Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4c3r_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 3.A N ASP 6.A OD2 no hydrogen 2.937 N/A ASP 6.A N ALA 3.A O no hydrogen 2.653 N/A PHE 7.A N LEU 4.A O no hydrogen 3.358 N/A GLU 8.A N ARG 25.A O no hydrogen 2.841 N/A GLY 10.A N LEU 23.A O no hydrogen 2.701 N/A ARG 11.A NH1 PRO 12.A O no hydrogen 3.075 N/A LEU 13.A N VAL 21.A O no hydrogen 2.777 N/A GLY 16.A N GLY 19.A O no hydrogen 2.713 N/A VAL 21.A N GLY 14.A O no hydrogen 3.052 N/A TYR 22.A N LEU 35.A O no hydrogen 2.973 N/A LEU 23.A N ARG 11.A O no hydrogen 2.952 N/A ALA 24.A N LEU 33.A O no hydrogen 2.819 N/A ARG 25.A N GLU 8.A O no hydrogen 2.765 N/A ARG 25.A NH2 GLU 8.A OE1 no hydrogen 2.968 N/A GLU 26.A N PHE 31.A O no hydrogen 2.993 N/A LYS 27.A N ASP 6.A O no hydrogen 3.115 N/A LYS 27.A NZ GLU 5.A O no hydrogen 3.059 N/A GLN 28.A N GLU 26.A OE2 no hydrogen 3.130 N/A SER 29.A N GLU 26.A OE1 no hydrogen 2.833 N/A SER 29.A OG GLU 26.A OE1 no hydrogen 2.412 N/A PHE 31.A N SER 29.A OG no hydrogen 3.301 N/A LEU 33.A N ALA 24.A O no hydrogen 2.849 N/A ALA 34.A N LEU 84.A O no hydrogen 2.823 N/A LEU 35.A N TYR 22.A O no hydrogen 2.867 N/A LYS 36.A N LEU 82.A O no hydrogen 2.797 N/A VAL 37.A N ASN 20.A O no hydrogen 2.882 N/A LEU 38.A N VAL 80.A O no hydrogen 2.743 N/A PHE 39.A N PHE 18.A O no hydrogen 2.960 N/A LYS 40.A N THR 78.A O no hydrogen 2.945 N/A LYS 40.A NZ ASP 76.A O no hydrogen 2.698 N/A GLN 42.A N GLN 42.A OE1 no hydrogen 3.279 N/A LEU 43.A N LYS 40.A O no hydrogen 2.991 N/A GLU 44.A N LYS 40.A O no hydrogen 2.821 N/A LYS 45.A N ALA 41.A O no hydrogen 2.773 N/A GLY 47.A N GLU 44.A O no hydrogen 3.283 N/A VAL 48.A N LEU 43.A O no hydrogen 3.087 N/A GLU 49.A N LEU 43.A O no hydrogen 3.429 N/A GLN 51.A NE2 GLN 51.A O no hydrogen 2.967 N/A LEU 52.A N VAL 48.A O no hydrogen 3.055 N/A GLU 55.A N GLN 51.A O no hydrogen 3.306 N/A VAL 56.A N LEU 52.A O no hydrogen 2.722 N/A GLU 57.A N ARG 53.A O no hydrogen 3.192 N/A ILE 58.A N ARG 54.A O no hydrogen 2.993 N/A GLN 59.A N GLU 55.A O no hydrogen 2.762 N/A SER 60.A N VAL 56.A O no hydrogen 2.395 N/A SER 60.A OG VAL 56.A O no hydrogen 3.174 N/A LEU 62.A N GLN 59.A O no hydrogen 3.173 N/A ARG 63.A N TYR 120.A OH no hydrogen 2.933 N/A ASN 66.A N HIS 64.A ND1 no hydrogen 3.245 N/A ASN 66.A ND2 GLU 113.A O no hydrogen 3.360 N/A ILE 67.A N HIS 64.A O no hydrogen 3.146 N/A LEU 68.A N ILE 146.A O no hydrogen 2.810 N/A ARG 69.A N GLU 85.A OE1 no hydrogen 3.140 N/A ARG 69.A NE ILE 67.A O no hydrogen 3.272 N/A ARG 69.A NH2 ILE 67.A O no hydrogen 2.794 N/A TYR 71.A N ILE 83.A O no hydrogen 2.780 N/A PHE 74.A N TYR 81.A O no hydrogen 3.226 N/A ASP 76.A N ARG 79.A O no hydrogen 3.036 N/A THR 78.A OG1 ALA 77.A O no hydrogen 2.618 N/A VAL 80.A N LEU 38.A O no hydrogen 2.693 N/A TYR 81.A N PHE 74.A O no hydrogen 3.070 N/A TYR 81.A OH ASP 76.A OD2 no hydrogen 2.568 N/A LEU 82.A N LYS 36.A O no hydrogen 2.812 N/A ILE 83.A N GLY 72.A O no hydrogen 3.246 N/A LEU 84.A N ALA 34.A O no hydrogen 2.713 N/A GLU 85.A N ARG 69.A O no hydrogen 2.973 N/A LEU 89.A N LEU 138.A O no hydrogen 3.074 N/A VAL 92.A N LEU 136.A O no hydrogen 2.758 N/A TYR 93.A N PRO 133.A O no hydrogen 3.009 N/A ARG 94.A N THR 91.A OG1 no hydrogen 2.819 N/A GLU 95.A N THR 91.A O no hydrogen 3.243 N/A LEU 96.A N VAL 92.A O no hydrogen 2.799 N/A GLN 97.A N TYR 93.A O no hydrogen 3.022 N/A LYS 98.A N ARG 94.A O no hydrogen 2.905 N/A LEU 99.A N GLU 95.A O no hydrogen 3.004 N/A SER 100.A N LEU 96.A O no hydrogen 2.589 N/A PHE 102.A N PHE 186.A O no hydrogen 2.793 N/A ARG 106.A N ASP 103.A OD1 no hydrogen 2.690 N/A ARG 106.A NE TYR 110.A OH no hydrogen 3.257 N/A THR 107.A N ASP 103.A O no hydrogen 3.170 N/A THR 107.A OG1 ASP 103.A O no hydrogen 2.813 N/A ALA 108.A N GLU 104.A O no hydrogen 2.915 N/A THR 109.A N GLN 105.A O no hydrogen 2.755 N/A THR 109.A OG1 GLN 105.A O no hydrogen 2.524 N/A TYR 110.A N ARG 106.A O no hydrogen 2.927 N/A TYR 110.A OH GLU 95.A OE1 no hydrogen 2.733 N/A ILE 111.A N THR 107.A O no hydrogen 3.001 N/A THR 112.A N ALA 108.A O no hydrogen 2.881 N/A THR 112.A OG1 ALA 108.A O no hydrogen 3.314 N/A THR 112.A OG1 SER 251.A OG no hydrogen 2.379 N/A GLU 113.A N THR 109.A O no hydrogen 2.894 N/A LEU 114.A N TYR 110.A O no hydrogen 2.868 N/A ALA 115.A N ILE 111.A O no hydrogen 2.802 N/A ASN 116.A N THR 112.A O no hydrogen 3.140 N/A ALA 117.A N GLU 113.A O no hydrogen 3.063 N/A LEU 118.A N LEU 114.A O no hydrogen 2.720 N/A SER 119.A N ALA 115.A O no hydrogen 2.527 N/A SER 119.A OG ALA 115.A O no hydrogen 2.864 N/A SER 119.A OG ASN 116.A O no hydrogen 3.038 N/A TYR 120.A N ASN 116.A O no hydrogen 2.890 N/A CYS 121.A N ALA 117.A O no hydrogen 3.127 N/A CYS 121.A SG ALA 117.A O no hydrogen 3.528 N/A HIS 122.A N LEU 118.A O no hydrogen 2.592 N/A HIS 122.A NE2 ASP 175.A OD2 no hydrogen 2.838 N/A SER 123.A N SER 119.A O no hydrogen 2.806 N/A SER 123.A OG TYR 120.A O no hydrogen 2.999 N/A LYS 124.A NZ TYR 120.A OH no hydrogen 3.308 N/A ARG 125.A N HIS 122.A O no hydrogen 2.772 N/A VAL 126.A N CYS 121.A O no hydrogen 2.898 N/A ILE 127.A N TRP 151.A O no hydrogen 2.617 N/A HIS 128.A NE2 ASP 148.A O no hydrogen 2.718 N/A ARG 129.A NH2 THR 156.A O no hydrogen 2.915 N/A ILE 131.A N ARG 129.A O no hydrogen 2.527 N/A LYS 132.A NZ ASP 130.A OD1 no hydrogen 2.652 N/A ASN 135.A N LYS 132.A O no hydrogen 2.853 N/A ASN 135.A ND2 ASP 130.A O no hydrogen 2.908 N/A ASN 135.A ND2 ASP 130.A OD2 no hydrogen 3.146 N/A LEU 137.A N LYS 145.A O no hydrogen 3.147 N/A LEU 138.A N GLY 90.A O no hydrogen 2.707 N/A GLY 139.A N GLU 143.A O no hydrogen 2.965 N/A ALA 141.A N GLU 143.A OE1 no hydrogen 3.243 N/A GLY 142.A N GLY 139.A O no hydrogen 2.682 N/A GLU 143.A N GLU 143.A OE1 no hydrogen 2.793 N/A LEU 144.A N GLU 113.A OE1 no hydrogen 2.531 N/A LYS 145.A N LEU 137.A O no hydrogen 2.744 N/A LYS 145.A NZ PRO 65.A O no hydrogen 2.804 N/A LYS 145.A NZ GLU 85.A OE2 no hydrogen 2.871 N/A ILE 146.A N ASN 66.A O no hydrogen 3.442 N/A ALA 147.A N ASN 135.A O no hydrogen 3.155 N/A GLY 150.A N GLU 55.A OE2 no hydrogen 3.237 N/A SER 152.A OG ARG 125.A O no hydrogen 3.194 N/A TYR 159.A OH GLU 185.A OE1 no hydrogen 2.526 N/A LEU 160.A N LEU 157.A O no hydrogen 3.103 N/A GLU 163.A N GLU 163.A OE1 no hydrogen 3.192 N/A MET 164.A N PRO 161.A O no hydrogen 3.179 N/A ILE 165.A N PRO 162.A O no hydrogen 2.959 N/A GLU 166.A N PRO 162.A O no hydrogen 2.946 N/A HIS 170.A ND1 ARG 168.A O no hydrogen 2.668 N/A LYS 173.A NZ ARG 235.A O no hydrogen 2.770 N/A LYS 173.A NZ PRO 236.A O no hydrogen 2.550 N/A VAL 174.A N ASP 171.A O no hydrogen 2.949 N/A ASP 175.A N GLU 172.A O no hydrogen 3.139 N/A LEU 176.A N LYS 173.A O no hydrogen 2.735 N/A TRP 177.A N LYS 173.A O no hydrogen 3.261 N/A SER 178.A N VAL 174.A O no hydrogen 3.173 N/A SER 178.A OG VAL 174.A O no hydrogen 3.042 N/A LEU 179.A N ASP 175.A O no hydrogen 3.152 N/A GLY 180.A N LEU 176.A O no hydrogen 3.211 N/A VAL 181.A N TRP 177.A O no hydrogen 2.946 N/A LEU 182.A N SER 178.A O no hydrogen 2.740 N/A CYS 183.A N LEU 179.A O no hydrogen 2.679 N/A TYR 184.A N GLY 180.A O no hydrogen 2.945 N/A TYR 184.A OH THR 211.A O no hydrogen 2.755 N/A GLU 185.A N VAL 181.A O no hydrogen 2.821 N/A PHE 186.A N LEU 182.A O no hydrogen 2.963 N/A LEU 187.A N CYS 183.A O no hydrogen 3.084 N/A VAL 188.A N TYR 184.A O no hydrogen 2.848 N/A GLY 189.A N GLU 185.A O no hydrogen 2.973 N/A LYS 190.A NZ GLU 194.A OE1 no hydrogen 3.370 N/A GLU 194.A N PRO 191.A O no hydrogen 3.312 N/A GLU 200.A N THR 197.A O no hydrogen 3.297 N/A GLU 200.A N THR 197.A OG1 no hydrogen 2.903 N/A THR 201.A N THR 197.A O no hydrogen 3.130 N/A THR 201.A OG1 PHE 193.A O no hydrogen 3.526 N/A THR 201.A OG1 THR 197.A O no hydrogen 3.252 N/A TYR 202.A N TYR 198.A O no hydrogen 3.038 N/A ARG 204.A N GLU 200.A O no hydrogen 2.684 N/A ARG 204.A NH1 GLU 194.A O no hydrogen 3.062 N/A ARG 204.A NH2 GLU 200.A OE2 no hydrogen 3.309 N/A ILE 205.A N THR 201.A O no hydrogen 2.720 N/A SER 206.A N TYR 202.A O no hydrogen 2.634 N/A SER 206.A OG GLU 166.A OE2 no hydrogen 2.458 N/A ARG 207.A N LYS 203.A O no hydrogen 3.050 N/A ARG 207.A NE GLU 209.A OE2 no hydrogen 3.301 N/A ARG 207.A NH2 GLU 209.A OE2 no hydrogen 3.108 N/A VAL 208.A N ILE 205.A O no hydrogen 2.930 N/A GLU 209.A N ARG 204.A O no hydrogen 2.895 N/A VAL 216.A N PRO 213.A O no hydrogen 3.229 N/A THR 217.A OG1 GLU 104.A OE2 no hydrogen 2.821 N/A GLU 218.A N GLU 218.A OE1 no hydrogen 2.714 N/A ARG 221.A N THR 217.A O no hydrogen 2.929 N/A ARG 221.A NE VAL 216.A O no hydrogen 2.645 N/A ARG 221.A NH2 VAL 216.A O no hydrogen 3.195 N/A ASP 222.A N GLU 218.A O no hydrogen 3.155 N/A LEU 223.A N GLY 219.A O no hydrogen 3.237 N/A ILE 224.A N ALA 220.A O no hydrogen 2.741 N/A SER 225.A N ARG 221.A O no hydrogen 2.853 N/A SER 225.A OG ARG 221.A O no hydrogen 2.571 N/A ARG 226.A N ASP 222.A O no hydrogen 2.841 N/A LEU 227.A N LEU 223.A O no hydrogen 2.890 N/A LEU 228.A N ILE 224.A O no hydrogen 2.840 N/A HIS 230.A NE2 GLU 166.A OE2 no hydrogen 3.329 N/A ASN 231.A ND2 GLN 234.A OE1 no hydrogen 3.452 N/A GLN 234.A N ASN 231.A O no hydrogen 3.262 N/A ARG 235.A N PRO 232.A O no hydrogen 3.053 N/A ARG 235.A NE LYS 229.A O no hydrogen 2.768 N/A ARG 235.A NH1 GLU 163.A OE2 no hydrogen 2.641 N/A ARG 235.A NH1 LYS 173.A O no hydrogen 3.136 N/A ARG 235.A NH2 GLU 163.A OE1 no hydrogen 2.718 N/A ARG 235.A NH2 GLU 163.A OE2 no hydrogen 3.295 N/A ARG 235.A NH2 LYS 229.A O no hydrogen 3.115 N/A ARG 235.A NH2 HIS 230.A O no hydrogen 3.370 N/A MET 237.A N GLU 240.A OE2 no hydrogen 3.138 N/A GLU 240.A N MET 237.A O no hydrogen 3.150 N/A LEU 242.A N LEU 238.A O no hydrogen 3.018 N/A GLU 243.A N ARG 239.A O no hydrogen 2.959 N/A HIS 244.A NE2 ASP 222.A OD2 no hydrogen 2.815 N/A TRP 246.A N HIS 244.A ND1 no hydrogen 3.340 N/A TRP 246.A NE1 GLU 104.A OE2 no hydrogen 2.813 N/A THR 248.A N HIS 244.A O no hydrogen 2.934 N/A THR 248.A OG1 LEU 242.A O no hydrogen 3.414 N/A ALA 249.A N PRO 245.A O no hydrogen 2.979 N/A ASN 250.A N ILE 247.A O no hydrogen 2.863 N/A ASN 250.A ND2 TRP 246.A O no hydrogen 2.501 N/A SER 251.A N ILE 247.A O no hydrogen 2.745 N/A SER 251.A OG ALA 108.A O no hydrogen 3.013 N/A SER 251.A OG THR 112.A OG1 no hydrogen 2.379 N/A SER 251.A OG ILE 247.A O no hydrogen 3.546 N/A