 60.A O no hydrogen 3.221 N/A ILE 64.A N PRO 61.A O no hydrogen 3.274 N/A PHE 65.A N GLU 62.A O no hydrogen 2.902 N/A GLU 66.A N ALA 63.A O no hydrogen 2.845 N/A ILE 67.A N PHE 179.A O no hydrogen 3.002 N/A PHE 70.A N GLU 66.A O no hydrogen 2.861 N/A LYS 71.A N ILE 67.A O no hydrogen 3.072 N/A LYS 72.A N TYR 69.A O no hydrogen 3.119 N/A HIS 73.A N TYR 69.A O no hydrogen 2.768 N/A PHE 78.A N PRO 74.A O no hydrogen 3.250 N/A ALA 79.A N GLU 75.A O no hydrogen 2.951 N/A LEU 80.A N PRO 76.A O no hydrogen 3.093 N/A ALA 81.A N PHE 77.A O no hydrogen 2.980 N/A LYS 82.A N PHE 78.A O no hydrogen 3.082 N/A GLU 83.A N ALA 79.A O no hydrogen 3.401 N/A LEU 84.A N LEU 80.A O no hydrogen 3.357 N/A GLN 86.A NE2 GLN 86.A O no hydrogen 3.344 N/A LYS 88.A NZ ASP 284.A OD1 no hydrogen 3.127 N/A THR 90.A N HIS 93.A ND1 no hydrogen 3.155 N/A THR 90.A OG1 ILE 33.A O no hydrogen 2.841 N/A THR 90.A OG1 HIS 93.A ND1 no hydrogen 3.159 N/A THR 90.A OG1 ASP 256.A OD1 no hydrogen 3.454 N/A CYS 92.A SG ASP 256.A OD1 no hydrogen 3.291 N/A HIS 93.A ND1 THR 90.A OG1 no hydrogen 3.159 N/A TYR 94.A N THR 90.A O no hydrogen 3.198 N/A PHE 95.A N ILE 91.A O no hydrogen 2.846 N/A MET 96.A N CYS 92.A O no hydrogen 3.249 N/A ARG 97.A N HIS 93.A O no hydrogen 3.097 N/A ARG 97.A NE ASP 101.A OD2 no hydrogen 3.358 N/A ARG 97.A NH2 ALA 120.A O no hydrogen 2.746 N/A LEU 98.A N TYR 94.A O no hydrogen 2.862 N/A LEU 99.A N PHE 95.A O no hydrogen 2.855 N/A LYS 100.A N MET 96.A O no hydrogen 3.010 N/A LYS 100.A NZ ASP 126.A OD2 no hydrogen 3.404 N/A ASP 101.A N ARG 97.A O no hydrogen 3.002 N/A LYS 102.A N LEU 98.A O no hydrogen 3.010 N/A LYS 102.A NZ GLU 271.A OE2 no hydrogen 3.528 N/A GLY 103.A N LYS 100.A O no hydrogen 2.991 N/A LEU 104.A N LEU 99.A O no hydrogen 2.823 N/A LEU 105.A N LEU 99.A O no hydrogen 3.144 N/A LEU 106.A N VAL 25.A O no hydrogen 2.830 N/A ARG 107.A NH1 ASP 194.A OD2 no hydrogen 3.432 N/A CYS 108.A N ASP 126.A O no hydrogen 2.789 N/A TYR 109.A N CYS 27.A O no hydrogen 2.718 N/A TYR 109.A OH ASP 194.A OD2 no hydrogen 2.528 N/A THR 110.A N VAL 128.A O no hydrogen 2.915 N/A THR 110.A OG1 GLU 117.A OE2 no hydrogen 2.643 N/A GLN 111.A N VAL 29.A O no hydrogen 2.900 N/A GLN 111.A NE2 THR 206.A OG1 no hydrogen 2.641 N/A ASN 112.A N THR 110.A OG1 no hydrogen 2.984 N/A ASN 112.A ND2 GLY 30.A O no hydrogen 2.830 N/A LEU 116.A N ASP 114.A OD1 no hydrogen 2.858 N/A ARG 118.A NE GLU 129.A OE2 no hydrogen 2.737 N/A ARG 118.A NH1 GLU 129.A OE1 no hydrogen 2.849 N/A ARG 118.A NH1 GLU 129.A OE2 no hydrogen 3.401 N/A ILE 119.A N THR 115.A O no hydrogen 3.241 N/A ALA 120.A N LEU 116.A O no hydrogen 2.802 N/A GLY 121.A N GLU 117.A O no hydrogen 3.237 N/A GLY 121.A N ARG 118.A O no hydrogen 2.969 N/A LEU 122.A N GLU 117.A O no hydrogen 3.065 N/A GLU 123.A N ASP 126.A OD2 no hydrogen 3.311 N/A ASP 126.A N GLU 123.A O no hydrogen 2.998 N/A LEU 127.A N GLN 124.A O no hydrogen 3.250 N/A VAL 128.A N CYS 108.A O no hydrogen 2.866 N/A ALA 130.A N THR 110.A O no hydrogen 2.960 N/A GLY 132.A N GLU 129.A O no hydrogen 3.151 N/A THR 133.A N ASP 175.A O no hydrogen 2.985 N/A THR 133.A OG1 THR 115.A OG1 no hydrogen 2.874 N/A PHE 134.A N ILE 113.A O no hydrogen 3.438 N/A TYR 135.A N THR 133.A OG1 no hydrogen 3.072 N/A SER 137.A N TYR 148.A O no hydrogen 3.107 N/A HIS 138.A N LYS 173.A O no hydrogen 2.734 N/A HIS 138.A ND1 ASP 175.A OD1 no hydrogen 2.551 N/A CYS 139.A N HIS 146.A O no hydrogen 3.063 N/A CYS 139.A SG SER 141.A OG no hydrogen 3.538 N/A VAL 140.A N LEU 171.A O no hydrogen 2.922 N/A CYS 144.A N SER 141.A O no hydrogen 3.025 N/A ARG 145.A N SER 141.A O no hydrogen 3.143 N/A HIS 146.A ND1 GLU 147.A O no hydrogen 3.039 N/A TYR 148.A N SER 137.A O no hydrogen 2.928 N/A MET 153.A N PRO 149.A O no hydrogen 3.084 N/A LYS 154.A N LEU 150.A O no hydrogen 2.811 N/A GLU 155.A N SER 151.A O no hydrogen 3.340 N/A LYS 156.A N TRP 152.A O no hydrogen 3.320 N/A ILE 157.A N MET 153.A O no hydrogen 2.871 N/A PHE 158.A N LYS 154.A O no hydrogen 2.757 N/A SER 159.A N GLU 155.A O no hydrogen 3.245 N/A SER 159.A OG GLU 155.A O no hydrogen 2.782 N/A SER 159.A OG LYS 156.A O no hydrogen 2.960 N/A GLU 160.A N ILE 157.A O no hydrogen 3.003 N/A VAL 161.A N LYS 156.A O no hydrogen 3.078 N/A CYS 165.A N SER 170.A O no hydrogen 2.712 N/A CYS 165.A SG TYR 148.A OH no hydrogen 3.386 N/A GLU 166.A N TYR 148.A OH no hydrogen 2.815 N/A CYS 168.A SG SER 141.A OG no hydrogen 3.652 N/A CYS 168.A SG SER 170.A OG no hydrogen 3.214 N/A GLN 169.A N CYS 165.A O no hydrogen 2.990 N/A VAL 172.A N PRO 163.A O no hydrogen 3.225 N/A LYS 173.A N HIS 138.A O no hydrogen 2.727 N/A LYS 173.A NZ PRO 174.A O no hydrogen 2.877 N/A LYS 173.A NZ ILE 176.A O no hydrogen 3.089 N/A ASP 175.A N THR 136.A O no hydrogen 2.779 N/A ILE 176.A N PRO 174.A O no hydrogen 2.663 N/A VAL 177.A N HIS 131.A O no hydrogen 2.800 N/A PHE 178.A N GLU 181.A OE1 no hydrogen 2.871 N/A PHE 179.A N PHE 65.A O no hydrogen 2.911 N/A GLU 181.A N PHE 178.A O no hydrogen 2.997 N/A ARG 186.A NE LEU 127.A O no hydrogen 3.098 N/A ARG 186.A NH2 LEU 127.A O no hydrogen 3.180 N/A PHE 187.A N PRO 184.A O no hydrogen 3.148 N/A SER 189.A N ALA 185.A O no hydrogen 2.844 N/A CYS 190.A N ARG 186.A O no hydrogen 2.782 N/A MET 191.A N PHE 187.A O no hydrogen 3.120 N/A SER 193.A N CYS 190.A O no hydrogen 3.253 N/A ASP 194.A N CYS 190.A O no hydrogen 2.863 N/A PHE 195.A N MET 191.A O no hydrogen 3.452 N/A LYS 197.A N ASP 194.A O no hydrogen 3.449 N/A ASP 199.A N ARG 24.A O no hydrogen 2.666 N/A LEU 200.A N ARG 24.A O no hydrogen 3.260 N/A LEU 201.A N PRO 225.A O no hydrogen 2.958 N/A LEU 202.A N ILE 26.A O no hydrogen 2.762 N/A VAL 203.A N LEU 227.A O no hydrogen 2.655 N/A MET 204.A N LEU 28.A O no hydrogen 2.870 N/A GLY 205.A N ILE 229.A O no hydrogen 2.952 N/A LEU 208.A N THR 206.A OG1 no hydrogen 2.919 N/A ALA 214.A N VAL 210.A O no hydrogen 2.912 N/A SER 215.A N PRO 212.A O no hydrogen 2.895 N/A SER 215.A OG PRO 212.A O no hydrogen 2.508 N/A LEU 216.A N PHE 213.A O no hydrogen 3.010 N/A ILE 217.A N ALA 214.A O no hydrogen 3.493 N/A SER 218.A N SER 215.A O no hydrogen 3.233 N/A LYS 219.A N LEU 216.A O no hydrogen 3.281 N/A THR 224.A N PRO 221.A O no hydrogen 3.086 N/A THR 224.A OG1 VAL 198.A O no hydrogen 3.406 N/A THR 224.A OG1 PRO 221.A O no hydrogen 3.196 N/A ARG 226.A N ARG 247.A O no hydrogen 3.145 N/A ARG 226.A NE ASP 248.A OD1 no hydrogen 2.678 N/A ARG 226.A NH1 ILE 217.A O no hydrogen 2.992 N/A ARG 226.A NH2 GLY 237.A O no hydrogen 2.469 N/A ARG 226.A NH2 ASP 248.A OD1 no hydrogen 3.322 N/A ARG 226.A NH2 ASP 248.A OD2 no hydrogen 2.827 N/A LEU 227.A N LEU 201.A O no hydrogen 2.851 N/A LEU 228.A N VAL 249.A O no hydrogen 2.778 N/A ILE 229.A N VAL 203.A O no hydrogen 2.795 N/A ASN 230.A N TRP 251.A O no hydrogen 3.156 N/A ASN 230.A ND2 GLU 232.A O no hydrogen 3.046 N/A LYS 233.A NZ ASP 241.A OD1 no hydrogen 3.429 N/A LYS 233.A NZ ASP 241.A OD2 no hydrogen 2.966 N/A MET 238.A N GLY 235.A O no hydrogen 3.072 N/A ASP 239.A N ASP 248.A OD2 no hydrogen 2.791 N/A SER 242.A N ASP 239.A OD1 no hydrogen 3.133 N/A SER 242.A OG ASP 239.A OD1 no hydrogen 3.202 N/A SER 242.A OG ASP 239.A OD2 no hydrogen 2.617 N/A LYS 244.A N SER 242.A OG no hydrogen 3.019 N/A ALA 245.A N SER 242.A O no hydrogen 2.824 N/A TYR 246.A OH LEU 222.A O no hydrogen 2.658 N/A ARG 247.A NH1 THR 224.A O no hydrogen 3.034 N/A VAL 249.A N ARG 226.A O no hydrogen 2.904 N/A TRP 251.A N LEU 228.A O no hydrogen 2.760 N/A GLY 253.A N ASN 230.A O no hydrogen 2.928 N/A CYS 255.A SG ILE 229.A O no hydrogen 3.730 N/A GLN 257.A N GLU 254.A O no hydrogen 3.097 N/A GLY 258.A N GLU 254.A O no hydrogen 3.244 N/A CYS 259.A N CYS 255.A O no hydrogen 2.975 N/A CYS 259.A SG CYS 255.A O no hydrogen 3.667 N/A LEU 260.A N ASP 256.A O no hydrogen 3.016 N/A ALA 261.A N GLN 257.A O no hydrogen 2.697 N/A LEU 262.A N GLY 258.A O no hydrogen 2.729 N/A ALA 263.A N CYS 259.A O no hydrogen 2.737 N/A GLU 264.A N LEU 260.A O no hydrogen 2.833 N/A LEU 265.A N ALA 261.A O no hydrogen 3.235 N/A LEU 266.A N LEU 262.A O no hydrogen 3.155 N/A LEU 266.A N ALA 263.A O no hydrogen 3.180 N/A GLY 267.A N GLU 264.A O no hydrogen 3.078 N/A TRP 268.A N ALA 263.A O no hydrogen 2.769 N/A LYS 270.A NZ GLU 273.A OE2 no hydrogen 3.567 N/A LEU 272.A N TRP 268.A O no hydrogen 2.789 N/A GLU 273.A N LYS 269.A O no hydrogen 2.960 N/A ASP 274.A N LYS 270.A O no hydrogen 3.054 N/A LEU 275.A N GLU 271.A O no hydrogen 2.921 N/A VAL 276.A N LEU 272.A O no hydrogen 2.905 N/A ARG 277.A N GLU 273.A O no hydrogen 2.934 N/A ARG 278.A N ASP 274.A O no hydrogen 3.022 N/A ARG 278.A NH1 ASP 274.A OD1 no hydrogen 2.921 N/A GLU 279.A N LEU 275.A O no hydrogen 2.851 N/A HIS 280.A N VAL 276.A O no hydrogen 2.847 N/A HIS 280.A NE2 PRO 89.A O no hydrogen 2.756 N/A ALA 281.A N ARG 277.A O no hydrogen 2.956 N/A SER 282.A N ARG 278.A O no hydrogen 3.003 N/A ILE 283.A N GLU 279.A O no hydrogen 3.137 N/A ASP 284.A N HIS 280.A O no hydrogen 2.857 N/A ALA 285.A N ALA 281.A O no hydrogen 2.992 N/A GLN 286.A N SER 282.A O no hydrogen 3.287 N/A