Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2ac3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 6.A N ASP 4.A OD1 no hydrogen 2.697 N/A SER 7.A N ASP 4.A OD1 no hydrogen 3.005 N/A SER 7.A OG ASP 4.A OD1 no hydrogen 3.373 N/A SER 7.A OG ASP 4.A OD2 no hydrogen 2.785 N/A ARG 9.A N ASP 12.A OD2 no hydrogen 2.963 N/A PHE 10.A N GLU 82.A OE1 no hydrogen 2.757 N/A ASP 12.A N ARG 9.A O no hydrogen 2.926 N/A VAL 13.A N ARG 9.A O no hydrogen 3.315 N/A TYR 14.A OH GLU 78.A OE1 no hydrogen 2.547 N/A GLN 15.A N ILE 33.A O no hydrogen 2.731 N/A GLN 17.A N THR 31.A O no hydrogen 3.065 N/A HIS 26.A ND1 GLN 49.A OE1 no hydrogen 2.856 N/A ARG 28.A N ILE 45.A O no hydrogen 3.258 N/A GLN 30.A N VAL 43.A O no hydrogen 3.014 N/A GLN 30.A NE2 GLN 17.A O no hydrogen 2.459 N/A THR 31.A OG1 ASP 19.A OD1 no hydrogen 2.655 N/A CYS 32.A N TYR 41.A O no hydrogen 2.908 N/A ILE 33.A N GLN 15.A O no hydrogen 2.742 N/A ASN 34.A N GLN 39.A O no hydrogen 2.945 N/A ASN 34.A ND2 THR 37.A O no hydrogen 2.833 N/A GLN 39.A N THR 37.A OG1 no hydrogen 3.212 N/A TYR 41.A N CYS 32.A O no hydrogen 2.821 N/A ALA 42.A N PHE 90.A O no hydrogen 3.026 N/A VAL 43.A N GLN 30.A O no hydrogen 2.981 N/A LYS 44.A N LEU 88.A O no hydrogen 2.799 N/A LYS 44.A NZ GLU 60.A OE1 no hydrogen 3.421 N/A LYS 44.A NZ GLU 60.A OE2 no hydrogen 2.766 N/A LYS 44.A NZ PHE 158.A O no hydrogen 3.009 N/A ILE 45.A N ARG 28.A O no hydrogen 2.769 N/A ILE 46.A N PHE 86.A O no hydrogen 2.886 N/A LYS 48.A N ASP 84.A O no hydrogen 2.781 N/A LYS 48.A NZ GLU 81.A OE2 no hydrogen 2.682 N/A LYS 48.A NZ GLU 82.A O no hydrogen 3.197 N/A LYS 48.A NZ GLU 83.A O no hydrogen 3.564 N/A ARG 54.A NH1 GLU 81.A OE1 no hydrogen 3.515 N/A ARG 54.A NH2 GLU 81.A OE2 no hydrogen 2.521 N/A ARG 56.A N ILE 53.A O no hydrogen 3.062 N/A PHE 58.A N ARG 54.A O no hydrogen 3.166 N/A ARG 59.A N SER 55.A O no hydrogen 3.015 N/A GLU 60.A N ARG 56.A O no hydrogen 3.022 N/A VAL 61.A N VAL 57.A O no hydrogen 2.935 N/A GLU 62.A N PHE 58.A O no hydrogen 2.842 N/A MET 63.A N ARG 59.A O no hydrogen 2.861 N/A LEU 64.A N GLU 60.A O no hydrogen 2.952 N/A TYR 65.A N VAL 61.A O no hydrogen 2.887 N/A GLN 66.A N GLU 62.A O no hydrogen 2.901 N/A CYS 67.A N LEU 64.A O no hydrogen 3.251 N/A CYS 67.A SG MET 63.A O no hydrogen 3.517 N/A GLN 68.A N TYR 65.A O no hydrogen 3.091 N/A GLN 68.A NE2 LEU 64.A O no hydrogen 3.312 N/A GLN 68.A NE2 LEU 74.A O no hydrogen 3.084 N/A ARG 71.A NH1 ASP 119.A OD1 no hydrogen 2.960 N/A ASN 72.A ND2 VAL 153.A O no hydrogen 2.872 N/A VAL 73.A N HIS 70.A O no hydrogen 3.092 N/A LEU 74.A N ILE 155.A O no hydrogen 2.998 N/A GLU 75.A N GLU 91.A OE1 no hydrogen 2.858 N/A LEU 76.A N GLN 68.A OE1 no hydrogen 2.760 N/A ILE 77.A N VAL 89.A O no hydrogen 2.569 N/A GLU 78.A N VAL 89.A O no hydrogen 3.094 N/A PHE 80.A N TYR 87.A O no hydrogen 2.802 N/A GLU 82.A N ARG 85.A O no hydrogen 2.900 N/A ARG 85.A N GLU 82.A O no hydrogen 3.151 N/A ARG 85.A NH1 TYR 87.A OH no hydrogen 3.489 N/A PHE 86.A N ILE 46.A O no hydrogen 2.780 N/A TYR 87.A N PHE 80.A O no hydrogen 2.885 N/A LEU 88.A N LYS 44.A O no hydrogen 2.840 N/A VAL 89.A N GLU 78.A O no hydrogen 2.571 N/A PHE 90.A N ALA 42.A O no hydrogen 2.657 N/A GLU 91.A N GLU 75.A O no hydrogen 3.076 N/A LYS 92.A NZ THR 31.A OG1 no hydrogen 2.803 N/A LYS 92.A NZ GLU 40.A OE1 no hydrogen 2.934 N/A GLY 95.A N CYS 144.A O no hydrogen 2.839 N/A GLY 96.A N MET 93.A O no hydrogen 3.026 N/A SER 97.A OG PRO 139.A O no hydrogen 2.923 N/A ILE 98.A N ILE 142.A O no hydrogen 2.783 N/A LEU 99.A N SER 97.A OG no hydrogen 2.998 N/A SER 100.A N SER 97.A O no hydrogen 3.072 N/A SER 100.A OG SER 97.A O no hydrogen 2.759 N/A HIS 101.A NE2 HIS 146.A O no hydrogen 3.126 N/A ILE 102.A N ILE 98.A O no hydrogen 2.949 N/A HIS 103.A N LEU 99.A O no hydrogen 3.064 N/A LYS 104.A N HIS 101.A O no hydrogen 3.096 N/A ARG 105.A N HIS 101.A O no hydrogen 2.821 N/A ARG 105.A NH1 GLU 112.A OE1 no hydrogen 2.783 N/A ARG 105.A NH1 GLU 112.A OE2 no hydrogen 3.466 N/A ARG 105.A NH2 GLU 112.A OE1 no hydrogen 3.445 N/A ARG 105.A NH2 GLU 112.A OE2 no hydrogen 2.563 N/A ARG 106.A N ILE 102.A O no hydrogen 2.665 N/A PHE 108.A N LEU 200.A O no hydrogen 2.856 N/A ASN 109.A N GLU 112.A OE2 no hydrogen 2.955 N/A ALA 113.A N ASN 109.A O no hydrogen 2.966 N/A SER 114.A N GLU 110.A O no hydrogen 2.903 N/A SER 114.A OG GLU 110.A O no hydrogen 3.271 N/A SER 114.A OG LEU 111.A O no hydrogen 2.723 N/A VAL 115.A N LEU 111.A O no hydrogen 3.415 N/A VAL 116.A N GLU 112.A O no hydrogen 3.406 N/A VAL 117.A N ALA 113.A O no hydrogen 3.061 N/A GLN 118.A N SER 114.A O no hydrogen 2.858 N/A ASP 119.A N VAL 115.A O no hydrogen 2.839 N/A VAL 120.A N VAL 116.A O no hydrogen 2.892 N/A ALA 121.A N VAL 117.A O no hydrogen 2.824 N/A SER 122.A N GLN 118.A O no hydrogen 3.019 N/A SER 122.A OG GLN 118.A O no hydrogen 2.651 N/A ALA 123.A N ASP 119.A O no hydrogen 3.092 N/A LEU 124.A N VAL 120.A O no hydrogen 2.910 N/A ASP 125.A N ALA 121.A O no hydrogen 2.788 N/A PHE 126.A N SER 122.A O no hydrogen 3.076 N/A LEU 127.A N ALA 123.A O no hydrogen 2.980 N/A HIS 128.A N LEU 124.A O no hydrogen 2.777 N/A HIS 128.A NE2 ASP 189.A OD1 no hydrogen 2.674 N/A ASN 129.A N ASP 125.A O no hydrogen 2.969 N/A LYS 130.A N LEU 127.A O no hydrogen 2.774 N/A LYS 130.A NZ GLN 66.A O no hydrogen 2.824 N/A GLY 131.A N HIS 128.A O no hydrogen 2.857 N/A ILE 132.A N LEU 127.A O no hydrogen 3.074 N/A HIS 134.A N ASP 189.A OD1 no hydrogen 2.805 N/A HIS 134.A NE2 CYS 156.A O no hydrogen 2.774 N/A ARG 135.A N ASP 189.A OD2 no hydrogen 2.808 N/A ARG 135.A NH1 ASP 185.A OD1 no hydrogen 2.759 N/A ASP 136.A N HIS 134.A ND1 no hydrogen 3.029 N/A GLU 140.A N GLU 140.A OE2 no hydrogen 2.777 N/A ASN 141.A N LYS 138.A O no hydrogen 2.832 N/A ILE 142.A N PRO 139.A O no hydrogen 3.092 N/A LEU 143.A N LYS 154.A O no hydrogen 2.784 N/A CYS 144.A N GLY 96.A O no hydrogen 2.693 N/A CYS 144.A SG VAL 150.A O no hydrogen 3.407 N/A GLU 145.A N PRO 152.A O no hydrogen 3.065 N/A GLN 149.A NE2 SER 151.A O no hydrogen 2.767 N/A VAL 153.A N ASP 119.A OD2 no hydrogen 3.027 N/A LYS 154.A N LEU 143.A O no hydrogen 2.818 N/A LYS 154.A NZ GLU 91.A OE1 no hydrogen 2.760 N/A LYS 154.A NZ GLU 91.A OE2 no hydrogen 3.355 N/A ILE 155.A N ASN 72.A O no hydrogen 2.770 N/A CYS 156.A N ASN 141.A O no hydrogen 2.922 N/A ASP 159.A N ASP 157.A OD1 no hydrogen 3.000 N/A TYR 168.A N SER 165.A O no hydrogen 3.098 N/A MET 169.A N ALA 166.A O no hydrogen 3.170 N/A GLU 172.A N GLU 172.A OE1 no hydrogen 2.760 N/A VAL 173.A N ALA 170.A O no hydrogen 2.781 N/A VAL 174.A N ALA 170.A O no hydrogen 2.957 N/A GLU 175.A N PRO 171.A O no hydrogen 2.864 N/A ALA 176.A N GLU 172.A O no hydrogen 3.021 N/A PHE 177.A N VAL 173.A O no hydrogen 3.221 N/A PHE 177.A N VAL 174.A O no hydrogen 3.100 N/A SER 178.A N GLU 175.A O no hydrogen 3.120 N/A SER 178.A OG GLU 175.A O no hydrogen 2.575 N/A ALA 181.A N SER 178.A OG no hydrogen 3.065 N/A SER 182.A N SER 178.A O no hydrogen 3.381 N/A SER 182.A OG GLU 179.A O no hydrogen 2.570 N/A ILE 183.A N GLU 179.A O no hydrogen 3.182 N/A TYR 184.A N GLU 180.A O no hydrogen 2.957 N/A ASP 185.A N ALA 181.A O no hydrogen 3.083 N/A LYS 186.A N ILE 183.A O no hydrogen 3.300 N/A LYS 186.A NZ SER 182.A O no hydrogen 2.910 N/A ARG 187.A N TYR 184.A O no hydrogen 2.875 N/A ARG 187.A NH2 ALA 261.A O no hydrogen 3.006 N/A ARG 187.A NH2 LYS 262.A O no hydrogen 3.367 N/A CYS 188.A SG ASP 185.A O no hydrogen 3.461 N/A ASP 189.A N LYS 186.A O no hydrogen 3.107 N/A LEU 190.A N ARG 187.A O no hydrogen 2.956 N/A TRP 191.A N ARG 187.A O no hydrogen 3.174 N/A SER 192.A N CYS 188.A O no hydrogen 3.128 N/A SER 192.A OG CYS 188.A O no hydrogen 3.060 N/A LEU 193.A N ASP 189.A O no hydrogen 2.912 N/A GLY 194.A N LEU 190.A O no hydrogen 2.917 N/A VAL 195.A N TRP 191.A O no hydrogen 2.917 N/A ILE 196.A N SER 192.A O no hydrogen 2.995 N/A LEU 197.A N LEU 193.A O no hydrogen 2.853 N/A TYR 198.A N GLY 194.A O no hydrogen 3.055 N/A TYR 198.A OH GLU 236.A O no hydrogen 2.623 N/A ILE 199.A N VAL 195.A O no hydrogen 3.083 N/A LEU 200.A N ILE 196.A O no hydrogen 2.897 N/A LEU 201.A N LEU 197.A O no hydrogen 3.101 N/A SER 202.A N TYR 198.A O no hydrogen 3.106 N/A SER 202.A OG TYR 198.A O no hydrogen 2.827 N/A GLY 203.A N ILE 199.A O no hydrogen 2.618 N/A TYR 204.A N SER 202.A OG no hydrogen 3.382 N/A TYR 204.A OH ASP 241.A OD1 no hydrogen 2.749 N/A CYS 222.A SG GLY 209.A O no hydrogen 3.795 N/A GLN 223.A N CYS 219.A O no hydrogen 3.276 N/A ASN 224.A N PRO 220.A O no hydrogen 3.012 N/A MET 225.A N ALA 221.A O no hydrogen 3.011 N/A LEU 226.A N CYS 222.A O no hydrogen 2.897 N/A PHE 227.A N GLN 223.A O no hydrogen 2.958 N/A GLU 228.A N ASN 224.A O no hydrogen 3.020 N/A SER 229.A N MET 225.A O no hydrogen 2.802 N/A ILE 230.A N LEU 226.A O no hydrogen 2.843 N/A GLN 231.A N PHE 227.A O no hydrogen 2.991 N/A GLU 232.A N GLU 228.A O no hydrogen 2.888 N/A GLY 233.A N SER 229.A O no hydrogen 2.936 N/A ASP 241.A N PRO 238.A O no hydrogen 3.196 N/A TRP 242.A N PRO 238.A O no hydrogen 2.881 N/A TRP 242.A N ASP 239.A O no hydrogen 3.273 N/A ALA 243.A N ASP 239.A O no hydrogen 2.928 N/A ILE 245.A N TRP 242.A O no hydrogen 3.104 N/A SER 246.A N GLU 110.A OE2 no hydrogen 2.869 N/A SER 246.A OG GLU 110.A OE1 no hydrogen 2.695 N/A SER 246.A OG GLU 110.A OE2 no hydrogen 3.567 N/A ALA 249.A N SER 246.A OG no hydrogen 3.105 N/A LYS 250.A N SER 246.A O no hydrogen 3.301 N/A LYS 250.A NZ TRP 242.A O no hydrogen 3.239 N/A ASP 251.A N CYS 247.A O no hydrogen 2.794 N/A LEU 252.A N ALA 248.A O no hydrogen 2.988 N/A ILE 253.A N ALA 249.A O no hydrogen 3.106 N/A SER 254.A N LYS 250.A O no hydrogen 2.920 N/A SER 254.A OG LYS 250.A O no hydrogen 3.327 N/A SER 254.A OG ASP 251.A O no hydrogen 2.691 N/A LYS 255.A N ASP 251.A O no hydrogen 3.078 N/A LYS 255.A N LEU 252.A O no hydrogen 2.987 N/A LYS 255.A NZ ASP 251.A OD1 no hydrogen 2.739 N/A LYS 255.A NZ ASP 251.A OD2 no hydrogen 3.201 N/A LEU 256.A N ILE 253.A O no hydrogen 3.035 N/A LEU 257.A N ILE 253.A O no hydrogen 2.836 N/A ARG 259.A NH1 GLN 231.A O no hydrogen 3.488 N/A LYS 262.A NZ ASP 260.A OD1 no hydrogen 3.433 N/A GLN 263.A N ASP 260.A O no hydrogen 2.904 N/A ARG 264.A N ASP 260.A O no hydrogen 3.190 N/A ARG 264.A N ALA 261.A O no hydrogen 3.346 N/A ARG 264.A NE VAL 258.A O no hydrogen 2.834 N/A ARG 264.A NH1 VAL 258.A O no hydrogen 2.797 N/A ARG 264.A NH2 ARG 187.A O no hydrogen 2.930 N/A LEU 265.A N LYS 255.A O no hydrogen 3.260 N/A SER 266.A N GLN 269.A OE1 no hydrogen 2.830 N/A GLN 269.A N SER 266.A OG no hydrogen 3.066 N/A VAL 270.A N SER 266.A O no hydrogen 2.960 N/A LEU 271.A N ALA 267.A O no hydrogen 3.073 N/A GLN 272.A N GLN 269.A O no hydrogen 3.002 N/A HIS 273.A N VAL 270.A O no hydrogen 3.073 N/A TRP 275.A NE1 GLU 110.A OE1 no hydrogen 2.755 N/A VAL 276.A N HIS 273.A O no hydrogen 2.822 N/A