Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1nq2_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 6.A N GLU 6.A OE1 no hydrogen 2.555 N/A LEU 7.A N GLU 6.A OE1 no hydrogen 2.898 N/A GLN 8.A NE2 ALA 4.A O no hydrogen 3.416 N/A LYS 9.A NZ GLU 199.A OE1 no hydrogen 3.220 N/A SER 10.A N GLU 6.A O no hydrogen 2.769 N/A ILE 11.A N LEU 7.A O no hydrogen 3.106 N/A GLY 12.A N LYS 9.A O no hydrogen 2.703 N/A HIS 13.A N GLN 8.A O no hydrogen 3.147 N/A THR 18.A N GLU 21.A OE1 no hydrogen 2.740 N/A GLU 21.A N THR 18.A OG1 no hydrogen 3.216 N/A TRP 22.A N THR 18.A O no hydrogen 2.866 N/A GLU 23.A N ASP 19.A O no hydrogen 3.345 N/A GLU 23.A N GLU 20.A O no hydrogen 3.067 N/A LEU 24.A N GLU 20.A O no hydrogen 3.155 N/A ILE 25.A N GLU 21.A O no hydrogen 2.800 N/A LYS 26.A N TRP 22.A O no hydrogen 3.139 N/A THR 27.A N GLU 23.A O no hydrogen 2.918 N/A THR 27.A OG1 GLU 23.A O no hydrogen 2.973 N/A VAL 28.A N LEU 24.A O no hydrogen 2.904 N/A THR 29.A N ILE 25.A O no hydrogen 2.901 N/A THR 29.A OG1 ILE 25.A O no hydrogen 2.675 N/A THR 29.A OG1 THR 163.A OG1 no hydrogen 2.814 N/A GLU 30.A N LYS 26.A O no hydrogen 2.976 N/A ALA 31.A N THR 27.A O no hydrogen 3.087 N/A HIS 32.A N VAL 28.A O no hydrogen 3.037 N/A VAL 33.A N THR 29.A O no hydrogen 2.790 N/A ALA 34.A N GLU 30.A O no hydrogen 2.881 N/A THR 35.A N HIS 32.A O no hydrogen 3.014 N/A THR 35.A OG1 ALA 31.A O no hydrogen 2.765 N/A THR 35.A OG1 HIS 32.A O no hydrogen 3.361 N/A ASN 36.A N VAL 33.A O no hydrogen 3.433 N/A ARG 46.A NE LYS 43.A O no hydrogen 2.937 N/A ARG 46.A NH2 LYS 43.A O no hydrogen 3.087 N/A LYS 47.A N GLU 128.A O no hydrogen 2.868 N/A LEU 49.A N ALA 130.A O no hydrogen 3.237 N/A ASP 52.A N PRO 50.A O no hydrogen 2.539 N/A ILE 53.A N PRO 50.A O no hydrogen 3.022 N/A GLN 55.A N ASP 52.A O no hydrogen 3.435 N/A ASP 60.A N ASN 138.A O no hydrogen 3.081 N/A PHE 64.A N ASP 60.A O no hydrogen 3.018 N/A SER 65.A N LEU 61.A O no hydrogen 2.859 N/A HIS 66.A N GLU 62.A O no hydrogen 3.064 N/A PHE 67.A N ALA 63.A O no hydrogen 2.881 N/A THR 68.A N PHE 64.A O no hydrogen 2.853 N/A THR 68.A OG1 PHE 64.A O no hydrogen 2.743 N/A THR 68.A OG1 SER 65.A O no hydrogen 3.126 N/A LYS 69.A N SER 65.A O no hydrogen 3.011 N/A ILE 70.A N PHE 67.A O no hydrogen 3.340 N/A ILE 71.A N THR 68.A O no hydrogen 3.523 N/A ILE 75.A N ILE 71.A O no hydrogen 3.051 N/A THR 76.A N THR 72.A O no hydrogen 3.024 N/A THR 76.A OG1 THR 72.A O no hydrogen 2.890 N/A ARG 77.A N PRO 73.A O no hydrogen 3.098 N/A ARG 77.A NH2 ASN 126.A OD1 no hydrogen 2.614 N/A VAL 78.A N ILE 75.A O no hydrogen 2.928 N/A VAL 79.A N ILE 75.A O no hydrogen 3.176 N/A ASP 80.A N THR 76.A O no hydrogen 2.974 N/A PHE 81.A N ARG 77.A O no hydrogen 3.010 N/A ALA 82.A N VAL 78.A O no hydrogen 3.141 N/A LYS 83.A N VAL 79.A O no hydrogen 2.890 N/A LYS 83.A NZ ASP 80.A OD1 no hydrogen 3.423 N/A LYS 84.A N ASP 80.A O no hydrogen 3.307 N/A LYS 84.A N PHE 81.A O no hydrogen 3.184 N/A LEU 85.A N ALA 82.A O no hydrogen 2.996 N/A CYS 89.A N LEU 85.A O no hydrogen 3.249 N/A CYS 89.A SG LYS 83.A O no hydrogen 3.446 N/A CYS 89.A SG LEU 85.A O no hydrogen 3.763 N/A GLU 90.A N PRO 86.A O no hydrogen 3.205 N/A GLU 90.A N MET 87.A O no hydrogen 3.207 N/A LEU 91.A N PHE 88.A O no hydrogen 3.050 N/A GLN 96.A N PRO 92.A O no hydrogen 2.936 N/A GLN 96.A NE2 PHE 88.A O no hydrogen 3.054 N/A ILE 97.A N CYS 93.A O no hydrogen 3.264 N/A ILE 98.A N GLU 94.A O no hydrogen 3.446 N/A LEU 99.A N ASP 95.A O no hydrogen 2.847 N/A LEU 100.A N GLN 96.A O no hydrogen 3.089 N/A LYS 101.A N ILE 97.A O no hydrogen 2.775 N/A GLY 102.A N ILE 98.A O no hydrogen 3.018 N/A CYS 103.A N LEU 99.A O no hydrogen 2.970 N/A CYS 103.A SG LEU 99.A O no hydrogen 3.452 N/A CYS 103.A SG LEU 100.A O no hydrogen 3.995 N/A CYS 104.A N LEU 100.A O no hydrogen 2.920 N/A ILE 107.A N CYS 103.A O no hydrogen 2.776 N/A MET 108.A N CYS 104.A O no hydrogen 2.949 N/A SER 109.A N MET 105.A O no hydrogen 2.889 N/A SER 109.A OG MET 105.A O no hydrogen 2.975 N/A SER 109.A OG GLU 106.A O no hydrogen 3.075 N/A LEU 110.A N GLU 106.A O no hydrogen 3.135 N/A ARG 111.A N ILE 107.A O no hydrogen 2.928 N/A ARG 111.A NE GLN 169.A OE1 no hydrogen 2.733 N/A ARG 111.A NH1 THR 35.A O no hydrogen 3.285 N/A ARG 111.A NH2 HIS 32.A ND1 no hydrogen 3.107 N/A ARG 111.A NH2 THR 35.A OG1 no hydrogen 3.248 N/A THR 112.A N MET 108.A O no hydrogen 3.185 N/A ALA 113.A N SER 109.A O no hydrogen 2.949 N/A VAL 114.A N LEU 110.A O no hydrogen 2.925 N/A ARG 115.A N THR 112.A O no hydrogen 3.342 N/A ARG 115.A NH1 ALA 37.A O no hydrogen 3.075 N/A ARG 115.A NH2 ALA 37.A O no hydrogen 3.102 N/A TYR 116.A N ALA 113.A O no hydrogen 2.949 N/A GLU 117.A N THR 122.A O no hydrogen 2.676 N/A GLU 119.A N GLU 117.A OE2 no hydrogen 2.818 N/A SER 120.A N GLU 117.A OE1 no hydrogen 2.556 N/A SER 120.A OG GLU 117.A OE1 no hydrogen 2.685 N/A SER 120.A OG THR 122.A OG1 no hydrogen 2.797 N/A THR 122.A N GLU 117.A O no hydrogen 2.961 N/A THR 122.A OG1 SER 120.A OG no hydrogen 2.797 N/A LEU 123.A N VAL 131.A O no hydrogen 3.005 N/A LEU 125.A N MET 129.A O no hydrogen 2.461 N/A GLU 128.A N LEU 125.A O no hydrogen 3.095 N/A ALA 130.A N LYS 47.A O no hydrogen 3.003 N/A VAL 131.A N LEU 123.A O no hydrogen 2.714 N/A ARG 133.A NH1 ASP 146.A OD2 no hydrogen 2.952 N/A ARG 133.A NH1 ASP 150.A OD1 no hydrogen 2.971 N/A ARG 133.A NH2 ASP 150.A OD1 no hydrogen 3.185 N/A GLN 135.A N THR 132.A OG1 no hydrogen 3.343 N/A LEU 136.A N THR 132.A O no hydrogen 3.051 N/A LYS 137.A N ARG 133.A O no hydrogen 2.922 N/A LYS 137.A NZ ASP 146.A OD1 no hydrogen 2.969 N/A ASN 138.A N GLY 134.A O no hydrogen 2.786 N/A ASN 138.A ND2 GLY 54.A O no hydrogen 2.951 N/A GLY 139.A N LEU 136.A O no hydrogen 3.278 N/A GLY 140.A N LYS 137.A O no hydrogen 3.113 N/A GLY 142.A N LYS 137.A O no hydrogen 3.123 N/A VAL 144.A N LEU 141.A O no hydrogen 2.813 N/A SER 145.A N GLY 142.A O no hydrogen 2.984 N/A SER 145.A OG ARG 133.A O no hydrogen 2.849 N/A ALA 147.A N VAL 143.A O no hydrogen 2.967 N/A ILE 148.A N VAL 144.A O no hydrogen 2.917 N/A PHE 149.A N SER 145.A O no hydrogen 2.936 N/A ASP 150.A N ASP 146.A O no hydrogen 2.870 N/A LEU 151.A N ALA 147.A O no hydrogen 2.955 N/A GLY 152.A N ILE 148.A O no hydrogen 2.805 N/A MET 153.A N PHE 149.A O no hydrogen 2.929 N/A SER 154.A N ASP 150.A O no hydrogen 3.061 N/A LEU 155.A N LEU 151.A O no hydrogen 2.852 N/A SER 156.A N MET 153.A O no hydrogen 3.431 N/A SER 156.A OG GLY 152.A O no hydrogen 3.529 N/A SER 156.A OG MET 153.A O no hydrogen 3.439 N/A PHE 158.A N LEU 155.A O no hydrogen 2.936 N/A ASN 159.A N SER 156.A O no hydrogen 3.374 N/A ASP 161.A N GLU 164.A OE1 no hydrogen 2.899 N/A THR 163.A OG1 THR 29.A OG1 no hydrogen 2.814 N/A GLU 164.A N ASP 161.A OD1 no hydrogen 2.780 N/A VAL 165.A N ASP 161.A O no hydrogen 3.162 N/A ALA 166.A N ASP 162.A O no hydrogen 2.866 N/A LEU 167.A N THR 163.A O no hydrogen 2.819 N/A LEU 168.A N GLU 164.A O no hydrogen 3.098 N/A GLN 169.A N VAL 165.A O no hydrogen 3.029 N/A GLN 169.A NE2 HIS 32.A ND1 no hydrogen 3.208 N/A ALA 170.A N ALA 166.A O no hydrogen 2.854 N/A VAL 171.A N LEU 167.A O no hydrogen 2.858 N/A LEU 172.A N LEU 168.A O no hydrogen 2.849 N/A LEU 173.A N GLN 169.A O no hydrogen 2.766 N/A MET 174.A N ALA 170.A O no hydrogen 3.042 N/A SER 175.A N LEU 173.A O no hydrogen 2.847 N/A SER 175.A OG LEU 172.A O no hydrogen 2.637 N/A ARG 178.A N SER 175.A O no hydrogen 3.461 N/A ARG 178.A NH1 GLU 106.A OE2 no hydrogen 3.262 N/A ARG 178.A NH2 GLU 106.A OE1 no hydrogen 2.764 N/A ARG 178.A NH2 LEU 172.A O no hydrogen 3.103 N/A ALA 182.A N ASP 95.A OD1 no hydrogen 2.805 N/A ALA 182.A N ASP 95.A OD2 no hydrogen 3.272 N/A CYS 183.A N ASP 95.A OD2 no hydrogen 2.802 N/A CYS 183.A SG ASP 95.A OD2 no hydrogen 3.394 N/A ILE 187.A N CYS 183.A O no hydrogen 3.028 N/A GLU 188.A N VAL 184.A O no hydrogen 3.082 N/A GLU 188.A N GLU 185.A O no hydrogen 3.213 N/A LYS 189.A N GLU 185.A O no hydrogen 3.016 N/A TYR 190.A N ARG 186.A O no hydrogen 3.098 N/A GLN 191.A N ILE 187.A O no hydrogen 3.123 N/A ASP 192.A N GLU 188.A O no hydrogen 3.074 N/A SER 193.A N LYS 189.A O no hydrogen 3.222 N/A SER 193.A OG LYS 189.A O no hydrogen 3.032 N/A PHE 194.A N TYR 190.A O no hydrogen 3.064 N/A LEU 195.A N GLN 191.A O no hydrogen 2.889 N/A LEU 196.A N ASP 192.A O no hydrogen 2.971 N/A ALA 197.A N SER 193.A O no hydrogen 3.144 N/A PHE 198.A N PHE 194.A O no hydrogen 2.647 N/A GLU 199.A N LEU 195.A O no hydrogen 2.868 N/A HIS 200.A N LEU 196.A O no hydrogen 3.171 N/A HIS 200.A ND1 GLU 21.A OE1 no hydrogen 2.558 N/A HIS 200.A NE2 GLU 5.A OE2 no hydrogen 3.056 N/A TYR 201.A N ALA 197.A O no hydrogen 2.842 N/A TYR 201.A OH ASP 161.A OD2 no hydrogen 2.563 N/A ILE 202.A N PHE 198.A O no hydrogen 2.937 N/A ASN 203.A N GLU 199.A O no hydrogen 3.048 N/A ASN 203.A ND2 PRO 15.A O no hydrogen 2.898 N/A TYR 204.A N HIS 200.A O no hydrogen 3.089 N/A ARG 205.A N TYR 201.A O no hydrogen 2.841 N/A ARG 205.A NE GLU 164.A OE2 no hydrogen 2.834 N/A ARG 205.A NH2 GLU 164.A OE1 no hydrogen 2.963 N/A LYS 206.A N ILE 202.A O no hydrogen 3.152 N/A LYS 215.A N HIS 211.A O no hydrogen 3.133 N/A LYS 215.A NZ THR 210.A O no hydrogen 3.040 N/A LEU 216.A N PHE 212.A O no hydrogen 2.754 N/A LEU 217.A N TRP 213.A O no hydrogen 2.886 N/A MET 218.A N PRO 214.A O no hydrogen 3.074 N/A LYS 219.A N LEU 216.A O no hydrogen 3.042 N/A ASP 222.A N MET 218.A O no hydrogen 3.212 N/A LEU 223.A N LYS 219.A O no hydrogen 2.859 N/A ARG 224.A N VAL 220.A O no hydrogen 2.970 N/A ARG 224.A NH1 GLN 191.A OE1 no hydrogen 3.461 N/A MET 225.A N THR 221.A O no hydrogen 2.793 N/A ILE 226.A N ASP 222.A O no hydrogen 2.740 N/A GLY 227.A N LEU 223.A O no hydrogen 2.947 N/A ALA 228.A N ARG 224.A O no hydrogen 2.996 N/A CYS 229.A N MET 225.A O no hydrogen 2.843 N/A HIS 230.A N ILE 226.A O no hydrogen 2.877 N/A HIS 230.A N GLY 227.A O no hydrogen 2.928 N/A ALA 231.A N GLY 227.A O no hydrogen 3.072 N/A ARG 233.A N CYS 229.A O no hydrogen 3.188 N/A ARG 233.A NH1 GLY 140.A O no hydrogen 3.111 N/A PHE 234.A N HIS 230.A O no hydrogen 2.752 N/A LEU 235.A N ALA 231.A O no hydrogen 3.233 N/A HIS 236.A N SER 232.A O no hydrogen 2.987 N/A MET 237.A N ARG 233.A O no hydrogen 3.025 N/A MET 237.A N PHE 234.A O no hydrogen 3.273 N/A LYS 238.A N PHE 234.A O no hydrogen 3.021 N/A GLU 240.A N MET 237.A O no hydrogen 3.044 N/A LEU 245.A N PRO 242.A O no hydrogen 3.103 N/A PHE 246.A N THR 243.A O no hydrogen 2.705 N/A LEU 251.A N PRO 247.A O no hydrogen 3.003 N/A GLU 252.A N PRO 248.A O no hydrogen 3.266 N/A VAL 253.A N LEU 249.A O no hydrogen 3.176 N/A PHE 254.A N PHE 250.A O no hydrogen 3.454 N/A