Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4er3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 4.A N TYR 17.A O no hydrogen 2.894 N/A LEU 6.A N ALA 15.A O no hydrogen 2.826 N/A LYS 7.A N ASN 76.A OD1 no hydrogen 2.690 N/A LYS 7.A NZ ASP 80.A OD1 no hydrogen 2.495 N/A LYS 7.A NZ ASP 80.A OD2 no hydrogen 3.060 N/A SER 8.A OG TRP 195.A O no hydrogen 2.779 N/A VAL 10.A N SER 8.A OG no hydrogen 2.804 N/A ALA 12.A N SER 8.A OG no hydrogen 3.306 N/A ALA 15.A N LEU 6.A O no hydrogen 2.948 N/A TYR 17.A N LEU 4.A O no hydrogen 2.847 N/A TYR 17.A OH GLU 33.A OE2 no hydrogen 2.638 N/A TYR 24.A N HIS 28.A O no hydrogen 2.828 N/A TYR 24.A OH GLU 33.A OE1 no hydrogen 2.496 N/A ASP 25.A N HIS 28.A O no hydrogen 3.162 N/A HIS 27.A N ASP 25.A OD1 no hydrogen 2.616 N/A HIS 28.A N ASP 25.A O no hydrogen 3.222 N/A HIS 28.A ND1 ASP 25.A OD2 no hydrogen 3.156 N/A ALA 30.A N PRO 22.A O no hydrogen 2.863 N/A HIS 32.A N ASP 29.A OD1 no hydrogen 3.128 N/A HIS 32.A ND1 ASP 29.A OD1 no hydrogen 2.777 N/A GLU 33.A N ASP 29.A O no hydrogen 3.146 N/A ILE 34.A N ALA 30.A O no hydrogen 2.912 N/A ILE 35.A N ALA 31.A O no hydrogen 3.121 N/A GLU 36.A N HIS 32.A O no hydrogen 2.803 N/A THR 37.A N GLU 33.A O no hydrogen 2.786 N/A THR 37.A OG1 GLU 33.A O no hydrogen 2.651 N/A THR 37.A OG1 HIS 106.A NE2 no hydrogen 3.006 N/A THR 37.A OG1 TYR 196.A OH no hydrogen 3.356 N/A ILE 38.A N ILE 34.A O no hydrogen 2.999 N/A ARG 39.A N ILE 35.A O no hydrogen 3.004 N/A ARG 39.A NE VAL 56.A O no hydrogen 2.998 N/A ARG 39.A NH2 VAL 56.A O no hydrogen 3.029 N/A TRP 40.A N GLU 36.A O no hydrogen 2.845 N/A VAL 41.A N THR 37.A O no hydrogen 2.900 N/A CYS 42.A N ILE 38.A O no hydrogen 2.947 N/A CYS 42.A SG ILE 38.A O no hydrogen 3.599 N/A GLU 43.A N ARG 39.A O no hydrogen 3.130 N/A GLU 44.A N TRP 40.A O no hydrogen 2.906 N/A ILE 45.A N VAL 41.A O no hydrogen 3.147 N/A LYS 49.A N ILE 45.A O no hydrogen 3.213 N/A LYS 49.A NZ GLU 43.A OE1 no hydrogen 2.929 N/A LYS 49.A NZ GLU 43.A OE2 no hydrogen 2.835 N/A LEU 50.A N PRO 46.A O no hydrogen 2.875 N/A ALA 51.A N ASP 47.A O no hydrogen 2.759 N/A MET 52.A N LEU 48.A O no hydrogen 3.025 N/A GLU 53.A N LEU 50.A O no hydrogen 3.181 N/A TYR 55.A N MET 52.A O no hydrogen 2.793 N/A VAL 56.A N MET 52.A O no hydrogen 2.954 N/A TYR 60.A N ILE 58.A O no hydrogen 2.990 N/A ASP 61.A N SER 67.A OG no hydrogen 3.228 N/A LYS 63.A N ASP 61.A OD1 no hydrogen 3.418 N/A SER 64.A N ASP 61.A O no hydrogen 3.366 N/A SER 64.A OG ASP 61.A OD2 no hydrogen 2.592 N/A MET 68.A N SER 64.A O no hydrogen 3.141 N/A GLN 69.A N.A PHE 65.A O no hydrogen 2.691 N/A GLN 69.A N.B PHE 65.A O no hydrogen 2.688 N/A GLN 69.A NE2.B GLN 69.A O.B no hydrogen 2.470 N/A ARG 70.A N GLU 66.A O no hydrogen 2.847 N/A LEU 71.A N SER 67.A O no hydrogen 3.170 N/A CYS 72.A N MET 68.A O no hydrogen 2.999 N/A CYS 72.A SG MET 68.A O no hydrogen 3.430 N/A ASP 73.A N GLN 69.A O.A no hydrogen 3.028 N/A ASP 73.A N GLN 69.A O.B no hydrogen 3.026 N/A LYS 74.A N ARG 70.A O no hydrogen 2.980 N/A TYR 75.A N LEU 71.A O no hydrogen 3.033 N/A TYR 75.A OH LYS 7.A O no hydrogen 2.529 N/A ASN 76.A N CYS 72.A O no hydrogen 2.669 N/A ASN 76.A ND2 ARG 5.A O no hydrogen 2.855 N/A ARG 77.A N ASP 73.A O no hydrogen 2.920 N/A ALA 78.A N LYS 74.A O no hydrogen 3.226 N/A ILE 79.A N TYR 75.A O no hydrogen 2.891 N/A ASP 80.A N ASN 76.A O no hydrogen 3.061 N/A SER 81.A N ARG 77.A O no hydrogen 2.947 N/A ILE 82.A N ALA 78.A O no hydrogen 2.913 N/A HIS 83.A N ILE 79.A O no hydrogen 2.816 N/A HIS 83.A NE2 PRO 9.A O no hydrogen 3.110 N/A GLN 84.A N ASP 80.A O no hydrogen 3.061 N/A LEU 85.A N SER 81.A O no hydrogen 3.038 N/A TRP 86.A N ILE 82.A O no hydrogen 2.886 N/A LYS 87.A N HIS 83.A O no hydrogen 3.308 N/A GLY 88.A N GLN 84.A O no hydrogen 3.347 N/A ARG 98.A NH1 ALA 163.A O no hydrogen 2.815 N/A LEU 103.A N SER 100.A OG no hydrogen 3.260 N/A LEU 104.A N SER 100.A O no hydrogen 2.958 N/A ARG 105.A N THR 101.A O no hydrogen 2.872 N/A ARG 105.A NH2 ASP 129.A OD1 no hydrogen 2.967 N/A HIS 106.A N GLY 102.A O no hydrogen 3.064 N/A HIS 106.A NE2 THR 37.A OG1 no hydrogen 3.006 N/A ILE 107.A N LEU 103.A O no hydrogen 2.744 N/A LEU 108.A N LEU 104.A O no hydrogen 2.878 N/A GLN 109.A N ARG 105.A O no hydrogen 3.055 N/A GLN 110.A N HIS 106.A O no hydrogen 3.014 N/A GLN 110.A NE2 GLU 33.A OE2 no hydrogen 2.860 N/A VAL 111.A N ILE 107.A O no hydrogen 2.778 N/A TYR 112.A N LEU 108.A O no hydrogen 2.891 N/A ASN 113.A N GLN 109.A O no hydrogen 2.836 N/A ASN 113.A ND2 GLN 109.A OE1 no hydrogen 2.971 N/A HIS 114.A N GLN 110.A O no hydrogen 2.818 N/A HIS 114.A NE2 GLU 33.A OE2 no hydrogen 2.675 N/A SER 115.A N VAL 111.A O no hydrogen 2.993 N/A SER 115.A N TYR 112.A O no hydrogen 3.033 N/A SER 115.A OG VAL 111.A O no hydrogen 2.522 N/A VAL 116.A N TYR 112.A O no hydrogen 2.830 N/A GLU 120.A N ASP 118.A OD1 no hydrogen 3.309 N/A LYS 121.A N ASP 118.A O no hydrogen 3.366 N/A ASN 123.A N GLU 120.A O no hydrogen 2.909 N/A VAL 131.A N SER 127.A O no hydrogen 2.872 N/A ALA 132.A N PHE 128.A O no hydrogen 2.862 N/A GLN 133.A N ASP 129.A O no hydrogen 2.928 N/A GLN 133.A NE2 GLU 137.A OE1 no hydrogen 2.682 N/A GLN 133.A NE2 SER 284.A O no hydrogen 2.642 N/A MET 134.A N LEU 130.A O no hydrogen 3.087 N/A ILE 135.A N VAL 131.A O no hydrogen 2.896 N/A ASP 136.A N ALA 132.A O no hydrogen 3.093 N/A GLU 137.A N GLN 133.A O no hydrogen 2.931 N/A ILE 138.A N MET 134.A O no hydrogen 2.819 N/A THR 141.A N ASP 144.A OD2 no hydrogen 3.088 N/A ASP 142.A N ASP 142.A OD1 no hydrogen 2.600 N/A ASP 143.A N THR 141.A OG1 no hydrogen 3.342 N/A ASP 144.A N THR 141.A O no hydrogen 2.853 N/A LEU 145.A N SER 223.A OG no hydrogen 2.684 N/A PHE 146.A N HIS 168.A O no hydrogen 3.108 N/A VAL 147.A N VAL 224.A O no hydrogen 2.895 N/A ASP 148.A N TYR 170.A O no hydrogen 2.948 N/A LEU 149.A N PHE 226.A O no hydrogen 3.064 N/A SER 151.A N VAL 172.A O no hydrogen 2.806 N/A GLY 152.A N GLU 173.A OE1 no hydrogen 2.814 N/A GLY 154.A N SER 151.A O no hydrogen 3.030 N/A GLN 155.A N GLN 155.A OE1 no hydrogen 2.635 N/A LEU 158.A N GLY 154.A O no hydrogen 2.996 N/A GLN 159.A N GLN 155.A O no hydrogen 2.863 N/A GLN 159.A NE2 PHE 128.A O no hydrogen 2.904 N/A VAL 160.A N VAL 156.A O no hydrogen 3.011 N/A ALA 161.A N VAL 157.A O no hydrogen 2.862 N/A ALA 162.A N LEU 158.A O no hydrogen 3.058 N/A ALA 163.A N GLN 159.A O no hydrogen 3.056 N/A ALA 163.A N VAL 160.A O no hydrogen 3.061 N/A THR 164.A N VAL 160.A O no hydrogen 2.847 N/A THR 164.A OG1 VAL 160.A O no hydrogen 3.192 N/A CYS 166.A SG THR 164.A OG1 no hydrogen 3.401 N/A CYS 166.A SG HIS 169.A NE2 no hydrogen 3.826 N/A LYS 167.A N ASP 144.A O no hydrogen 3.134 N/A HIS 168.A NE2 THR 204.A OG1 no hydrogen 2.787 N/A HIS 169.A N GLU 202.A O no hydrogen 3.057 N/A HIS 169.A ND1 GLU 202.A O no hydrogen 3.182 N/A HIS 169.A NE2 THR 164.A OG1 no hydrogen 2.764 N/A TYR 170.A N PHE 146.A O no hydrogen 2.816 N/A GLY 171.A N THR 204.A O no hydrogen 3.030 N/A VAL 172.A N ASP 148.A O no hydrogen 3.467 N/A GLU 173.A N GLU 206.A O no hydrogen 3.271 N/A ALA 175.A N GLU 173.A OE2 no hydrogen 2.980 N/A ALA 179.A N ALA 175.A O no hydrogen 3.361 N/A LYS 180.A N ASP 176.A O no hydrogen 2.823 N/A TYR 181.A N ILE 177.A O no hydrogen 2.930 N/A ALA 182.A N PRO 178.A O no hydrogen 2.793 N/A GLU 183.A N ALA 179.A O no hydrogen 3.220 N/A GLU 183.A N LYS 180.A O no hydrogen 3.159 N/A MET 185.A N TYR 181.A O no hydrogen 2.948 N/A ASP 186.A N ALA 182.A O no hydrogen 2.943 N/A ARG 187.A N GLU 183.A O no hydrogen 3.162 N/A GLU 188.A N THR 184.A O no hydrogen 2.760 N/A PHE 189.A N MET 185.A O no hydrogen 2.726 N/A ARG 190.A N ASP 186.A O no hydrogen 3.059 N/A ARG 190.A NE ASP 186.A OD1 no hydrogen 2.750 N/A LYS 191.A N ARG 187.A O no hydrogen 3.008 N/A LYS 191.A NZ GLU 188.A OE1 no hydrogen 2.997 N/A LYS 191.A NZ GLU 188.A OE2 no hydrogen 3.448 N/A TRP 192.A N GLU 188.A O no hydrogen 2.836 N/A MET 193.A N PHE 189.A O no hydrogen 2.874 N/A LYS 194.A N.A ARG 190.A O no hydrogen 3.034 N/A LYS 194.A N.B ARG 190.A O no hydrogen 3.041 N/A TRP 195.A N LYS 191.A O no hydrogen 2.872 N/A TYR 196.A N TRP 192.A O no hydrogen 2.886 N/A TYR 196.A OH GLN 110.A OE1 no hydrogen 2.494 N/A GLY 197.A N LYS 194.A O.A no hydrogen 2.769 N/A GLY 197.A N LYS 194.A O.B no hydrogen 2.778 N/A LYS 198.A N MET 193.A O no hydrogen 2.838 N/A LYS 198.A NZ THR 97.A OG1 no hydrogen 2.780 N/A LYS 199.A N THR 97.A O no hydrogen 2.702 N/A HIS 200.A ND1 ALA 201.A O no hydrogen 2.550 N/A ALA 201.A N ALA 161.A O no hydrogen 2.941 N/A TYR 203.A OH ASP 186.A OD1 no hydrogen 2.489 N/A THR 204.A N HIS 169.A O no hydrogen 2.953 N/A THR 204.A OG1 HIS 168.A NE2 no hydrogen 2.787 N/A GLU 206.A N GLY 171.A O no hydrogen 3.091 N/A GLY 208.A N GLU 173.A O no hydrogen 2.777 N/A LEU 211.A N ASP 209.A OD1 no hydrogen 2.766 N/A SER 212.A OG ASP 209.A O no hydrogen 3.143 N/A ARG 216.A N GLU 213.A O.A no hydrogen 3.199 N/A ARG 216.A N GLU 213.A O.B no hydrogen 3.236 N/A ARG 216.A NE GLU 213.A OE1.B no hydrogen 2.926 N/A ARG 218.A NH1 GLU 206.A OE2 no hydrogen 2.831 N/A ARG 218.A NH2 GLU 206.A OE1 no hydrogen 3.149 N/A ARG 218.A NH2 GLU 206.A OE2 no hydrogen 3.435 N/A ILE 219.A N TRP 215.A O no hydrogen 2.881 N/A ALA 220.A N ARG 216.A O no hydrogen 3.196 N/A ASN 221.A N.A GLU 217.A O no hydrogen 2.980 N/A ASN 221.A N.A ARG 218.A O no hydrogen 3.170 N/A ASN 221.A N.B GLU 217.A O no hydrogen 2.976 N/A THR 222.A N ILE 219.A O no hydrogen 3.151 N/A THR 222.A OG1 ARG 218.A O no hydrogen 2.656 N/A SER 223.A OG ASP 144.A OD1 no hydrogen 2.842 N/A SER 223.A OG LEU 145.A O no hydrogen 3.392 N/A VAL 224.A N LEU 145.A O no hydrogen 2.871 N/A ILE 225.A N ARG 252.A O no hydrogen 2.949 N/A PHE 226.A N VAL 147.A O no hydrogen 2.908 N/A VAL 227.A N VAL 254.A O no hydrogen 2.983 N/A ASN 229.A ND2 ASP 237.A OD1.A no hydrogen 3.549 N/A ASN 229.A ND2 LYS 257.A O no hydrogen 2.793 N/A PHE 232.A N ASN 229.A O no hydrogen 2.964 N/A ASP 237.A N.A GLY 233.A O no hydrogen 3.090 N/A ASP 237.A N.B GLY 233.A O no hydrogen 3.062 N/A HIS 238.A N PRO 234.A O no hydrogen 2.982 N/A GLN 239.A N GLU 235.A O no hydrogen 2.858 N/A LEU 240.A N VAL 236.A O no hydrogen 2.971 N/A LYS 241.A N ASP 237.A O.A no hydrogen 3.143 N/A LYS 241.A N ASP 237.A O.B no hydrogen 3.073 N/A LYS 241.A NZ ASP 237.A OD2.B no hydrogen 2.577 N/A GLU 242.A N HIS 238.A O no hydrogen 3.232 N/A ARG 243.A N GLN 239.A O no hydrogen 3.174 N/A ARG 243.A NH1 GLN 239.A O no hydrogen 3.115 N/A PHE 244.A N LEU 240.A O no hydrogen 2.759 N/A ALA 245.A N LYS 241.A O no hydrogen 3.036 N/A ASN 246.A N ARG 243.A O no hydrogen 3.420 N/A MET 247.A N PHE 244.A O no hydrogen 2.960 N/A GLY 250.A N ILE 297.A O no hydrogen 2.857 N/A GLY 251.A N LYS 248.A O no hydrogen 3.323 N/A ARG 252.A N SER 223.A O no hydrogen 2.763 N/A ARG 252.A NH1 LYS 139.A O no hydrogen 3.116 N/A ARG 252.A NH1 ASP 144.A OD1 no hydrogen 3.560 N/A ARG 252.A NH2 LYS 139.A O no hydrogen 2.768 N/A ILE 253.A N HIS 295.A O no hydrogen 2.755 N/A VAL 254.A N ILE 225.A O no hydrogen 2.938 N/A SER 255.A N TYR 293.A O no hydrogen 3.030 N/A SER 255.A OG LYS 257.A O no hydrogen 2.942 N/A SER 256.A N ASN 229.A OD1 no hydrogen 3.077 N/A SER 256.A OG ASN 228.A OD1 no hydrogen 2.823 N/A SER 256.A OG ASN 229.A OD1 no hydrogen 3.328 N/A LYS 257.A N ASN 229.A OD1 no hydrogen 2.732 N/A PHE 259.A N HIS 295.A NE2 no hydrogen 2.929 N/A ASN 267.A N ASN 270.A OD1 no hydrogen 2.878 N/A ARG 269.A N ASN 267.A OD1 no hydrogen 2.671 N/A ASN 270.A N ASN 267.A O no hydrogen 3.033 N/A ASN 270.A ND2 ARG 265.A O no hydrogen 3.323 N/A ASP 273.A N ASN 270.A O no hydrogen 2.980 N/A THR 276.A N ASP 273.A O no hydrogen 3.074 N/A THR 276.A OG1 ASP 273.A O no hydrogen 2.495 N/A ILE 277.A N ILE 274.A O no hydrogen 2.836 N/A ARG 279.A N THR 296.A O no hydrogen 2.858 N/A ARG 279.A NH2 ASP 298.A OD1 no hydrogen 3.177 N/A VAL 281.A N LEU 294.A O no hydrogen 2.971 N/A LEU 283.A N TYR 292.A O no hydrogen 2.646 N/A SER 289.A N LEU 286.A O no hydrogen 2.799 N/A SER 291.A OG TYR 293.A OH no hydrogen 3.322 N/A TYR 293.A N SER 255.A O no hydrogen 2.985 N/A LEU 294.A N VAL 281.A O no hydrogen 2.929 N/A HIS 295.A N ILE 253.A O no hydrogen 2.750 N/A HIS 295.A ND1 ILE 253.A O no hydrogen 2.996 N/A THR 296.A N ARG 279.A O no hydrogen 2.894 N/A ILE 297.A N GLY 251.A O no hydrogen 2.907 N/A ASP 298.A N ILE 277.A O no hydrogen 2.614 N/A ARG 299.A N GLU 249.A OE1 no hydrogen 3.098 N/A ARG 299.A N GLU 249.A OE2 no hydrogen 2.827 N/A ARG 299.A NH1 MET 247.A O no hydrogen 2.615 N/A ARG 299.A NH2 MET 247.A O no hydrogen 3.062 N/A THR 300.A N ASP 298.A OD2 no hydrogen 3.275 N/A THR 300.A OG1 ASP 298.A OD1 no hydrogen 3.251 N/A THR 300.A OG1 ASP 298.A OD2 no hydrogen 2.760 N/A ILE 301.A N ASP 298.A O no hydrogen 3.488 N/A LEU 302.A N ARG 299.A O no hydrogen 2.753 N/A GLU 303.A N ARG 299.A O no hydrogen 3.148 N/A ASN 304.A N THR 300.A O no hydrogen 2.858 N/A TYR 305.A N LEU 302.A O no hydrogen 3.085 N/A PHE 306.A N LEU 302.A O no hydrogen 3.154 N/A SER 307.A N GLU 303.A O no hydrogen 2.830 N/A SER 308.A N ASN 304.A O no hydrogen 3.198 N/A SER 308.A OG ASN 304.A O no hydrogen 3.438 N/A SER 308.A OG TYR 305.A O no hydrogen 2.698 N/A LEU 309.A N TYR 305.A O no hydrogen 3.207 N/A LYS 310.A N PHE 306.A O no hydrogen 3.160 N/A ASN 311.A N SER 308.A O no hydrogen 3.069 N/A