Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2pix_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 5.A N PRO 1.A O no hydrogen 3.213 N/A VAL 6.A N ILE 2.A O no hydrogen 3.143 N/A LEU 7.A N PHE 3.A O no hydrogen 3.228 N/A GLU 8.A N LEU 4.A O no hydrogen 3.125 N/A ALA 9.A N ASN 5.A O no hydrogen 2.857 N/A ALA 9.A N VAL 6.A O no hydrogen 2.823 N/A ILE 10.A N VAL 6.A O no hydrogen 2.747 N/A ALA 17.A N ASP 97.A OD1 no hydrogen 2.780 N/A HIS 19.A N ASP 97.A OD2 no hydrogen 2.758 N/A HIS 19.A ND1 SER 33.A OG no hydrogen 2.787 N/A ASN 22.A N ASP 20.A OD1 no hydrogen 2.936 N/A GLN 23.A N ASP 20.A O no hydrogen 3.360 N/A ALA 29.A N SER 26.A OG no hydrogen 3.238 N/A LEU 30.A N SER 26.A O no hydrogen 2.944 N/A LEU 31.A N PHE 27.A O no hydrogen 2.960 N/A SER 32.A N ALA 28.A O no hydrogen 2.886 N/A SER 32.A OG ALA 28.A O no hydrogen 2.716 N/A SER 33.A N ALA 29.A O no hydrogen 3.042 N/A SER 33.A OG HIS 19.A ND1 no hydrogen 2.787 N/A SER 33.A OG ALA 29.A O no hydrogen 2.869 N/A LEU 34.A N LEU 30.A O no hydrogen 3.086 N/A ASN 35.A N LEU 31.A O no hydrogen 2.963 N/A ASN 35.A ND2 ASP 220.A O no hydrogen 2.955 N/A GLU 36.A N SER 32.A O no hydrogen 3.072 N/A LEU 37.A N SER 33.A O no hydrogen 2.761 N/A GLY 38.A N LEU 34.A O no hydrogen 2.789 N/A GLU 39.A N ASN 35.A O no hydrogen 2.918 N/A ARG 40.A N GLU 36.A O no hydrogen 3.073 N/A ARG 40.A NE GLU 36.A OE2 no hydrogen 3.074 N/A ARG 40.A NH1 CYS 16.A O no hydrogen 2.947 N/A GLN 41.A N LEU 37.A O no hydrogen 2.709 N/A LEU 42.A N GLY 38.A O no hydrogen 2.783 N/A LEU 42.A N GLU 39.A O no hydrogen 3.259 N/A VAL 43.A N GLU 39.A O no hydrogen 3.343 N/A VAL 43.A N ARG 40.A O no hydrogen 3.176 N/A HIS 44.A ND1 ARG 40.A O no hydrogen 3.061 N/A VAL 45.A N GLN 41.A O no hydrogen 3.198 N/A VAL 46.A N LEU 42.A O no hydrogen 3.021 N/A LYS 47.A N VAL 43.A O no hydrogen 3.397 N/A TRP 48.A N HIS 44.A O no hydrogen 2.723 N/A ALA 49.A N VAL 45.A O no hydrogen 2.806 N/A LYS 50.A N VAL 46.A O no hydrogen 3.098 N/A ALA 51.A N LYS 47.A O no hydrogen 3.141 N/A LEU 52.A N ALA 49.A O no hydrogen 2.697 N/A PHE 55.A N LEU 52.A O no hydrogen 3.044 N/A ASN 57.A N GLY 54.A O no hydrogen 3.009 N/A LEU 58.A N PHE 55.A O no hydrogen 3.269 N/A ASP 61.A N HIS 59.A ND1 no hydrogen 2.814 N/A GLN 63.A N HIS 59.A O no hydrogen 2.927 N/A GLN 63.A NE2 LEU 58.A O no hydrogen 2.794 N/A MET 64.A N VAL 60.A O no hydrogen 3.365 N/A ALA 65.A N ASP 61.A O no hydrogen 2.974 N/A VAL 66.A N ASP 62.A O no hydrogen 3.070 N/A GLN 68.A N MET 64.A O no hydrogen 2.974 N/A SER 70.A N VAL 66.A O no hydrogen 3.183 N/A SER 70.A OG VAL 66.A O no hydrogen 2.946 N/A SER 70.A OG LEU 142.A O no hydrogen 3.478 N/A LEU 74.A N SER 70.A O no hydrogen 3.104 N/A MET 75.A N TRP 71.A O no hydrogen 3.221 N/A VAL 76.A N MET 72.A O no hydrogen 3.183 N/A PHE 77.A N GLY 73.A O no hydrogen 3.130 N/A ALA 78.A N LEU 74.A O no hydrogen 2.960 N/A MET 79.A N MET 75.A O no hydrogen 2.824 N/A GLY 80.A N VAL 76.A O no hydrogen 2.889 N/A TRP 81.A N PHE 77.A O no hydrogen 3.167 N/A TRP 81.A N ALA 78.A O no hydrogen 2.965 N/A ARG 82.A N ALA 78.A O no hydrogen 3.085 N/A ARG 82.A NE TYR 93.A O no hydrogen 3.333 N/A ARG 82.A NH2 PHE 94.A O no hydrogen 2.671 N/A SER 83.A N MET 79.A O no hydrogen 3.049 N/A SER 83.A OG MET 79.A O no hydrogen 3.059 N/A SER 83.A OG MET 91.A O no hydrogen 3.298 N/A PHE 84.A N GLY 80.A O no hydrogen 3.270 N/A THR 85.A N TRP 81.A O no hydrogen 2.873 N/A THR 85.A OG1 TRP 81.A O no hydrogen 3.045 N/A THR 85.A OG1 ARG 82.A O no hydrogen 3.410 N/A ASN 86.A N ARG 82.A O no hydrogen 2.711 N/A ASN 86.A ND2 ARG 82.A O no hydrogen 3.111 N/A VAL 87.A N SER 83.A O no hydrogen 3.121 N/A SER 89.A N SER 83.A O no hydrogen 2.702 N/A SER 89.A OG SER 121.A O no hydrogen 3.053 N/A SER 89.A OG SER 121.A OG no hydrogen 2.934 N/A ARG 90.A N VAL 87.A O no hydrogen 3.006 N/A LEU 92.A N PHE 100.A O no hydrogen 3.136 N/A TYR 93.A N SER 83.A OG no hydrogen 2.745 N/A LEU 98.A N ALA 95.A O no hydrogen 2.810 N/A PHE 100.A N LEU 92.A O no hydrogen 2.872 N/A ARG 104.A N ASN 101.A OD1 no hydrogen 2.674 N/A ARG 104.A NE ASP 25.A OD1 no hydrogen 3.165 N/A ARG 104.A NE ASP 25.A OD2 no hydrogen 3.335 N/A ARG 104.A NH1 VAL 99.A O no hydrogen 2.885 N/A ARG 104.A NH2 ASN 21.A OD1 no hydrogen 3.388 N/A MET 105.A N ASN 101.A O no hydrogen 2.829 N/A HIS 106.A N TYR 103.A O no hydrogen 2.751 N/A LYS 107.A N TYR 103.A O no hydrogen 2.946 N/A SER 108.A N ARG 104.A O no hydrogen 2.856 N/A SER 108.A OG ARG 104.A O no hydrogen 3.312 N/A SER 108.A OG MET 105.A O no hydrogen 2.880 N/A ARG 109.A N HIS 106.A O no hydrogen 3.101 N/A TYR 111.A OH GLU 102.A OE1 no hydrogen 3.269 N/A SER 112.A OG GLN 113.A OE1 no hydrogen 2.911 N/A GLN 113.A N GLN 113.A OE1 no hydrogen 2.876 N/A CYS 114.A N MET 110.A O no hydrogen 3.269 N/A CYS 114.A SG MET 110.A O no hydrogen 3.334 N/A VAL 115.A N TYR 111.A O no hydrogen 3.027 N/A ARG 116.A N SER 112.A O no hydrogen 3.380 N/A ARG 116.A NH1 GLU 202.A OE2 no hydrogen 3.082 N/A MET 117.A N GLN 113.A O no hydrogen 3.168 N/A ARG 118.A N CYS 114.A O no hydrogen 2.720 N/A HIS 119.A N ARG 116.A O no hydrogen 3.153 N/A LEU 120.A N ARG 116.A O no hydrogen 2.905 N/A SER 121.A N MET 117.A O no hydrogen 2.938 N/A SER 121.A OG GLY 80.A O no hydrogen 3.017 N/A SER 121.A OG SER 89.A OG no hydrogen 2.934 N/A GLN 122.A N ARG 118.A O no hydrogen 3.340 N/A GLU 123.A N HIS 119.A O no hydrogen 3.087 N/A GLU 123.A N LEU 120.A O no hydrogen 3.105 N/A GLY 125.A N GLN 122.A O no hydrogen 2.890 N/A TRP 126.A N GLN 122.A O no hydrogen 2.942 N/A LEU 127.A N GLU 123.A O no hydrogen 2.963 N/A GLN 128.A N GLY 125.A O no hydrogen 2.892 N/A ILE 129.A N PHE 124.A O no hydrogen 2.942 N/A THR 130.A N GLU 133.A OE1 no hydrogen 2.909 N/A THR 130.A OG1 GLN 132.A OE1 no hydrogen 2.818 N/A GLU 133.A N THR 130.A OG1 no hydrogen 3.307 N/A PHE 134.A N THR 130.A O no hydrogen 2.877 N/A LEU 135.A N PRO 131.A O no hydrogen 3.040 N/A CYS 136.A N GLN 132.A O no hydrogen 3.226 N/A CYS 136.A SG TYR 164.A O no hydrogen 3.957 N/A MET 137.A N GLU 133.A O no hydrogen 3.010 N/A LYS 138.A N PHE 134.A O no hydrogen 2.952 N/A LYS 138.A NZ GLU 11.A OE2 no hydrogen 3.048 N/A ALA 139.A N LEU 135.A O no hydrogen 3.310 N/A LEU 140.A N CYS 136.A O no hydrogen 3.338 N/A LEU 141.A N MET 137.A O no hydrogen 3.116 N/A LEU 141.A N LYS 138.A O no hydrogen 2.982 N/A LEU 142.A N ALA 139.A O no hydrogen 2.957 N/A PHE 143.A N LEU 140.A O no hydrogen 3.203 N/A SER 144.A OG LEU 140.A O no hydrogen 2.491 N/A VAL 148.A N LYS 240.A O no hydrogen 2.828 N/A GLY 150.A N PRO 147.A O no hydrogen 2.859 N/A LEU 151.A N GLN 154.A OE1 no hydrogen 2.887 N/A LYS 152.A N ASP 62.A OD1 no hydrogen 3.047 N/A ASN 153.A N ASP 62.A OD2 no hydrogen 3.136 N/A PHE 157.A N ASN 153.A O no hydrogen 3.328 N/A ASP 158.A N GLN 154.A O no hydrogen 2.859 N/A GLU 159.A N LYS 155.A O no hydrogen 3.165 N/A LEU 160.A N PHE 156.A O no hydrogen 3.055 N/A ARG 161.A N PHE 157.A O no hydrogen 2.875 N/A ARG 161.A NH1 PHE 143.A O no hydrogen 2.796 N/A MET 162.A N ASP 158.A O no hydrogen 2.765 N/A ASN 163.A N GLU 159.A O no hydrogen 2.947 N/A ASN 163.A ND2 GLU 159.A OE2 no hydrogen 2.760 N/A TYR 164.A N LEU 160.A O no hydrogen 3.397 N/A TYR 164.A OH PRO 53.A O no hydrogen 2.745 N/A ILE 165.A N ARG 161.A O no hydrogen 3.115 N/A LYS 166.A N MET 162.A O no hydrogen 3.172 N/A GLU 167.A N ASN 163.A O no hydrogen 3.142 N/A LEU 168.A N TYR 164.A O no hydrogen 3.270 N/A ASP 169.A N ILE 165.A O no hydrogen 3.337 N/A ARG 170.A N LYS 166.A O no hydrogen 3.068 N/A ARG 170.A NH2 GLU 167.A OE1 no hydrogen 2.637 N/A ILE 171.A N GLU 167.A O no hydrogen 2.953 N/A ILE 172.A N LEU 168.A O no hydrogen 2.939 N/A ALA 173.A N ASP 169.A O no hydrogen 2.603 N/A CYS 174.A N ILE 171.A O no hydrogen 3.321 N/A CYS 174.A SG ARG 170.A O no hydrogen 3.071 N/A SER 181.A OG ASN 178.A O no hydrogen 3.370 N/A CYS 182.A N ASN 178.A O no hydrogen 3.301 N/A SER 183.A N PRO 179.A O no hydrogen 3.261 N/A ARG 185.A N SER 181.A O no hydrogen 2.723 N/A ARG 185.A NE GLU 133.A OE2 no hydrogen 3.050 N/A ARG 185.A NH1 LEU 127.A O no hydrogen 2.887 N/A ARG 185.A NH1 GLN 188.A OE1 no hydrogen 3.033 N/A ARG 185.A NH2 LEU 127.A O no hydrogen 3.325 N/A ARG 185.A NH2 GLN 128.A O no hydrogen 3.191 N/A ARG 185.A NH2 GLU 133.A OE1 no hydrogen 2.764 N/A ARG 185.A NH2 GLU 133.A OE2 no hydrogen 3.351 N/A PHE 186.A N CYS 182.A O no hydrogen 3.396 N/A GLN 188.A N ARG 184.A O no hydrogen 3.270 N/A LEU 189.A N ARG 185.A O no hydrogen 3.202 N/A THR 190.A N PHE 186.A O no hydrogen 3.026 N/A THR 190.A OG1 PHE 186.A O no hydrogen 2.884 N/A THR 190.A OG1 TYR 187.A O no hydrogen 2.717 N/A THR 190.A OG1 HIS 247.A NE2 no hydrogen 2.831 N/A LYS 191.A N TYR 187.A O no hydrogen 3.197 N/A LEU 192.A N GLN 188.A O no hydrogen 3.021 N/A LEU 193.A N LEU 189.A O no hydrogen 2.904 N/A ASP 194.A N THR 190.A O no hydrogen 3.230 N/A SER 195.A N LYS 191.A O no hydrogen 2.901 N/A SER 195.A OG LEU 192.A O no hydrogen 2.596 N/A VAL 196.A N LEU 193.A O no hydrogen 3.169 N/A GLN 197.A N ASP 194.A O no hydrogen 3.161 N/A ALA 200.A N VAL 196.A O no hydrogen 2.925 N/A ARG 201.A N GLN 197.A O no hydrogen 2.853 N/A GLU 202.A N PRO 198.A O no hydrogen 3.131 N/A GLU 202.A N ILE 199.A O no hydrogen 3.033 N/A LEU 203.A N ILE 199.A O no hydrogen 3.160 N/A HIS 204.A N ALA 200.A O no hydrogen 2.976 N/A GLN 205.A N ARG 201.A O no hydrogen 3.160 N/A PHE 206.A N GLU 202.A O no hydrogen 3.079 N/A THR 207.A N LEU 203.A O no hydrogen 2.835 N/A PHE 208.A N HIS 204.A O no hydrogen 3.092 N/A ASP 209.A N GLN 205.A O no hydrogen 3.133 N/A LEU 210.A N PHE 206.A O no hydrogen 2.905 N/A LEU 211.A N THR 207.A O no hydrogen 2.896 N/A ILE 212.A N PHE 208.A O no hydrogen 2.999 N/A LYS 213.A N ASP 209.A O no hydrogen 3.167 N/A SER 214.A N LEU 211.A O no hydrogen 3.349 N/A SER 214.A OG LEU 211.A O no hydrogen 2.811 N/A VAL 217.A N LYS 213.A O no hydrogen 3.353 N/A SER 218.A N HIS 215.A O no hydrogen 3.432 N/A VAL 219.A N SER 214.A O no hydrogen 2.858 N/A ASP 220.A N SER 32.A OG no hydrogen 3.130 N/A MET 225.A N GLU 39.A OE1 no hydrogen 3.180 N/A ALA 226.A N PRO 222.A O no hydrogen 2.831 N/A GLU 227.A N GLU 223.A O no hydrogen 3.108 N/A ILE 228.A N MET 224.A O no hydrogen 3.076 N/A ILE 229.A N MET 225.A O no hydrogen 3.105 N/A SER 230.A OG ALA 226.A O no hydrogen 2.712 N/A SER 230.A OG GLU 227.A O no hydrogen 3.197 N/A VAL 231.A N GLU 227.A O no hydrogen 2.850 N/A GLN 232.A N ILE 228.A O no hydrogen 2.854 N/A VAL 233.A N ILE 228.A O no hydrogen 2.851 N/A LYS 235.A N GLN 232.A O no hydrogen 2.963 N/A LYS 235.A NZ VAL 231.A O no hydrogen 2.971 N/A ILE 236.A N VAL 233.A O no hydrogen 2.687 N/A LEU 237.A N VAL 233.A O no hydrogen 3.229 N/A SER 238.A N PRO 234.A O no hydrogen 2.969 N/A SER 238.A OG PRO 234.A O no hydrogen 3.022 N/A SER 238.A OG LYS 235.A O no hydrogen 3.016 N/A GLY 239.A N ILE 236.A O no hydrogen 3.198 N/A VAL 241.A N LYS 235.A O no hydrogen 2.914 N/A LYS 242.A N ILE 146.A O no hydrogen 3.320 N/A ILE 244.A N SER 144.A O no hydrogen 2.567 N/A PHE 246.A N ASP 194.A OD1 no hydrogen 3.177 N/A PHE 246.A N ASP 194.A OD2 no hydrogen 3.024 N/A HIS 247.A N ASP 194.A OD2 no hydrogen 3.096 N/A HIS 247.A NE2 THR 190.A OG1 no hydrogen 2.831 N/A