Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3r7o_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 1.A NE2 ASN 66.A O no hydrogen 2.698 N/A HIS 5.A ND1 SER 102.A O no hydrogen 3.246 N/A SER 9.A N ASP 7.A OD1 no hydrogen 3.227 N/A ALA 10.A N ASP 7.A O no hydrogen 2.995 N/A LEU 11.A N LEU 8.A O no hydrogen 3.097 N/A GLU 14.A N ASN 12.A OD1 no hydrogen 2.902 N/A VAL 16.A N ASN 12.A O no hydrogen 3.231 N/A GLN 17.A N PRO 13.A O no hydrogen 3.015 N/A ALA 18.A N GLU 14.A O no hydrogen 2.848 N/A VAL 19.A N LEU 15.A O no hydrogen 2.745 N/A GLN 20.A N VAL 16.A O no hydrogen 2.825 N/A VAL 22.A N VAL 19.A O no hydrogen 3.273 N/A ILE 24.A N ILE 98.A O no hydrogen 2.832 N/A SER 28.A N GLY 25.A O no hydrogen 3.010 N/A LEU 29.A N PRO 26.A O no hydrogen 3.430 N/A ILE 30.A N THR 49.A O no hydrogen 2.922 N/A HIS 32.A N HIS 47.A O no hydrogen 2.841 N/A GLU 35.A N HIS 32.A O no hydrogen 2.743 N/A ILE 37.A N VAL 45.A O no hydrogen 2.728 N/A GLY 40.A N GLY 43.A O no hydrogen 2.979 N/A CYS 44.A SG ASN 66.A OD1 no hydrogen 3.600 N/A VAL 45.A N GLY 38.A O no hydrogen 2.829 N/A TYR 46.A N VAL 62.A O no hydrogen 2.758 N/A HIS 47.A N GLU 35.A O no hydrogen 3.089 N/A HIS 47.A ND1 HIS 59.A NE2 no hydrogen 2.832 N/A GLY 48.A N CYS 60.A O no hydrogen 2.906 N/A THR 49.A N ILE 30.A O no hydrogen 2.776 N/A LEU 50.A N ILE 58.A O no hydrogen 2.805 N/A LEU 51.A N SER 28.A O no hydrogen 3.107 N/A ASP 52.A N LYS 56.A O no hydrogen 3.213 N/A ASP 54.A N ASP 52.A OD1 no hydrogen 3.272 N/A GLY 55.A N ASP 52.A OD1 no hydrogen 2.799 N/A LYS 56.A N ASP 52.A OD1 no hydrogen 2.778 N/A ILE 58.A N LEU 50.A O no hydrogen 2.615 N/A HIS 59.A NE2 HIS 47.A ND1 no hydrogen 2.832 N/A CYS 60.A N GLY 48.A O no hydrogen 3.097 N/A ALA 61.A N LEU 110.A O no hydrogen 2.797 N/A VAL 62.A N TYR 46.A O no hydrogen 2.725 N/A LYS 63.A N VAL 108.A O no hydrogen 2.700 N/A LYS 63.A NZ GLU 80.A OE1 no hydrogen 3.344 N/A LYS 63.A NZ GLU 80.A OE2 no hydrogen 2.796 N/A LYS 63.A NZ ASP 175.A OD1 no hydrogen 2.876 N/A SER 64.A N CYS 44.A O no hydrogen 3.070 N/A SER 64.A OG LEU 65.A O no hydrogen 3.399 N/A LEU 65.A N SER 105.A OG no hydrogen 3.035 N/A ASN 66.A N PHE 42.A O no hydrogen 3.029 N/A THR 69.A OG1 GLU 73.A OE1 no hydrogen 2.732 N/A GLU 73.A N ASP 70.A OD2 no hydrogen 3.191 N/A SER 75.A N ILE 71.A O no hydrogen 2.894 N/A GLN 76.A N GLY 72.A O no hydrogen 2.887 N/A PHE 77.A N GLU 73.A O no hydrogen 3.003 N/A LEU 78.A N VAL 74.A O no hydrogen 2.948 N/A THR 79.A N SER 75.A O no hydrogen 3.085 N/A THR 79.A OG1 SER 75.A O no hydrogen 2.541 N/A GLU 80.A N GLN 76.A O no hydrogen 3.124 N/A GLY 81.A N PHE 77.A O no hydrogen 3.466 N/A ILE 82.A N LEU 78.A O no hydrogen 3.001 N/A ILE 83.A N THR 79.A O no hydrogen 2.841 N/A MET 84.A N GLU 80.A O no hydrogen 3.289 N/A LYS 85.A N ILE 82.A O no hydrogen 2.983 N/A LYS 85.A NZ ASP 86.A OD1 no hydrogen 3.406 N/A LYS 85.A NZ ASP 86.A OD2 no hydrogen 3.329 N/A PHE 87.A N MET 84.A O no hydrogen 3.273 N/A SER 88.A N TYR 147.A OH no hydrogen 2.854 N/A ASN 91.A N HIS 89.A ND1 no hydrogen 3.149 N/A ASN 91.A ND2 GLN 140.A OE1 no hydrogen 2.948 N/A ASN 91.A ND2 VAL 171.A O no hydrogen 2.816 N/A VAL 92.A N HIS 89.A O no hydrogen 3.179 N/A LEU 93.A N VAL 173.A O no hydrogen 2.983 N/A LEU 96.A N VAL 109.A O no hydrogen 2.936 N/A GLY 97.A N VAL 109.A O no hydrogen 3.346 N/A ILE 98.A N VAL 22.A O no hydrogen 2.996 N/A CYS 99.A N LEU 107.A O no hydrogen 2.762 N/A CYS 99.A SG ILE 24.A O no hydrogen 3.771 N/A GLY 104.A N VAL 4.A O no hydrogen 2.851 N/A SER 105.A OG PRO 106.A O no hydrogen 2.875 N/A LEU 107.A N CYS 99.A O no hydrogen 2.770 N/A VAL 108.A N LYS 63.A O no hydrogen 2.943 N/A VAL 109.A N GLY 97.A O no hydrogen 2.783 N/A LEU 110.A N ALA 61.A O no hydrogen 2.780 N/A HIS 115.A N LEU 165.A O no hydrogen 2.974 N/A GLY 116.A N MET 113.A O no hydrogen 2.867 N/A LEU 118.A N CYS 163.A O no hydrogen 2.763 N/A ARG 119.A N ALA 160.A O no hydrogen 3.278 N/A ASN 120.A N ASP 117.A OD2 no hydrogen 2.953 N/A ASN 120.A ND2 ASP 117.A OD1 no hydrogen 2.760 N/A PHE 121.A N ASP 117.A O no hydrogen 3.123 N/A ILE 122.A N LEU 118.A O no hydrogen 3.151 N/A ARG 123.A N ARG 119.A O no hydrogen 3.280 N/A ARG 123.A N ASN 120.A O no hydrogen 3.134 N/A ARG 123.A NH2 GLY 227.A O no hydrogen 2.962 N/A ASN 124.A N PHE 121.A O no hydrogen 3.396 N/A GLU 125.A N GLU 125.A OE2 no hydrogen 2.980 N/A THR 126.A OG1 GLU 125.A O no hydrogen 3.372 N/A HIS 127.A N ASN 124.A O no hydrogen 3.334 N/A ASN 128.A N ASN 124.A O no hydrogen 3.258 N/A THR 130.A N ASP 133.A OD2 no hydrogen 2.818 N/A THR 130.A OG1 GLU 294.A O no hydrogen 2.811 N/A LYS 132.A NZ PHE 288.A O no hydrogen 3.102 N/A LYS 132.A NZ PHE 291.A O no hydrogen 2.702 N/A ASP 133.A N THR 130.A OG1 no hydrogen 3.052 N/A LEU 134.A N THR 130.A O no hydrogen 2.962 N/A ILE 135.A N VAL 131.A O no hydrogen 3.078 N/A GLY 136.A N LYS 132.A O no hydrogen 2.952 N/A PHE 137.A N ASP 133.A O no hydrogen 2.933 N/A GLY 138.A N LEU 134.A O no hydrogen 3.099 N/A LEU 139.A N ILE 135.A O no hydrogen 2.934 N/A GLN 140.A N GLY 136.A O no hydrogen 3.062 N/A GLN 140.A NE2 PHE 169.A O no hydrogen 3.387 N/A GLN 140.A NE2 HIS 299.A ND1 no hydrogen 3.068 N/A VAL 141.A N PHE 137.A O no hydrogen 3.060 N/A ALA 142.A N GLY 138.A O no hydrogen 2.993 N/A LYS 143.A N LEU 139.A O no hydrogen 3.047 N/A GLY 144.A N GLN 140.A O no hydrogen 3.134 N/A MET 145.A N VAL 141.A O no hydrogen 2.924 N/A LYS 146.A N ALA 142.A O no hydrogen 2.853 N/A TYR 147.A N LYS 143.A O no hydrogen 3.190 N/A TYR 147.A OH ASP 86.A O no hydrogen 3.381 N/A LEU 148.A N GLY 144.A O no hydrogen 3.023 N/A ALA 149.A N MET 145.A O no hydrogen 3.031 N/A SER 150.A N LYS 146.A O no hydrogen 3.115 N/A SER 150.A OG LYS 146.A O no hydrogen 3.458 N/A SER 150.A OG TYR 147.A O no hydrogen 2.680 N/A LYS 151.A N TYR 147.A O no hydrogen 3.253 N/A LYS 151.A N LEU 148.A O no hydrogen 3.300 N/A LYS 152.A N ALA 149.A O no hydrogen 3.030 N/A LYS 152.A NZ ALA 149.A O no hydrogen 3.196 N/A PHE 153.A N LEU 148.A O no hydrogen 3.107 N/A VAL 154.A N ARG 180.A O no hydrogen 3.080 N/A HIS 155.A N ASP 212.A OD2 no hydrogen 2.739 N/A HIS 155.A NE2 ASP 175.A O no hydrogen 2.643 N/A ARG 156.A N ASP 212.A OD1 no hydrogen 2.873 N/A ARG 156.A NE LEU 178.A O no hydrogen 2.784 N/A ARG 156.A NH2 LEU 178.A O no hydrogen 3.091 N/A ASP 157.A N HIS 155.A ND1 no hydrogen 3.066 N/A ALA 160.A N GLU 222.A OE1 no hydrogen 2.991 N/A ARG 161.A NH2 ASP 157.A OD1 no hydrogen 3.291 N/A ASN 162.A N ALA 159.A O no hydrogen 2.971 N/A ASN 162.A ND2 ASP 157.A O no hydrogen 2.769 N/A CYS 163.A N ALA 160.A O no hydrogen 3.301 N/A CYS 163.A SG ALA 159.A O no hydrogen 3.752 N/A MET 164.A N LYS 172.A O no hydrogen 2.837 N/A LEU 165.A N GLY 116.A O no hydrogen 2.926 N/A ASP 166.A N THR 170.A O no hydrogen 3.150 N/A GLU 167.A N GLU 167.A OE1 no hydrogen 2.865 N/A LYS 168.A N ASP 166.A OD1 no hydrogen 3.071 N/A PHE 169.A N ASP 166.A O no hydrogen 3.148 N/A THR 170.A N ASP 166.A OD1 no hydrogen 3.124 N/A THR 170.A OG1 ASP 166.A OD1 no hydrogen 3.533 N/A VAL 171.A N GLN 140.A OE1 no hydrogen 2.980 N/A LYS 172.A N MET 164.A O no hydrogen 2.819 N/A LYS 172.A NZ PRO 90.A O no hydrogen 2.840 N/A VAL 173.A N ASN 91.A O no hydrogen 3.001 N/A ALA 174.A N ASN 162.A O no hydrogen 2.820 N/A ASP 175.A N ASN 162.A O no hydrogen 3.071 N/A GLY 177.A N ASP 175.A OD2 no hydrogen 2.936 N/A ALA 179.A N PHE 176.A O no hydrogen 3.180 N/A ARG 180.A N VAL 154.A O no hydrogen 3.141 N/A ARG 180.A NH1 ALA 179.A O no hydrogen 2.931 N/A MET 182.A N LYS 152.A O no hydrogen 2.915 N/A TYR 183.A N ASP 181.A OD1 no hydrogen 3.044 N/A VAL 188.A N GLN 205.A O no hydrogen 3.300 N/A LYS 195.A NZ TYR 231.A O no hydrogen 2.825 N/A LYS 195.A NZ VAL 234.A O no hydrogen 3.120 N/A TRP 196.A N PRO 193.A O no hydrogen 3.243 N/A TRP 196.A NE1 GLU 222.A OE1 no hydrogen 2.957 N/A MET 197.A N VAL 194.A O no hydrogen 3.174 N/A GLU 200.A N GLU 200.A OE2 no hydrogen 3.085 N/A SER 201.A N ALA 198.A O no hydrogen 2.868 N/A SER 201.A OG LYS 206.A O no hydrogen 2.658 N/A LEU 202.A N ALA 198.A O no hydrogen 3.174 N/A LEU 202.A N LEU 199.A O no hydrogen 3.112 N/A GLN 203.A N LEU 199.A O no hydrogen 3.265 N/A THR 204.A N GLU 200.A O no hydrogen 2.903 N/A THR 204.A OG1 GLU 200.A O no hydrogen 2.728 N/A GLN 205.A N SER 201.A O no hydrogen 3.029 N/A GLN 205.A NE2 LEU 202.A O no hydrogen 3.366 N/A THR 208.A N SER 211.A OG no hydrogen 2.705 N/A LYS 210.A NZ ARG 274.A O no hydrogen 2.840 N/A SER 211.A N THR 208.A O no hydrogen 3.099 N/A SER 211.A N THR 208.A OG1 no hydrogen 3.274 N/A SER 211.A OG THR 208.A O no hydrogen 2.662 N/A ASP 212.A N THR 208.A O no hydrogen 3.099 N/A VAL 213.A N THR 209.A O no hydrogen 2.880 N/A TRP 214.A N LYS 210.A O no hydrogen 3.358 N/A SER 215.A N SER 211.A O no hydrogen 3.387 N/A SER 215.A OG TRP 196.A O no hydrogen 2.672 N/A SER 215.A OG SER 211.A O no hydrogen 3.455 N/A PHE 216.A N ASP 212.A O no hydrogen 2.867 N/A GLY 217.A N VAL 213.A O no hydrogen 3.114 N/A VAL 218.A N TRP 214.A O no hydrogen 3.220 N/A LEU 219.A N SER 215.A O no hydrogen 2.850 N/A LEU 220.A N PHE 216.A O no hydrogen 2.774 N/A TRP 221.A N GLY 217.A O no hydrogen 2.970 N/A TRP 221.A NE1 LEU 250.A O no hydrogen 2.722 N/A GLU 222.A N VAL 218.A O no hydrogen 2.919 N/A LEU 223.A N LEU 219.A O no hydrogen 2.994 N/A MET 224.A N LEU 220.A O no hydrogen 3.070 N/A THR 225.A N TRP 221.A O no hydrogen 3.039 N/A THR 225.A OG1 TRP 221.A O no hydrogen 2.956 N/A THR 225.A OG1 GLU 222.A O no hydrogen 3.176 N/A ARG 226.A N LEU 223.A O no hydrogen 3.128 N/A ARG 226.A NH1 PRO 129.A O no hydrogen 2.522 N/A ARG 226.A NH2 PRO 129.A O no hydrogen 2.584 N/A GLY 227.A N GLU 222.A O no hydrogen 2.689 N/A ALA 228.A N THR 225.A OG1 no hydrogen 3.381 N/A VAL 234.A N TYR 231.A O no hydrogen 3.431 N/A ASN 235.A ND2 ASP 238.A OD2 no hydrogen 3.230 N/A ASP 238.A N ASN 235.A O no hydrogen 2.883 N/A VAL 241.A N ASP 238.A O no hydrogen 3.182 N/A TYR 242.A N ASP 238.A O no hydrogen 3.149 N/A LEU 243.A N ILE 239.A O no hydrogen 3.053 N/A LEU 244.A N THR 240.A O no hydrogen 3.055 N/A GLN 245.A N VAL 241.A O no hydrogen 2.996 N/A GLY 246.A N LEU 243.A O no hydrogen 3.230 N/A ARG 247.A N TYR 242.A O no hydrogen 3.288 N/A ARG 247.A NH2 GLN 245.A OE1 no hydrogen 2.658 N/A ARG 248.A NE TRP 267.A O no hydrogen 2.922 N/A ARG 248.A NH1 LEU 243.A O no hydrogen 2.987 N/A ARG 248.A NH1 ARG 247.A O no hydrogen 3.169 N/A ARG 248.A NH2 TRP 267.A O no hydrogen 3.146 N/A GLN 251.A NE2 CYS 255.A O no hydrogen 2.830 N/A GLN 251.A NE2 ASP 257.A OD1 no hydrogen 3.074 N/A CYS 255.A N PRO 252.A O no hydrogen 3.309 N/A CYS 255.A SG PRO 256.A O no hydrogen 3.413 N/A LEU 259.A N PRO 256.A O no hydrogen 3.102 N/A TYR 260.A N PRO 256.A O no hydrogen 3.211 N/A TYR 260.A OH LEU 249.A O no hydrogen 2.716 N/A GLU 261.A N ASP 257.A O no hydrogen 3.104 N/A VAL 262.A N PRO 258.A O no hydrogen 3.151 N/A MET 263.A N LEU 259.A O no hydrogen 3.078 N/A LEU 264.A N TYR 260.A O no hydrogen 2.964 N/A LYS 265.A N GLU 261.A O no hydrogen 3.181 N/A LYS 265.A NZ GLU 261.A OE2 no hydrogen 3.256 N/A CYS 266.A N VAL 262.A O no hydrogen 3.111 N/A CYS 266.A SG VAL 262.A O no hydrogen 3.445 N/A TRP 267.A N MET 263.A O no hydrogen 3.255 N/A TRP 267.A N LEU 264.A O no hydrogen 3.208 N/A HIS 268.A N LYS 265.A O no hydrogen 3.362 N/A LYS 270.A N HIS 268.A ND1 no hydrogen 3.105 N/A MET 273.A N LYS 270.A O no hydrogen 2.997 N/A ARG 274.A N ALA 271.A O no hydrogen 3.271 N/A ARG 274.A NE HIS 268.A O no hydrogen 2.835 N/A ARG 274.A NH1 GLU 200.A OE1 no hydrogen 2.972 N/A ARG 274.A NH1 GLU 200.A OE2 no hydrogen 3.364 N/A ARG 274.A NH1 LYS 210.A O no hydrogen 2.918 N/A ARG 274.A NH2 GLU 200.A OE2 no hydrogen 2.623 N/A ARG 274.A NH2 HIS 268.A O no hydrogen 3.056 N/A GLU 279.A N SER 276.A OG no hydrogen 3.261 N/A LEU 280.A N SER 276.A O no hydrogen 2.960 N/A VAL 281.A N PHE 277.A O no hydrogen 2.933 N/A SER 282.A N SER 278.A O no hydrogen 3.249 N/A SER 282.A OG SER 278.A O no hydrogen 3.402 N/A ARG 283.A N GLU 279.A O no hydrogen 2.879 N/A ARG 283.A NE GLU 279.A OE2 no hydrogen 2.821 N/A ILE 284.A N LEU 280.A O no hydrogen 2.819 N/A SER 285.A N VAL 281.A O no hydrogen 2.865 N/A ALA 286.A N SER 282.A O no hydrogen 3.077 N/A ILE 287.A N ARG 283.A O no hydrogen 3.080 N/A PHE 288.A N ILE 284.A O no hydrogen 2.848 N/A SER 289.A N SER 285.A O no hydrogen 2.987 N/A SER 289.A OG SER 285.A O no hydrogen 3.148 N/A SER 289.A OG ALA 286.A O no hydrogen 3.260 N/A THR 290.A N ALA 286.A O no hydrogen 3.176 N/A THR 290.A OG1 ALA 286.A O no hydrogen 2.737 N/A THR 290.A OG1 ILE 287.A O no hydrogen 3.314 N/A PHE 291.A N PHE 288.A O no hydrogen 3.267 N/A HIS 296.A N ASP 133.A OD1 no hydrogen 3.123 N/A HIS 296.A ND1 ASP 133.A OD2 no hydrogen 3.083 N/A