Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7cxe_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 3.A N ASN 1.A OD1 no hydrogen 3.157 N/A ALA 5.A N ASN 1.A O no hydrogen 3.122 N/A ASP 6.A N PRO 2.A O no hydrogen 3.229 N/A LEU 7.A N GLU 3.A O no hydrogen 3.419 N/A ARG 8.A N SER 4.A O no hydrogen 2.908 N/A ARG 8.A NH1 GLN 205.A OE1 no hydrogen 2.859 N/A ARG 8.A NH2 GLN 205.A OE1 no hydrogen 3.120 N/A ALA 9.A N ALA 5.A O no hydrogen 2.940 N/A LEU 10.A N ASP 6.A O no hydrogen 3.126 N/A ALA 11.A N LEU 7.A O no hydrogen 3.030 N/A LYS 12.A N ARG 8.A O no hydrogen 2.948 N/A HIS 13.A N ALA 9.A O no hydrogen 2.900 N/A HIS 13.A NE2 SER 87.A O no hydrogen 2.643 N/A LEU 14.A N LEU 10.A O no hydrogen 2.982 N/A TYR 15.A N ALA 11.A O no hydrogen 3.041 N/A ASP 16.A N LYS 12.A O no hydrogen 3.053 N/A SER 17.A N HIS 13.A O no hydrogen 3.110 N/A SER 17.A OG HIS 13.A O no hydrogen 2.894 N/A TYR 18.A N LEU 14.A O no hydrogen 2.820 N/A TYR 18.A OH ASP 166.A OD1 no hydrogen 2.875 N/A ILE 19.A N TYR 15.A O no hydrogen 2.914 N/A LYS 20.A N ASP 16.A O no hydrogen 3.234 N/A LYS 20.A N SER 17.A O no hydrogen 3.034 N/A LYS 20.A NZ ASP 16.A OD2 no hydrogen 2.896 N/A SER 21.A N SER 17.A O no hydrogen 2.889 N/A SER 21.A N TYR 18.A O no hydrogen 3.218 N/A SER 21.A OG SER 17.A O no hydrogen 2.671 N/A PHE 22.A N TYR 18.A O no hydrogen 3.099 N/A LYS 26.A N ASP 166.A OD1 no hydrogen 2.826 N/A LYS 26.A NZ LEU 164.A O no hydrogen 2.534 N/A ALA 27.A N ASP 166.A OD2 no hydrogen 2.936 N/A LYS 28.A N THR 25.A OG1 no hydrogen 3.198 N/A ALA 29.A N THR 25.A O no hydrogen 3.016 N/A ARG 30.A N LYS 26.A O no hydrogen 2.972 N/A ARG 30.A NH2 ALA 116.A O no hydrogen 3.406 N/A ARG 30.A NH2 SER 117.A O no hydrogen 3.072 N/A ARG 30.A NH2 MET 119.A O no hydrogen 2.493 N/A ALA 31.A N ALA 27.A O no hydrogen 3.332 N/A ILE 32.A N LYS 28.A O no hydrogen 3.051 N/A LEU 33.A N ALA 29.A O no hydrogen 2.957 N/A THR 34.A N ARG 30.A O no hydrogen 2.799 N/A THR 34.A OG1 ARG 30.A O no hydrogen 2.598 N/A GLY 35.A N ILE 32.A O no hydrogen 3.213 N/A PHE 43.A N GLN 130.A O no hydrogen 2.981 N/A ILE 45.A N PHE 132.A O no hydrogen 2.836 N/A TYR 46.A N SER 50.A OG no hydrogen 3.015 N/A ASP 47.A N SER 50.A OG no hydrogen 2.924 N/A SER 50.A N ASP 47.A OD1 no hydrogen 2.783 N/A SER 50.A OG ASP 47.A O no hydrogen 2.680 N/A SER 50.A OG ASP 47.A OD1 no hydrogen 2.547 N/A LEU 51.A N ASP 47.A O no hydrogen 3.128 N/A MET 52.A N MET 48.A O no hydrogen 3.083 N/A MET 53.A N ASN 49.A O no hydrogen 2.988 N/A GLY 54.A N SER 50.A O no hydrogen 2.892 N/A ASP 56.A N MET 53.A O no hydrogen 3.178 N/A LYS 57.A N MET 53.A O no hydrogen 3.356 N/A ILE 58.A N GLY 54.A O no hydrogen 2.931 N/A ALA 63.A N GLU 61.A OE1 no hydrogen 3.444 N/A CYS 65.A N GLU 61.A O no hydrogen 3.315 N/A CYS 65.A SG GLU 61.A O no hydrogen 3.429 N/A ILE 66.A N VAL 62.A O no hydrogen 3.056 N/A PHE 67.A N ALA 63.A O no hydrogen 3.124 N/A GLN 68.A N ILE 64.A O no hydrogen 2.730 N/A GLY 69.A N CYS 65.A O no hydrogen 2.870 N/A CYS 70.A N ILE 66.A O no hydrogen 2.731 N/A GLN 71.A N PHE 67.A O no hydrogen 2.863 N/A GLN 71.A N GLN 68.A O no hydrogen 3.266 N/A PHE 72.A N GLN 68.A O no hydrogen 3.196 N/A ARG 73.A N GLY 69.A O no hydrogen 3.244 N/A ARG 73.A NH1 GLU 80.A OE2 no hydrogen 3.268 N/A ARG 73.A NH2 GLU 80.A OE1 no hydrogen 3.314 N/A SER 74.A N CYS 70.A O no hydrogen 3.322 N/A SER 74.A OG CYS 70.A O no hydrogen 3.165 N/A VAL 75.A N GLN 71.A O no hydrogen 3.097 N/A GLU 76.A N PHE 72.A O no hydrogen 2.972 N/A ALA 77.A N ARG 73.A O no hydrogen 2.857 N/A VAL 78.A N SER 74.A O no hydrogen 2.938 N/A GLN 79.A N VAL 75.A O no hydrogen 3.055 N/A GLU 80.A N GLU 76.A O no hydrogen 3.202 N/A ILE 81.A N ALA 77.A O no hydrogen 2.932 N/A THR 82.A N VAL 78.A O no hydrogen 2.839 N/A THR 82.A OG1 VAL 78.A O no hydrogen 2.747 N/A GLU 83.A N GLN 79.A O no hydrogen 3.151 N/A TYR 84.A N GLU 80.A O no hydrogen 2.974 N/A TYR 84.A OH ALA 170.A O no hydrogen 2.612 N/A ALA 85.A N ILE 81.A O no hydrogen 2.812 N/A LYS 86.A N THR 82.A O no hydrogen 3.328 N/A SER 87.A N TYR 84.A O no hydrogen 2.993 N/A SER 87.A OG TYR 84.A O no hydrogen 2.446 N/A ILE 88.A N ALA 85.A O no hydrogen 2.856 N/A PHE 91.A N ILE 88.A O no hydrogen 2.906 N/A ASN 93.A N GLY 90.A O no hydrogen 3.194 N/A LEU 94.A N PHE 91.A O no hydrogen 3.363 N/A ASN 97.A N ASP 95.A OD1 no hydrogen 2.976 N/A GLN 99.A N ASP 95.A O no hydrogen 3.062 N/A GLN 99.A NE2 VAL 92.A O no hydrogen 2.969 N/A GLN 99.A NE2 LEU 94.A O no hydrogen 2.490 N/A VAL 100.A N LEU 96.A O no hydrogen 3.163 N/A THR 101.A N ASN 97.A O no hydrogen 3.046 N/A THR 101.A OG1 ASN 97.A O no hydrogen 3.035 N/A LEU 102.A N ASP 98.A O no hydrogen 2.846 N/A LEU 103.A N GLN 99.A O no hydrogen 3.339 N/A LYS 104.A N VAL 100.A O no hydrogen 2.922 N/A LYS 104.A NZ GLU 256.A O no hydrogen 2.795 N/A LYS 104.A NZ LYS 259.A O no hydrogen 2.549 N/A TYR 105.A N THR 101.A O no hydrogen 3.271 N/A VAL 107.A N LEU 103.A O no hydrogen 3.111 N/A ILE 110.A N GLY 106.A O no hydrogen 3.272 N/A ILE 111.A N VAL 107.A O no hydrogen 2.796 N/A TYR 112.A N HIS 108.A O no hydrogen 3.266 N/A THR 113.A N GLU 109.A O no hydrogen 3.185 N/A THR 113.A OG1 GLU 109.A O no hydrogen 2.871 N/A MET 114.A N ILE 110.A O no hydrogen 2.931 N/A LEU 115.A N ILE 111.A O no hydrogen 2.834 N/A ALA 116.A N TYR 112.A O no hydrogen 3.400 N/A SER 117.A OG MET 114.A O no hydrogen 3.260 N/A LEU 118.A N LEU 115.A O no hydrogen 2.919 N/A MET 119.A N ALA 116.A O no hydrogen 2.911 N/A ASN 120.A N GLY 123.A O no hydrogen 3.071 N/A LYS 121.A NZ ASP 122.A OD1 no hydrogen 3.496 N/A LYS 121.A NZ ASP 122.A OD2 no hydrogen 3.503 N/A ASP 122.A N ASN 120.A OD1 no hydrogen 3.045 N/A GLY 123.A N ASN 120.A O no hydrogen 3.248 N/A GLY 123.A N ASN 120.A OD1 no hydrogen 3.085 N/A VAL 124.A N MET 133.A O no hydrogen 2.988 N/A LEU 125.A N LEU 118.A O no hydrogen 2.796 N/A ILE 126.A N GLY 131.A O no hydrogen 3.194 N/A SER 127.A OG LYS 59.A O no hydrogen 3.126 N/A GLY 129.A N ILE 126.A O no hydrogen 3.039 N/A GLN 130.A N SER 127.A O no hydrogen 3.199 N/A GLN 130.A NE2 SER 127.A O no hydrogen 3.279 N/A GLY 131.A N ILE 126.A O no hydrogen 3.119 N/A PHE 132.A N PHE 43.A O no hydrogen 2.794 N/A MET 133.A N VAL 124.A O no hydrogen 2.887 N/A THR 134.A N ILE 45.A O no hydrogen 3.101 N/A THR 134.A OG1 ILE 45.A O no hydrogen 3.561 N/A ARG 135.A N ASP 122.A O no hydrogen 2.670 N/A ARG 135.A NE GLU 150.A OE1 no hydrogen 3.073 N/A ARG 135.A NE GLU 150.A OE2 no hydrogen 3.116 N/A ARG 135.A NH1 LYS 121.A O no hydrogen 3.099 N/A ARG 135.A NH2 GLU 150.A OE1 no hydrogen 2.788 N/A PHE 137.A N THR 134.A OG1 no hydrogen 3.428 N/A LEU 138.A N THR 134.A O no hydrogen 3.348 N/A LYS 139.A N ARG 135.A O no hydrogen 3.062 N/A LYS 139.A NZ GLU 136.A OE2 no hydrogen 3.311 N/A SER 140.A N GLU 136.A O no hydrogen 2.835 N/A SER 140.A N PHE 137.A O no hydrogen 3.207 N/A SER 140.A OG PHE 137.A O no hydrogen 2.691 N/A ARG 142.A NH1 GLU 245.A OE1 no hydrogen 2.534 N/A LYS 143.A NZ ASP 147.A OD2 no hydrogen 2.759 N/A GLY 146.A N ARG 142.A O no hydrogen 3.181 N/A ASP 147.A N PRO 144.A O no hydrogen 3.072 N/A PHE 148.A N PHE 145.A O no hydrogen 3.352 N/A LYS 152.A NZ PHE 148.A O no hydrogen 2.908 N/A LYS 152.A NZ HIS 234.A ND1 no hydrogen 3.152 N/A PHE 153.A N MET 149.A O no hydrogen 3.011 N/A GLU 154.A N GLU 150.A O no hydrogen 2.966 N/A PHE 155.A N PRO 151.A O no hydrogen 2.922 N/A ALA 156.A N LYS 152.A O no hydrogen 2.757 N/A VAL 157.A N PHE 153.A O no hydrogen 2.994 N/A PHE 159.A N PHE 155.A O no hydrogen 2.778 N/A ASN 160.A N ALA 156.A O no hydrogen 2.692 N/A ASN 160.A ND2 ALA 116.A O no hydrogen 2.992 N/A ALA 161.A N LYS 158.A O no hydrogen 3.166 N/A LEU 162.A N PHE 159.A O no hydrogen 3.048 N/A GLU 163.A N ASN 160.A O no hydrogen 3.040 N/A ASP 165.A N ASP 168.A OD2 no hydrogen 2.923 N/A SER 167.A OG ASP 165.A OD1 no hydrogen 2.419 N/A ASP 168.A N ASP 165.A OD1 no hydrogen 3.138 N/A LEU 169.A N ASP 165.A O no hydrogen 3.080 N/A ALA 170.A N ASP 166.A O no hydrogen 2.945 N/A PHE 172.A N ASP 168.A O no hydrogen 3.189 N/A ILE 173.A N LEU 169.A O no hydrogen 2.798 N/A ALA 174.A N ALA 170.A O no hydrogen 3.251 N/A VAL 175.A N ILE 171.A O no hydrogen 3.052 N/A ILE 176.A N PHE 172.A O no hydrogen 3.159 N/A ILE 177.A N ILE 173.A O no hydrogen 3.279 N/A LEU 178.A N ALA 174.A O no hydrogen 3.115 N/A SER 179.A OG ILE 176.A O no hydrogen 2.690 N/A ARG 182.A NH1 GLU 109.A OE1 no hydrogen 3.076 N/A ARG 182.A NH1 GLU 109.A OE2 no hydrogen 3.504 N/A ARG 182.A NH2 GLU 109.A OE2 no hydrogen 3.017 N/A LEU 186.A N ASP 98.A OD1 no hydrogen 2.861 N/A ASN 187.A N ASP 98.A OD2 no hydrogen 2.927 N/A LYS 189.A NZ ASP 193.A OD1 no hydrogen 2.971 N/A LYS 189.A NZ ASP 193.A OD2 no hydrogen 3.502 N/A GLU 192.A N VAL 188.A O no hydrogen 3.205 N/A ASP 193.A N LYS 189.A O no hydrogen 3.211 N/A ILE 194.A N PRO 190.A O no hydrogen 3.360 N/A GLN 195.A N ILE 191.A O no hydrogen 2.861 N/A GLN 195.A NE2 VAL 175.A O no hydrogen 2.951 N/A ASP 196.A N GLU 192.A O no hydrogen 2.657 N/A ASN 197.A N ASP 193.A O no hydrogen 3.288 N/A LEU 198.A N ILE 194.A O no hydrogen 2.906 N/A LEU 199.A N GLN 195.A O no hydrogen 2.704 N/A GLN 200.A N ASP 196.A O no hydrogen 3.003 N/A GLN 200.A NE2 ASP 196.A OD1 no hydrogen 3.428 N/A ALA 201.A N ASN 197.A O no hydrogen 3.082 N/A LEU 202.A N LEU 198.A O no hydrogen 2.828 N/A GLU 203.A N LEU 199.A O no hydrogen 2.917 N/A LEU 204.A N GLN 200.A O no hydrogen 3.202 N/A GLN 205.A N ALA 201.A O no hydrogen 2.830 N/A GLN 205.A NE2 ASP 168.A OD1 no hydrogen 2.924 N/A LEU 206.A N LEU 202.A O no hydrogen 2.820 N/A LYS 207.A N GLU 203.A O no hydrogen 3.156 N/A LEU 208.A N LEU 204.A O no hydrogen 2.887 N/A ASN 209.A N GLN 205.A O no hydrogen 2.866 N/A ASN 209.A ND2 ASP 165.A OD2 no hydrogen 2.723 N/A ASN 209.A ND2 ASP 168.A OD1 no hydrogen 2.848 N/A HIS 210.A N LEU 206.A O no hydrogen 2.806 N/A HIS 210.A NE2 ASP 168.A OD2 no hydrogen 2.709 N/A SER 213.A N HIS 210.A O no hydrogen 3.038 N/A LYS 219.A N GLN 215.A O no hydrogen 2.993 N/A LYS 219.A NZ SER 214.A O no hydrogen 3.422 N/A LEU 220.A N LEU 216.A O no hydrogen 2.666 N/A LEU 221.A N PHE 217.A O no hydrogen 2.910 N/A GLN 222.A N ALA 218.A O no hydrogen 3.050 N/A LYS 223.A N LEU 220.A O no hydrogen 3.031 N/A MET 224.A N LEU 221.A O no hydrogen 2.944 N/A THR 225.A N GLN 222.A O no hydrogen 3.270 N/A THR 225.A OG1 GLN 222.A O no hydrogen 3.207 N/A ASP 226.A N LYS 223.A O no hydrogen 2.999 N/A LEU 227.A N LYS 223.A O no hydrogen 3.227 N/A ARG 228.A N MET 224.A O no hydrogen 3.485 N/A ARG 228.A NE GLU 109.A OE1 no hydrogen 2.946 N/A ARG 228.A NH2 ASP 181.A OD2 no hydrogen 2.896 N/A GLN 229.A N THR 225.A O no hydrogen 3.439 N/A GLN 229.A NE2 GLU 233.A OE2 no hydrogen 2.743 N/A ILE 230.A N ASP 226.A O no hydrogen 3.096 N/A VAL 231.A N LEU 227.A O no hydrogen 3.006 N/A THR 232.A N ARG 228.A O no hydrogen 3.011 N/A THR 232.A OG1 ARG 228.A O no hydrogen 3.201 N/A GLU 233.A N GLN 229.A O no hydrogen 3.006 N/A HIS 234.A N ILE 230.A O no hydrogen 3.010 N/A VAL 235.A N VAL 231.A O no hydrogen 2.913 N/A GLN 236.A N THR 232.A O no hydrogen 3.011 N/A LEU 237.A N GLU 233.A O no hydrogen 2.977 N/A LEU 238.A N HIS 234.A O no hydrogen 2.968 N/A GLN 239.A N VAL 235.A O no hydrogen 3.240 N/A ILE 241.A N LEU 237.A O no hydrogen 3.242 N/A LYS 242.A N LEU 238.A O no hydrogen 2.913 N/A LYS 243.A N VAL 240.A O no hydrogen 3.312 N/A THR 244.A N VAL 240.A O no hydrogen 3.135 N/A THR 244.A OG1 VAL 240.A O no hydrogen 3.400 N/A GLU 245.A N ILE 241.A O no hydrogen 2.632 N/A LEU 253.A N HIS 251.A ND1 no hydrogen 3.295 N/A GLN 255.A N HIS 251.A O no hydrogen 3.013 N/A GLN 255.A NE2 LEU 250.A O no hydrogen 3.629 N/A GLU 256.A N PRO 252.A O no hydrogen 2.701 N/A ILE 257.A N LEU 253.A O no hydrogen 3.093 N/A TYR 258.A N LEU 254.A O no hydrogen 2.994 N/A TYR 258.A OH HIS 108.A NE2 no hydrogen 2.649 N/A LEU 261.A N TYR 258.A O no hydrogen 3.110 N/A