Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3qri_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 9.A N SER 6.A O no hydrogen 3.211 N/A TRP 12.A N ASP 10.A OD1 no hydrogen 3.091 N/A GLU 13.A N ASP 10.A O no hydrogen 3.096 N/A MET 14.A N VAL 81.A O no hydrogen 2.743 N/A ARG 16.A NH1 PRO 87.A O no hydrogen 2.344 N/A ARG 16.A NH2 PRO 87.A O no hydrogen 2.988 N/A ASP 18.A N GLU 15.A O no hydrogen 2.847 N/A ILE 19.A N ARG 16.A O no hydrogen 2.910 N/A THR 20.A N VAL 37.A O no hydrogen 3.324 N/A LYS 22.A N GLU 35.A O no hydrogen 2.831 N/A LEU 25.A N VAL 33.A O no hydrogen 2.762 N/A GLN 29.A N GLY 26.A O no hydrogen 3.023 N/A TYR 30.A OH ARG 144.A O no hydrogen 2.679 N/A GLY 31.A N GLY 28.A O no hydrogen 3.289 N/A TYR 34.A N VAL 47.A O no hydrogen 2.910 N/A TYR 34.A OH GLU 32.A OE2 no hydrogen 2.781 N/A GLU 35.A N HIS 23.A O no hydrogen 3.067 N/A GLY 36.A N VAL 45.A O no hydrogen 2.806 N/A VAL 37.A N THR 20.A O no hydrogen 3.304 N/A TRP 38.A N LEU 43.A O no hydrogen 2.589 N/A LYS 39.A N ASP 18.A O no hydrogen 2.959 N/A LYS 39.A NZ THR 17.A O no hydrogen 2.478 N/A LYS 40.A NZ TYR 41.A OH no hydrogen 2.625 N/A SER 42.A N LYS 39.A O no hydrogen 3.230 N/A LEU 43.A N TRP 38.A O no hydrogen 3.308 N/A VAL 45.A N GLY 36.A O no hydrogen 2.607 N/A ALA 46.A N THR 92.A O no hydrogen 3.008 N/A VAL 47.A N TYR 34.A O no hydrogen 2.811 N/A LYS 48.A N ILE 90.A O no hydrogen 2.732 N/A LYS 48.A NZ GLU 63.A OE1 no hydrogen 2.671 N/A LYS 48.A NZ GLU 63.A OE2 no hydrogen 3.534 N/A THR 49.A N GLU 32.A O no hydrogen 2.776 N/A THR 49.A OG1 GLU 32.A O no hydrogen 3.443 N/A LEU 50.A N PHE 88.A O no hydrogen 3.052 N/A PHE 60.A N GLU 56.A O no hydrogen 3.191 N/A LEU 61.A N VAL 57.A O no hydrogen 2.822 N/A LYS 62.A N GLU 58.A O no hydrogen 3.234 N/A GLU 63.A N GLU 59.A O no hydrogen 3.270 N/A ALA 64.A N PHE 60.A O no hydrogen 3.112 N/A ALA 65.A N LEU 61.A O no hydrogen 2.917 N/A VAL 66.A N LYS 62.A O no hydrogen 3.001 N/A MET 67.A N GLU 63.A O no hydrogen 2.971 N/A LYS 68.A N ALA 64.A O no hydrogen 3.082 N/A GLU 69.A N VAL 66.A O no hydrogen 2.937 N/A ILE 70.A N MET 67.A O no hydrogen 3.138 N/A LYS 71.A N TYR 130.A OH no hydrogen 3.140 N/A ASN 74.A N HIS 72.A ND1 no hydrogen 2.955 N/A ASN 74.A ND2 VAL 154.A O no hydrogen 3.210 N/A LEU 75.A N HIS 72.A O no hydrogen 3.253 N/A VAL 76.A N VAL 156.A O no hydrogen 3.186 N/A GLN 77.A N GLU 93.A OE2 no hydrogen 2.937 N/A GLN 77.A NE2.B LEU 78.A O no hydrogen 2.783 N/A LEU 79.A N ILE 91.A O no hydrogen 2.870 N/A GLY 80.A N ILE 91.A O no hydrogen 3.250 N/A VAL 81.A N TRP 12.A O no hydrogen 2.959 N/A CYS 82.A N TYR 89.A O no hydrogen 2.996 N/A CYS 82.A SG MET 14.A O no hydrogen 3.703 N/A THR 83.A N GLU 13.A OE1 no hydrogen 3.003 N/A THR 83.A OG1 GLU 13.A OE2 no hydrogen 2.533 N/A ARG 84.A NH1 ASN 8.A O no hydrogen 3.395 N/A ARG 84.A NH2 ASN 8.A O no hydrogen 3.187 N/A PHE 88.A N LEU 50.A O no hydrogen 3.121 N/A TYR 89.A N CYS 82.A O no hydrogen 2.875 N/A ILE 90.A N LYS 48.A O no hydrogen 2.759 N/A ILE 91.A N GLY 80.A O no hydrogen 2.992 N/A THR 92.A N ALA 46.A O no hydrogen 2.852 N/A THR 92.A OG1 GLU 93.A O no hydrogen 3.123 N/A GLU 93.A N GLN 77.A O no hydrogen 3.066 N/A THR 96.A OG1 GLU 150.A OE1 no hydrogen 2.933 N/A TYR 97.A N VAL 148.A O no hydrogen 2.958 N/A GLY 98.A N MET 95.A O no hydrogen 3.201 N/A ASN 99.A ND2 ASP 102.A OD2 no hydrogen 2.869 N/A LEU 100.A N CYS 146.A O no hydrogen 2.725 N/A LEU 101.A N ALA 143.A O no hydrogen 3.288 N/A ASP 102.A N ASN 99.A OD1 no hydrogen 2.814 N/A TYR 103.A N ASN 99.A O no hydrogen 3.140 N/A LEU 104.A N LEU 100.A O no hydrogen 2.896 N/A ARG 105.A N LEU 101.A O no hydrogen 3.150 N/A ARG 105.A NE GLY 213.A O no hydrogen 2.757 N/A ARG 105.A NH2 GLY 213.A O no hydrogen 3.184 N/A GLU 106.A N ASP 102.A O no hydrogen 3.065 N/A GLU 106.A N TYR 103.A O no hydrogen 3.256 N/A CYS 107.A SG LEU 104.A O no hydrogen 3.232 N/A GLN 110.A N ASN 108.A OD1 no hydrogen 2.927 N/A GLU 111.A N ASN 108.A OD1 no hydrogen 3.314 N/A VAL 112.A N ASN 108.A O no hydrogen 2.837 N/A ASN 113.A ND2 GLN 110.A O no hydrogen 3.064 N/A VAL 115.A N ASN 113.A OD1 no hydrogen 3.171 N/A VAL 116.A N ASN 113.A OD1 no hydrogen 3.211 N/A LEU 117.A N ASN 113.A O no hydrogen 2.913 N/A LEU 118.A N ALA 114.A O no hydrogen 3.156 N/A TYR 119.A N VAL 115.A O no hydrogen 3.020 N/A MET 120.A N VAL 116.A O no hydrogen 2.843 N/A ALA 121.A N LEU 117.A O no hydrogen 3.126 N/A THR 122.A N LEU 118.A O no hydrogen 3.100 N/A THR 122.A OG1.A LEU 118.A O no hydrogen 3.088 N/A GLN 123.A N TYR 119.A O no hydrogen 3.083 N/A GLN 123.A NE2 TYR 119.A O no hydrogen 3.644 N/A GLN 123.A NE2 HIS 152.A O no hydrogen 2.869 N/A ILE 124.A N MET 120.A O no hydrogen 3.152 N/A SER 125.A N ALA 121.A O no hydrogen 2.864 N/A SER 126.A N THR 122.A O no hydrogen 3.060 N/A SER 126.A OG HIS 72.A NE2 no hydrogen 3.347 N/A ALA 127.A N GLN 123.A O no hydrogen 3.190 N/A MET 128.A N ILE 124.A O no hydrogen 2.991 N/A GLU 129.A N SER 125.A O no hydrogen 2.923 N/A TYR 130.A N SER 126.A O no hydrogen 3.079 N/A LEU 131.A N ALA 127.A O no hydrogen 3.041 N/A GLU 132.A N MET 128.A O no hydrogen 2.936 N/A LYS 133.A N GLU 129.A O no hydrogen 2.947 N/A LYS 134.A N TYR 130.A O no hydrogen 2.925 N/A LYS 134.A NZ GLU 69.A O no hydrogen 3.430 N/A ASN 135.A N GLU 132.A O no hydrogen 3.079 N/A PHE 136.A N LEU 131.A O no hydrogen 2.782 N/A HIS 138.A N ASP 198.A OD2 no hydrogen 2.677 N/A HIS 138.A NE2 ALA 157.A O no hydrogen 2.746 N/A ARG 139.A N ASP 198.A OD1 no hydrogen 2.937 N/A ASP 140.A N HIS 138.A ND1 no hydrogen 3.192 N/A ALA 143.A N GLU 208.A OE2 no hydrogen 3.079 N/A ARG 144.A NE TYR 170.A OH no hydrogen 2.779 N/A ARG 144.A NH2 ASP 140.A OD1 no hydrogen 2.908 N/A ASN 145.A N ALA 142.A O no hydrogen 2.973 N/A ASN 145.A ND2 ASP 140.A O no hydrogen 2.871 N/A CYS 146.A N ALA 143.A O no hydrogen 3.132 N/A CYS 146.A SG ALA 142.A O no hydrogen 3.528 N/A LEU 147.A N LYS 155.A O no hydrogen 2.732 N/A VAL 148.A N GLY 98.A O no hydrogen 2.987 N/A GLY 149.A N LEU 153.A O no hydrogen 2.658 N/A LEU 153.A N GLU 150.A O no hydrogen 3.136 N/A VAL 154.A N GLN 123.A OE1 no hydrogen 2.823 N/A LYS 155.A N LEU 147.A O no hydrogen 2.896 N/A LYS 155.A NZ GLU 93.A OE1 no hydrogen 2.695 N/A LYS 155.A NZ GLU 93.A OE2 no hydrogen 2.304 N/A VAL 156.A N ASN 74.A O no hydrogen 2.887 N/A ALA 157.A N ASN 145.A O no hydrogen 2.865 N/A PHE 159.A N ASN 145.A OD1 no hydrogen 3.014 N/A GLY 160.A N ASP 158.A OD1 no hydrogen 2.829 N/A ARG 163.A N GLY 160.A O no hydrogen 3.458 N/A ARG 163.A NH1 GLU 59.A OE2 no hydrogen 2.718 N/A LEU 164.A N LEU 161.A O no hydrogen 3.091 N/A MET 165.A N LEU 161.A O no hydrogen 2.907 N/A ASP 168.A N ASP 168.A OD1 no hydrogen 2.526 N/A TYR 170.A OH ASP 140.A OD1 no hydrogen 3.303 N/A TYR 170.A OH ASP 140.A OD2 no hydrogen 2.442 N/A THR 171.A N PHE 178.A O no hydrogen 2.979 N/A ALA 172.A N THR 171.A OG1 no hydrogen 2.439 N/A HIS 173.A N ALA 176.A O no hydrogen 2.672 N/A ALA 176.A N HIS 173.A O no hydrogen 3.004 N/A LYS 177.A NZ SER 162.A O no hydrogen 2.932 N/A PHE 178.A N THR 171.A O no hydrogen 2.863 N/A LYS 181.A NZ.A PRO 216.A O no hydrogen 2.830 N/A LYS 181.A NZ.A TYR 217.A O no hydrogen 3.145 N/A LYS 181.A NZ.A ILE 220.A O no hydrogen 3.183 N/A LYS 181.A NZ.B PRO 216.A O no hydrogen 3.278 N/A TRP 182.A N PRO 179.A O no hydrogen 2.886 N/A TRP 182.A NE1 GLU 208.A OE2 no hydrogen 2.824 N/A THR 183.A N ILE 180.A O no hydrogen 3.166 N/A THR 183.A OG1 PRO 179.A O no hydrogen 2.956 N/A GLU 186.A N GLU 186.A OE1 no hydrogen 2.924 N/A SER 187.A N ALA 184.A O no hydrogen 2.913 N/A SER 187.A OG LYS 192.A O no hydrogen 2.775 N/A LEU 188.A N ALA 184.A O no hydrogen 3.056 N/A ALA 189.A N PRO 185.A O no hydrogen 2.985 N/A TYR 190.A N GLU 186.A O no hydrogen 2.896 N/A ASN 191.A N SER 187.A O no hydrogen 2.722 N/A SER 194.A N SER 197.A OG no hydrogen 2.771 N/A LYS 196.A NZ ARG 260.A O no hydrogen 3.201 N/A SER 197.A N SER 194.A O no hydrogen 3.140 N/A SER 197.A N SER 194.A OG no hydrogen 3.154 N/A SER 197.A OG SER 194.A O no hydrogen 2.712 N/A ASP 198.A N SER 194.A O no hydrogen 3.244 N/A VAL 199.A N ILE 195.A O no hydrogen 3.000 N/A TRP 200.A N LYS 196.A O no hydrogen 3.144 N/A ALA 201.A N SER 197.A O no hydrogen 3.088 N/A PHE 202.A N ASP 198.A O no hydrogen 2.884 N/A GLY 203.A N VAL 199.A O no hydrogen 3.222 N/A VAL 204.A N TRP 200.A O no hydrogen 3.308 N/A LEU 205.A N ALA 201.A O no hydrogen 3.002 N/A LEU 206.A N PHE 202.A O no hydrogen 2.878 N/A TRP 207.A N GLY 203.A O no hydrogen 3.128 N/A TRP 207.A NE1 GLU 236.A O no hydrogen 3.207 N/A GLU 208.A N VAL 204.A O no hydrogen 2.813 N/A ILE 209.A N LEU 205.A O no hydrogen 2.855 N/A ALA 210.A N LEU 206.A O no hydrogen 2.959 N/A THR 211.A N TRP 207.A O no hydrogen 3.097 N/A THR 211.A OG1 TRP 207.A O no hydrogen 2.906 N/A THR 211.A OG1 GLU 208.A O no hydrogen 3.294 N/A TYR 212.A N ILE 209.A O no hydrogen 3.083 N/A TYR 212.A OH VAL 112.A O no hydrogen 2.599 N/A GLY 213.A N GLU 208.A O no hydrogen 2.716 N/A MET 214.A N THR 211.A OG1 no hydrogen 3.218 N/A ILE 220.A N TYR 217.A O no hydrogen 3.038 N/A GLN 224.A N ASP 221.A O no hydrogen 2.974 N/A VAL 225.A N LEU 222.A O no hydrogen 2.881 N/A LEU 228.A N GLN 224.A O no hydrogen 3.106 N/A LEU 229.A N VAL 225.A O no hydrogen 3.009 N/A GLU 230.A N TYR 226.A O no hydrogen 3.008 N/A LYS 231.A N GLU 227.A O no hydrogen 3.316 N/A LYS 231.A N LEU 228.A O no hydrogen 3.175 N/A ASP 232.A N LEU 229.A O no hydrogen 2.818 N/A TYR 233.A N LEU 228.A O no hydrogen 3.063 N/A ARG 234.A NE TRP 253.A O no hydrogen 2.875 N/A ARG 234.A NH1 LEU 229.A O no hydrogen 2.859 N/A ARG 234.A NH1 TYR 233.A O no hydrogen 2.831 N/A ARG 234.A NH2 TRP 253.A O no hydrogen 3.125 N/A ARG 237.A NH1 CYS 241.A O no hydrogen 2.679 N/A CYS 241.A N PRO 238.A O no hydrogen 3.127 N/A CYS 241.A SG PRO 242.A O no hydrogen 3.688 N/A LYS 244.A NZ MET 273.A O no hydrogen 3.349 N/A VAL 245.A N PRO 242.A O no hydrogen 3.087 N/A TYR 246.A N PRO 242.A O no hydrogen 3.144 N/A TYR 246.A OH MET 235.A O no hydrogen 2.650 N/A GLU 247.A N GLU 243.A O no hydrogen 2.857 N/A LEU 248.A N LYS 244.A O no hydrogen 3.260 N/A MET 249.A N VAL 245.A O no hydrogen 3.013 N/A ARG 250.A N TYR 246.A O no hydrogen 3.043 N/A ARG 250.A NH2 TYR 246.A OH no hydrogen 3.226 N/A ALA 251.A N GLU 247.A O no hydrogen 2.822 N/A CYS 252.A N LEU 248.A O no hydrogen 2.957 N/A CYS 252.A SG LEU 248.A O no hydrogen 3.264 N/A TRP 253.A N MET 249.A O no hydrogen 3.059 N/A TRP 253.A N ARG 250.A O no hydrogen 3.251 N/A GLN 254.A N ALA 251.A O no hydrogen 3.451 N/A SER 258.A N ASN 256.A OD1 no hydrogen 3.021 N/A SER 258.A OG ASN 256.A OD1 no hydrogen 3.173 N/A ASP 259.A N ASN 256.A O no hydrogen 2.898 N/A ARG 260.A N PRO 257.A O no hydrogen 3.097 N/A ARG 260.A NE GLN 254.A O no hydrogen 2.926 N/A ARG 260.A NH1 GLU 186.A OE1 no hydrogen 3.566 N/A ARG 260.A NH1 GLU 186.A OE2 no hydrogen 2.654 N/A ARG 260.A NH1 LYS 196.A O no hydrogen 3.009 N/A ARG 260.A NH2 GLU 186.A OE1 no hydrogen 2.817 N/A ARG 260.A NH2 GLN 254.A O no hydrogen 3.146 N/A SER 262.A N GLU 265.A OE1 no hydrogen 2.995 N/A PHE 263.A N GLU 132.A OE2 no hydrogen 2.899 N/A ALA 264.A N GLU 132.A OE1 no hydrogen 3.124 N/A GLU 265.A N SER 262.A OG no hydrogen 3.024 N/A ILE 266.A N SER 262.A O no hydrogen 2.852 N/A HIS 267.A N PHE 263.A O no hydrogen 3.072 N/A HIS 267.A ND1 GLU 271.A OE2 no hydrogen 2.827 N/A GLN 268.A N ALA 264.A O no hydrogen 3.082 N/A ALA 269.A N GLU 265.A O no hydrogen 2.883 N/A PHE 270.A N ILE 266.A O no hydrogen 3.171 N/A GLU 271.A N HIS 267.A O no hydrogen 3.066 N/A THR 272.A N GLN 268.A O no hydrogen 2.990 N/A THR 272.A OG1 GLN 268.A O no hydrogen 3.183 N/A