Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4o0u_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 4.A N ASP 7.A OD2 no hydrogen 3.059 N/A ASP 7.A N ALA 4.A O no hydrogen 3.078 N/A PHE 8.A N LEU 5.A O no hydrogen 3.124 N/A GLU 9.A N ARG 26.A O no hydrogen 2.860 N/A GLY 11.A N LEU 24.A O no hydrogen 2.687 N/A ARG 12.A NE PRO 13.A O no hydrogen 3.268 N/A LEU 14.A N VAL 22.A O no hydrogen 2.625 N/A GLY 15.A N VAL 22.A O no hydrogen 3.427 N/A GLY 17.A N GLY 20.A O no hydrogen 2.942 N/A ASN 21.A ND2 TYR 23.A OH no hydrogen 3.004 N/A VAL 22.A N GLY 15.A O no hydrogen 2.887 N/A TYR 23.A N LEU 36.A O no hydrogen 3.089 N/A LEU 24.A N ARG 12.A O no hydrogen 3.078 N/A ALA 25.A N LEU 34.A O no hydrogen 2.897 N/A ARG 26.A N GLU 9.A O no hydrogen 2.904 N/A ARG 26.A NH2 GLU 9.A OE2 no hydrogen 3.305 N/A GLU 27.A N PHE 32.A O no hydrogen 3.047 N/A LYS 28.A N ASP 7.A O no hydrogen 2.925 N/A LYS 28.A NZ GLU 6.A O no hydrogen 3.164 N/A GLN 29.A N GLU 27.A OE2 no hydrogen 2.952 N/A SER 30.A N GLU 27.A OE1 no hydrogen 3.002 N/A SER 30.A OG GLU 27.A OE1 no hydrogen 2.755 N/A LYS 31.A N GLU 27.A O no hydrogen 2.803 N/A LEU 34.A N ALA 25.A O no hydrogen 2.965 N/A ALA 35.A N LEU 85.A O no hydrogen 2.845 N/A LEU 36.A N TYR 23.A O no hydrogen 2.814 N/A LYS 37.A N LEU 83.A O no hydrogen 2.943 N/A VAL 38.A N ASN 21.A O no hydrogen 3.017 N/A LEU 39.A N VAL 81.A O no hydrogen 2.589 N/A PHE 40.A N PHE 19.A O no hydrogen 3.295 N/A LYS 41.A N THR 79.A O no hydrogen 3.257 N/A LYS 41.A NZ ASP 77.A O no hydrogen 2.995 N/A LYS 41.A NZ ALA 78.A O no hydrogen 3.331 N/A LEU 44.A N LYS 41.A O no hydrogen 3.207 N/A GLU 45.A N LYS 41.A O no hydrogen 2.774 N/A LYS 46.A N ALA 42.A O no hydrogen 3.199 N/A ALA 47.A N LEU 44.A O no hydrogen 2.975 N/A GLY 48.A N GLU 45.A O no hydrogen 3.085 N/A GLN 52.A N VAL 49.A O no hydrogen 2.760 N/A LEU 53.A N VAL 49.A O no hydrogen 3.186 N/A ARG 55.A N HIS 51.A O no hydrogen 3.356 N/A GLU 56.A N GLN 52.A O no hydrogen 2.820 N/A VAL 57.A N LEU 53.A O no hydrogen 3.150 N/A GLU 58.A N ARG 54.A O no hydrogen 3.324 N/A ILE 59.A N ARG 55.A O no hydrogen 2.945 N/A GLN 60.A N GLU 56.A O no hydrogen 3.008 N/A SER 61.A N VAL 57.A O no hydrogen 3.062 N/A SER 61.A OG VAL 57.A O no hydrogen 2.182 N/A SER 61.A OG GLU 58.A O no hydrogen 3.467 N/A HIS 62.A N ILE 59.A O no hydrogen 3.190 N/A LEU 63.A N GLN 60.A O no hydrogen 3.297 N/A ARG 64.A N TYR 121.A OH no hydrogen 3.053 N/A ASN 67.A N HIS 65.A ND1 no hydrogen 3.136 N/A ASN 67.A ND2 LEU 145.A O no hydrogen 2.951 N/A ILE 68.A N HIS 65.A O no hydrogen 3.086 N/A LEU 69.A N ILE 147.A O no hydrogen 2.975 N/A ARG 70.A N GLU 86.A OE2 no hydrogen 3.155 N/A TYR 72.A N ILE 84.A O no hydrogen 3.004 N/A PHE 75.A N TYR 82.A O no hydrogen 3.150 N/A ASP 77.A N ARG 80.A O no hydrogen 3.067 N/A ARG 80.A N ASP 77.A OD1 no hydrogen 2.675 N/A VAL 81.A N LEU 39.A O no hydrogen 2.680 N/A TYR 82.A N PHE 75.A O no hydrogen 2.984 N/A LEU 83.A N LYS 37.A O no hydrogen 2.921 N/A ILE 84.A N GLY 73.A O no hydrogen 3.152 N/A LEU 85.A N ALA 35.A O no hydrogen 2.644 N/A GLU 86.A N ARG 70.A O no hydrogen 3.174 N/A LEU 90.A N LEU 139.A O no hydrogen 3.180 N/A GLY 91.A N ALA 88.A O no hydrogen 3.336 N/A VAL 93.A N LEU 137.A O no hydrogen 2.900 N/A TYR 94.A N PRO 134.A O no hydrogen 3.256 N/A ARG 95.A N THR 92.A OG1 no hydrogen 2.991 N/A ARG 95.A NH2 GLN 98.A OE1 no hydrogen 3.115 N/A GLU 96.A N THR 92.A O no hydrogen 3.250 N/A LEU 97.A N VAL 93.A O no hydrogen 2.767 N/A GLN 98.A N TYR 94.A O no hydrogen 3.122 N/A LYS 99.A N ARG 95.A O no hydrogen 3.094 N/A LEU 100.A N GLU 96.A O no hydrogen 3.114 N/A SER 101.A N LEU 97.A O no hydrogen 2.866 N/A PHE 103.A N PHE 190.A O no hydrogen 2.990 N/A ARG 107.A N ASP 104.A OD1 no hydrogen 2.815 N/A THR 108.A N ASP 104.A O no hydrogen 3.031 N/A THR 108.A OG1 ASP 104.A O no hydrogen 2.923 N/A ALA 109.A N GLU 105.A O no hydrogen 2.955 N/A THR 110.A N GLN 106.A O no hydrogen 3.086 N/A THR 110.A OG1 GLN 106.A O no hydrogen 2.808 N/A THR 110.A OG1 SER 256.A OG no hydrogen 3.016 N/A TYR 111.A N ARG 107.A O no hydrogen 2.996 N/A ILE 112.A N THR 108.A O no hydrogen 3.094 N/A THR 113.A N ALA 109.A O no hydrogen 3.105 N/A THR 113.A OG1 ALA 109.A O no hydrogen 3.164 N/A THR 113.A OG1 SER 255.A OG no hydrogen 2.989 N/A GLU 114.A N THR 110.A O no hydrogen 3.080 N/A LEU 115.A N TYR 111.A O no hydrogen 2.989 N/A ALA 116.A N ILE 112.A O no hydrogen 2.890 N/A ASN 117.A N THR 113.A O no hydrogen 3.116 N/A ASN 117.A ND2 PRO 258.A O no hydrogen 3.583 N/A ALA 118.A N GLU 114.A O no hydrogen 3.235 N/A LEU 119.A N LEU 115.A O no hydrogen 2.927 N/A SER 120.A N ALA 116.A O no hydrogen 2.915 N/A TYR 121.A N ASN 117.A O no hydrogen 3.239 N/A CYS 122.A N ALA 118.A O no hydrogen 3.139 N/A CYS 122.A SG ALA 118.A O no hydrogen 3.357 N/A HIS 123.A N LEU 119.A O no hydrogen 3.043 N/A HIS 123.A NE2 ASP 179.A OD2 no hydrogen 2.664 N/A SER 124.A N SER 120.A O no hydrogen 3.211 N/A SER 124.A OG TYR 121.A O no hydrogen 2.725 N/A LYS 125.A N CYS 122.A O no hydrogen 3.115 N/A ARG 126.A N HIS 123.A O no hydrogen 2.963 N/A ARG 126.A NH1 GLU 176.A OE2 no hydrogen 2.980 N/A VAL 127.A N CYS 122.A O no hydrogen 2.737 N/A LYS 133.A NZ ASP 131.A OD2 no hydrogen 3.515 N/A GLU 135.A N GLU 135.A OE2 no hydrogen 3.080 N/A ASN 136.A N LYS 133.A O no hydrogen 2.815 N/A LEU 137.A N PRO 134.A O no hydrogen 3.244 N/A LEU 138.A N LYS 146.A O no hydrogen 2.863 N/A LEU 139.A N GLY 91.A O no hydrogen 2.840 N/A GLY 140.A N GLU 144.A O no hydrogen 2.935 N/A GLY 143.A N GLY 140.A O no hydrogen 2.727 N/A GLU 144.A N GLU 144.A OE1 no hydrogen 2.540 N/A LEU 145.A N GLU 114.A OE1 no hydrogen 2.917 N/A LYS 146.A N LEU 138.A O no hydrogen 2.698 N/A LYS 146.A NZ PRO 66.A O no hydrogen 2.782 N/A LYS 146.A NZ GLU 86.A OE1 no hydrogen 3.327 N/A ILE 147.A N ASN 67.A O no hydrogen 2.922 N/A ALA 148.A N ASN 136.A O no hydrogen 3.026 N/A GLY 151.A N ASP 149.A OD1 no hydrogen 3.346 N/A ASP 162.A N THR 160.A OG1 no hydrogen 3.319 N/A TYR 163.A OH GLU 189.A OE2 no hydrogen 2.814 N/A LEU 164.A N LEU 161.A O no hydrogen 2.999 N/A GLU 167.A N GLU 167.A OE1 no hydrogen 2.846 N/A MET 168.A N PRO 165.A O no hydrogen 3.192 N/A GLU 170.A N PRO 166.A O no hydrogen 3.219 N/A LYS 177.A N ASP 175.A OD1 no hydrogen 3.323 N/A LYS 177.A NZ ARG 239.A O no hydrogen 2.698 N/A LYS 177.A NZ PRO 240.A O no hydrogen 3.463 N/A VAL 178.A N ASP 175.A O no hydrogen 3.113 N/A ASP 179.A N GLU 176.A O no hydrogen 3.195 N/A TRP 181.A N LYS 177.A O no hydrogen 3.350 N/A SER 182.A N VAL 178.A O no hydrogen 3.277 N/A LEU 183.A N ASP 179.A O no hydrogen 3.039 N/A GLY 184.A N LEU 180.A O no hydrogen 3.365 N/A VAL 185.A N TRP 181.A O no hydrogen 3.126 N/A LEU 186.A N SER 182.A O no hydrogen 3.070 N/A CYS 187.A N LEU 183.A O no hydrogen 2.925 N/A TYR 188.A N GLY 184.A O no hydrogen 3.107 N/A TYR 188.A OH THR 215.A O no hydrogen 2.849 N/A GLU 189.A N VAL 185.A O no hydrogen 3.070 N/A PHE 190.A N LEU 186.A O no hydrogen 2.812 N/A LEU 191.A N CYS 187.A O no hydrogen 3.265 N/A VAL 192.A N TYR 188.A O no hydrogen 2.755 N/A GLY 193.A N GLU 189.A O no hydrogen 2.863 N/A GLU 198.A N PRO 195.A O no hydrogen 3.402 N/A GLN 203.A N GLN 203.A OE1 no hydrogen 2.793 N/A THR 205.A N THR 201.A O no hydrogen 3.122 N/A THR 205.A OG1 THR 201.A O no hydrogen 2.994 N/A TYR 206.A N TYR 202.A O no hydrogen 2.976 N/A TYR 206.A OH ILE 169.A O no hydrogen 3.334 N/A LYS 207.A N GLN 203.A O no hydrogen 3.374 N/A ARG 208.A N GLU 204.A O no hydrogen 3.106 N/A ILE 209.A N THR 205.A O no hydrogen 3.030 N/A SER 210.A N TYR 206.A O no hydrogen 2.975 N/A SER 210.A OG GLU 170.A OE1 no hydrogen 2.741 N/A ARG 211.A N LYS 207.A O no hydrogen 2.894 N/A ARG 211.A NE GLU 213.A OE2 no hydrogen 2.695 N/A VAL 212.A N ILE 209.A O no hydrogen 3.066 N/A GLU 213.A N ARG 208.A O no hydrogen 2.995 N/A VAL 220.A N PRO 217.A O no hydrogen 3.253 N/A THR 221.A OG1 GLU 105.A OE1 no hydrogen 3.018 N/A ARG 225.A N THR 221.A O no hydrogen 2.918 N/A ARG 225.A NE VAL 220.A O no hydrogen 2.734 N/A ARG 225.A NH2 VAL 220.A O no hydrogen 3.298 N/A ASP 226.A N GLU 222.A O no hydrogen 3.119 N/A ILE 228.A N ALA 224.A O no hydrogen 3.174 N/A SER 229.A N ARG 225.A O no hydrogen 2.945 N/A SER 229.A OG ARG 225.A O no hydrogen 2.990 N/A ARG 230.A N ASP 226.A O no hydrogen 3.014 N/A ARG 230.A NE ASP 226.A OD2 no hydrogen 2.828 N/A LEU 231.A N LEU 227.A O no hydrogen 3.016 N/A LEU 231.A N ILE 228.A O no hydrogen 3.004 N/A LEU 232.A N ILE 228.A O no hydrogen 2.920 N/A SER 237.A OG ASN 235.A OD1 no hydrogen 3.445 N/A GLN 238.A N ASN 235.A O no hydrogen 3.097 N/A ARG 239.A NE LYS 233.A O no hydrogen 3.101 N/A ARG 239.A NH1 GLU 167.A OE1 no hydrogen 2.698 N/A ARG 239.A NH1 GLU 167.A OE2 no hydrogen 3.372 N/A ARG 239.A NH1 LYS 233.A O no hydrogen 3.194 N/A ARG 239.A NH2 GLU 167.A OE2 no hydrogen 2.758 N/A ARG 239.A NH2 LYS 177.A O no hydrogen 3.102 N/A MET 241.A N GLU 244.A OE1 no hydrogen 3.168 N/A GLU 244.A N MET 241.A O no hydrogen 3.101 N/A VAL 245.A N MET 241.A O no hydrogen 3.288 N/A LEU 246.A N LEU 242.A O no hydrogen 3.097 N/A GLU 247.A N ARG 243.A O no hydrogen 3.104 N/A GLU 247.A N GLU 244.A O no hydrogen 3.047 N/A HIS 248.A N VAL 245.A O no hydrogen 3.240 N/A HIS 248.A NE2 ASP 226.A OD2 no hydrogen 2.991 N/A TRP 250.A N HIS 248.A ND1 no hydrogen 3.159 N/A TRP 250.A NE1 GLU 105.A OE1 no hydrogen 2.782 N/A THR 252.A N HIS 248.A O no hydrogen 2.872 N/A THR 252.A OG1 HIS 248.A O no hydrogen 3.290 N/A ALA 253.A N PRO 249.A O no hydrogen 3.199 N/A ASN 254.A N TRP 250.A O no hydrogen 3.185 N/A ASN 254.A ND2 TRP 250.A O no hydrogen 2.612 N/A SER 255.A N ILE 251.A O no hydrogen 2.787 N/A SER 255.A OG THR 113.A OG1 no hydrogen 2.989 N/A SER 255.A OG LYS 257.A O no hydrogen 3.488 N/A SER 256.A N THR 110.A OG1 no hydrogen 3.178 N/A SER 256.A OG THR 110.A OG1 no hydrogen 3.016 N/A LYS 257.A N SER 255.A OG no hydrogen 3.248 N/A