Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3pix_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 5.A N TYR 2.A O no hydrogen 3.076 N/A GLU 6.A N GLY 3.A O no hydrogen 3.098 N/A ILE 7.A N VAL 73.A O no hydrogen 2.789 N/A LYS 10.A N ASP 8.A OD2 no hydrogen 3.090 N/A ASP 11.A N ASP 8.A O no hydrogen 2.866 N/A LEU 12.A N PRO 9.A O no hydrogen 3.164 N/A THR 13.A N LYS 30.A O no hydrogen 2.945 N/A THR 13.A OG1 LYS 30.A O no hydrogen 3.206 N/A LEU 15.A N TYR 28.A O no hydrogen 2.808 N/A LYS 16.A N TYR 28.A O no hydrogen 3.157 N/A LEU 18.A N VAL 26.A O no hydrogen 2.858 N/A GLY 19.A N VAL 26.A O no hydrogen 3.181 N/A THR 20.A OG1 GLU 17.A OE2 no hydrogen 2.726 N/A GLY 21.A N GLY 24.A O no hydrogen 3.129 N/A PHE 23.A N ASP 158.A OD1 no hydrogen 2.775 N/A GLY 24.A N GLY 21.A O no hydrogen 3.024 N/A VAL 26.A N GLY 19.A O no hydrogen 2.756 N/A LYS 27.A N ILE 39.A O no hydrogen 2.796 N/A TYR 28.A N LYS 16.A O no hydrogen 2.624 N/A TYR 28.A OH ASP 36.A OD1 no hydrogen 2.620 N/A GLY 29.A N VAL 37.A O no hydrogen 2.893 N/A LYS 30.A N THR 13.A O no hydrogen 2.987 N/A LYS 30.A NZ ASP 36.A OD1 no hydrogen 2.733 N/A TRP 31.A N TYR 35.A O no hydrogen 2.755 N/A ARG 32.A N ASP 11.A O no hydrogen 2.791 N/A GLN 34.A N TRP 31.A O no hydrogen 3.299 N/A GLN 34.A NE2 ARG 32.A O no hydrogen 3.559 N/A TYR 35.A N TRP 31.A O no hydrogen 3.049 N/A VAL 37.A N GLY 29.A O no hydrogen 2.829 N/A ALA 38.A N THR 84.A O no hydrogen 2.947 N/A ILE 39.A N LYS 27.A O no hydrogen 2.706 N/A LYS 40.A N ILE 82.A O no hydrogen 2.847 N/A LYS 40.A NZ GLY 24.A O no hydrogen 2.921 N/A LYS 40.A NZ TYR 155.A O no hydrogen 3.274 N/A LYS 40.A NZ VAL 156.A O no hydrogen 3.332 N/A LYS 40.A NZ ASP 158.A OD1 no hydrogen 2.968 N/A MET 41.A N VAL 25.A O no hydrogen 2.857 N/A ILE 42.A N ILE 80.A O no hydrogen 3.019 N/A LYS 43.A N PHE 23.A O no hydrogen 2.715 N/A SER 46.A N LYS 43.A O no hydrogen 3.200 N/A SER 46.A OG LYS 43.A O no hydrogen 2.676 N/A SER 48.A N GLU 51.A OE2 no hydrogen 3.150 N/A GLU 51.A N SER 48.A OG no hydrogen 3.186 N/A PHE 52.A N SER 48.A O no hydrogen 3.101 N/A ILE 53.A N GLU 49.A O no hydrogen 2.941 N/A GLU 54.A N ASP 50.A O no hydrogen 2.852 N/A GLU 55.A N GLU 51.A O no hydrogen 2.852 N/A ALA 56.A N PHE 52.A O no hydrogen 2.812 N/A LYS 57.A N ILE 53.A O no hydrogen 3.166 N/A LYS 57.A NZ ASN 61.A OD1 no hydrogen 3.285 N/A VAL 58.A N GLU 54.A O no hydrogen 3.178 N/A MET 59.A N GLU 55.A O no hydrogen 3.339 N/A MET 60.A N ALA 56.A O no hydrogen 2.912 N/A ASN 61.A N LYS 57.A O no hydrogen 3.067 N/A SER 63.A N TYR 121.A OH no hydrogen 2.952 N/A SER 63.A OG GLN 69.A OE1 no hydrogen 2.868 N/A LYS 66.A N HIS 64.A ND1 no hydrogen 3.116 N/A LYS 66.A NZ ASP 114.A OD2 no hydrogen 3.026 N/A LYS 66.A NZ GLU 117.A OE1 no hydrogen 2.803 N/A LEU 67.A N HIS 64.A O no hydrogen 3.037 N/A VAL 68.A N VAL 147.A O no hydrogen 2.926 N/A GLN 69.A N GLU 85.A OE2 no hydrogen 2.866 N/A GLN 69.A NE2 LEU 70.A O no hydrogen 2.834 N/A TYR 71.A N ILE 83.A O no hydrogen 2.709 N/A GLY 72.A N ILE 83.A O no hydrogen 3.025 N/A VAL 73.A N TRP 5.A O no hydrogen 2.829 N/A CYS 74.A N PHE 81.A O no hydrogen 2.969 N/A CYS 74.A SG ILE 7.A O no hydrogen 3.306 N/A THR 75.A N GLU 6.A OE1 no hydrogen 2.818 N/A THR 75.A OG1 GLU 6.A OE1 no hydrogen 3.298 N/A THR 75.A OG1 GLU 6.A OE2 no hydrogen 2.735 N/A GLN 77.A NE2 PRO 79.A O no hydrogen 2.766 N/A ARG 78.A NH1 THR 75.A O no hydrogen 3.425 N/A ARG 78.A NH1 GLN 77.A O no hydrogen 2.780 N/A PHE 81.A N CYS 74.A O no hydrogen 3.007 N/A ILE 82.A N LYS 40.A O no hydrogen 2.943 N/A ILE 83.A N GLY 72.A O no hydrogen 2.742 N/A THR 84.A N ALA 38.A O no hydrogen 2.972 N/A THR 84.A OG1 GLU 85.A O no hydrogen 3.201 N/A GLU 85.A N GLN 69.A O no hydrogen 2.806 N/A ASN 89.A N VAL 139.A O no hydrogen 2.821 N/A ASN 89.A ND2 ASN 140.A O no hydrogen 2.931 N/A GLY 90.A N MET 87.A O no hydrogen 3.123 N/A CYS 91.A SG ARG 135.A O no hydrogen 3.644 N/A LEU 92.A N CYS 137.A O no hydrogen 2.847 N/A LEU 93.A N ALA 134.A O no hydrogen 3.305 N/A TYR 95.A N CYS 91.A O no hydrogen 3.047 N/A LEU 96.A N LEU 92.A O no hydrogen 2.880 N/A ARG 97.A N LEU 93.A O no hydrogen 3.221 N/A ARG 97.A NE GLY 204.A O no hydrogen 2.653 N/A ARG 97.A NH2 GLY 204.A O no hydrogen 2.905 N/A GLU 98.A N TYR 95.A O no hydrogen 3.248 N/A ARG 100.A N GLU 98.A OE1 no hydrogen 3.166 N/A ARG 100.A NE GLU 98.A OE1 no hydrogen 2.986 N/A ARG 100.A NH2 GLU 98.A OE2 no hydrogen 2.839 N/A HIS 101.A N GLU 98.A O no hydrogen 3.380 N/A ARG 102.A N MET 99.A O no hydrogen 3.185 N/A ARG 102.A NE ARG 100.A O no hydrogen 3.003 N/A GLN 104.A N GLN 107.A OE1 no hydrogen 2.785 N/A GLN 104.A NE2 GLN 106.A OE1 no hydrogen 3.581 N/A LEU 108.A N GLN 104.A O no hydrogen 3.223 N/A LEU 109.A N THR 105.A O no hydrogen 2.931 N/A GLU 110.A N GLN 106.A O no hydrogen 3.081 N/A MET 111.A N GLN 107.A O no hydrogen 3.048 N/A CYS 112.A N LEU 108.A O no hydrogen 3.174 N/A CYS 112.A SG LEU 108.A O no hydrogen 3.486 N/A LYS 113.A N LEU 109.A O no hydrogen 2.878 N/A LYS 113.A NZ GLU 117.A OE1 no hydrogen 2.809 N/A ASP 114.A N GLU 110.A O no hydrogen 2.900 N/A VAL 115.A N MET 111.A O no hydrogen 3.159 N/A CYS 116.A N CYS 112.A O no hydrogen 2.871 N/A CYS 116.A SG PHE 254.A O no hydrogen 3.516 N/A GLU 117.A N LYS 113.A O no hydrogen 2.918 N/A ALA 118.A N ASP 114.A O no hydrogen 3.227 N/A MET 119.A N VAL 115.A O no hydrogen 2.885 N/A GLU 120.A N CYS 116.A O no hydrogen 2.852 N/A TYR 121.A N GLU 117.A O no hydrogen 3.151 N/A LEU 122.A N ALA 118.A O no hydrogen 3.023 N/A GLU 123.A N MET 119.A O no hydrogen 2.765 N/A SER 124.A N GLU 120.A O no hydrogen 2.901 N/A SER 124.A OG TYR 121.A O no hydrogen 2.478 N/A LYS 125.A N TYR 121.A O no hydrogen 3.108 N/A LYS 125.A N LEU 122.A O no hydrogen 3.121 N/A GLN 126.A N GLU 123.A O no hydrogen 3.048 N/A PHE 127.A N LEU 122.A O no hydrogen 2.878 N/A HIS 129.A N ASP 189.A OD2 no hydrogen 2.854 N/A ARG 130.A N ASP 189.A OD1 no hydrogen 3.085 N/A ALA 134.A N GLU 199.A OE2 no hydrogen 3.013 N/A ASN 136.A N ALA 133.A O no hydrogen 2.829 N/A ASN 136.A ND2 ASP 131.A O no hydrogen 2.803 N/A CYS 137.A N ALA 134.A O no hydrogen 3.241 N/A CYS 137.A SG ALA 133.A O no hydrogen 3.736 N/A LEU 138.A N LYS 146.A O no hydrogen 2.878 N/A VAL 139.A N GLY 90.A O no hydrogen 2.703 N/A ASN 140.A N VAL 144.A O no hydrogen 3.033 N/A GLN 142.A N ASN 140.A OD1 no hydrogen 2.927 N/A GLN 142.A NE2 ASP 141.A OD2 no hydrogen 3.346 N/A GLY 143.A N ASN 140.A O no hydrogen 3.114 N/A VAL 144.A N ASN 140.A OD1 no hydrogen 2.924 N/A VAL 145.A N ASP 114.A OD1 no hydrogen 2.941 N/A LYS 146.A N LEU 138.A O no hydrogen 2.891 N/A LYS 146.A NZ GLU 65.A O no hydrogen 2.826 N/A LYS 146.A NZ GLU 85.A OE1 no hydrogen 2.802 N/A VAL 147.A N LYS 66.A O no hydrogen 2.962 N/A SER 148.A N ASN 136.A O no hydrogen 3.062 N/A PHE 150.A N SER 153.A OG no hydrogen 2.755 N/A LEU 152.A N GLU 55.A O no hydrogen 3.216 N/A SER 153.A N PHE 150.A O no hydrogen 3.166 N/A SER 153.A OG PHE 150.A O no hydrogen 2.484 N/A ARG 154.A N GLY 151.A O no hydrogen 3.165 N/A TYR 155.A N LEU 152.A O no hydrogen 2.873 N/A VAL 156.A N LEU 152.A O no hydrogen 3.248 N/A LEU 157.A N SER 153.A O no hydrogen 3.009 N/A ASP 158.A N TYR 155.A O no hydrogen 3.237 N/A ASP 159.A N ARG 154.A O no hydrogen 2.938 N/A THR 162.A N ASP 159.A OD2 no hydrogen 2.914 N/A THR 162.A OG1 ASP 159.A OD2 no hydrogen 2.549 N/A SER 163.A N ASP 159.A O no hydrogen 2.768 N/A SER 163.A OG ASP 159.A O no hydrogen 3.151 N/A SER 164.A N GLU 160.A O no hydrogen 3.015 N/A SER 164.A OG GLU 160.A O no hydrogen 2.530 N/A SER 164.A OG TYR 161.A O no hydrogen 3.468 N/A VAL 165.A N THR 162.A O no hydrogen 3.146 N/A GLY 166.A N TYR 161.A O no hydrogen 2.843 N/A SER 167.A N SER 164.A O no hydrogen 2.827 N/A LYS 168.A N SER 164.A OG no hydrogen 2.930 N/A LYS 168.A NZ GLU 160.A OE1 no hydrogen 2.801 N/A LYS 168.A NZ GLU 160.A OE2 no hydrogen 3.432 N/A VAL 171.A N PHE 169.A O no hydrogen 2.769 N/A ARG 172.A NH1 PHE 211.A O no hydrogen 2.738 N/A ARG 172.A NH2 PRO 207.A O no hydrogen 2.918 N/A ARG 172.A NH2 TYR 208.A O no hydrogen 2.891 N/A ARG 172.A NH2 PHE 211.A O no hydrogen 3.065 N/A TRP 173.A N PRO 170.A O no hydrogen 3.029 N/A TRP 173.A NE1 GLU 199.A OE2 no hydrogen 2.834 N/A SER 174.A N VAL 171.A O no hydrogen 3.088 N/A SER 174.A OG PRO 170.A O no hydrogen 2.727 N/A GLU 177.A N GLU 177.A OE1 no hydrogen 2.786 N/A VAL 178.A N PRO 175.A O no hydrogen 3.064 N/A LEU 179.A N PRO 175.A O no hydrogen 3.167 N/A MET 180.A N PRO 176.A O no hydrogen 2.839 N/A TYR 181.A N GLU 177.A O no hydrogen 3.150 N/A SER 182.A N VAL 178.A O no hydrogen 2.857 N/A LYS 183.A N GLU 177.A O no hydrogen 3.049 N/A SER 185.A N SER 188.A OG no hydrogen 2.963 N/A LYS 187.A N SER 185.A OG no hydrogen 3.106 N/A LYS 187.A NZ ARG 251.A O no hydrogen 2.889 N/A LYS 187.A NZ PRO 252.A O no hydrogen 3.214 N/A SER 188.A N SER 185.A O no hydrogen 2.911 N/A SER 188.A OG SER 185.A O no hydrogen 2.619 N/A ASP 189.A N SER 185.A O no hydrogen 3.424 N/A ILE 190.A N SER 186.A O no hydrogen 2.946 N/A TRP 191.A N LYS 187.A O no hydrogen 3.160 N/A ALA 192.A N SER 188.A O no hydrogen 3.238 N/A PHE 193.A N ASP 189.A O no hydrogen 2.959 N/A GLY 194.A N ILE 190.A O no hydrogen 3.201 N/A VAL 195.A N TRP 191.A O no hydrogen 3.180 N/A LEU 196.A N ALA 192.A O no hydrogen 2.848 N/A MET 197.A N PHE 193.A O no hydrogen 2.864 N/A TRP 198.A N GLY 194.A O no hydrogen 3.057 N/A TRP 198.A NE1 TYR 227.A O no hydrogen 2.801 N/A GLU 199.A N VAL 195.A O no hydrogen 2.862 N/A ILE 200.A N LEU 196.A O no hydrogen 2.894 N/A TYR 201.A N MET 197.A O no hydrogen 2.912 N/A SER 202.A N TRP 198.A O no hydrogen 2.902 N/A SER 202.A N GLU 199.A O no hydrogen 3.283 N/A SER 202.A OG TRP 198.A O no hydrogen 2.792 N/A LEU 203.A N ILE 200.A O no hydrogen 3.002 N/A GLY 204.A N GLU 199.A O no hydrogen 2.773 N/A LYS 205.A N SER 202.A O no hydrogen 3.368 N/A PHE 211.A N TYR 208.A O no hydrogen 2.884 N/A THR 212.A N GLU 215.A OE2 no hydrogen 3.050 N/A THR 212.A OG1 GLU 215.A OE2 no hydrogen 3.449 N/A GLU 215.A N THR 212.A OG1 no hydrogen 3.045 N/A THR 216.A N THR 212.A O no hydrogen 2.920 N/A THR 216.A OG1 THR 212.A O no hydrogen 2.769 N/A ALA 217.A N ASN 213.A O no hydrogen 3.029 N/A GLU 218.A N SER 214.A O no hydrogen 3.233 N/A HIS 219.A N GLU 215.A O no hydrogen 2.852 N/A HIS 219.A NE2 ARG 225.A O no hydrogen 3.322 N/A ILE 220.A N THR 216.A O no hydrogen 3.021 N/A ALA 221.A N ALA 217.A O no hydrogen 3.065 N/A GLN 222.A N GLU 218.A O no hydrogen 3.081 N/A GLN 222.A N HIS 219.A O no hydrogen 3.079 N/A GLN 222.A NE2 GLU 218.A O no hydrogen 3.273 N/A GLY 223.A N ILE 220.A O no hydrogen 2.858 N/A LEU 224.A N HIS 219.A O no hydrogen 3.193 N/A ARG 225.A NE TRP 244.A O no hydrogen 2.784 N/A ARG 225.A NH1 ILE 220.A O no hydrogen 3.220 N/A ARG 225.A NH1 LEU 224.A O no hydrogen 3.040 N/A ARG 225.A NH2 TRP 244.A O no hydrogen 2.827 N/A TYR 227.A OH GLU 209.A OE1 no hydrogen 2.525 N/A ARG 228.A NH1 ALA 232.A O no hydrogen 2.713 N/A ALA 232.A N PRO 229.A O no hydrogen 2.977 N/A LYS 235.A NZ GLU 267.A OE1 no hydrogen 3.255 N/A LYS 235.A NZ GLU 267.A OE2 no hydrogen 2.756 N/A VAL 236.A N SER 233.A OG no hydrogen 3.169 N/A TYR 237.A N SER 233.A O no hydrogen 2.920 N/A TYR 237.A OH LEU 226.A O no hydrogen 2.554 N/A THR 238.A N GLU 234.A O no hydrogen 2.961 N/A THR 238.A OG1 GLU 234.A O no hydrogen 2.938 N/A ILE 239.A N LYS 235.A O no hydrogen 3.372 N/A MET 240.A N VAL 236.A O no hydrogen 3.116 N/A TYR 241.A N TYR 237.A O no hydrogen 2.747 N/A SER 242.A N THR 238.A O no hydrogen 2.967 N/A SER 242.A N ILE 239.A O no hydrogen 3.104 N/A SER 242.A OG ILE 239.A O no hydrogen 2.599 N/A CYS 243.A N MET 240.A O no hydrogen 3.039 N/A CYS 243.A SG ILE 239.A O no hydrogen 3.768 N/A TRP 244.A N TYR 241.A O no hydrogen 2.985 N/A LYS 247.A N HIS 245.A ND1 no hydrogen 3.030 N/A GLU 250.A N LYS 247.A O no hydrogen 2.992 N/A ARG 251.A N ALA 248.A O no hydrogen 3.129 N/A ARG 251.A NE HIS 245.A O no hydrogen 2.775 N/A ARG 251.A NH1 GLU 177.A OE2 no hydrogen 2.767 N/A ARG 251.A NH1 LYS 187.A O no hydrogen 2.948 N/A ARG 251.A NH2 GLU 177.A OE1 no hydrogen 3.030 N/A ARG 251.A NH2 GLU 177.A OE2 no hydrogen 3.542 N/A ARG 251.A NH2 HIS 245.A O no hydrogen 2.990 N/A PHE 254.A N GLU 123.A OE2 no hydrogen 2.747 N/A ILE 256.A N THR 253.A OG1 no hydrogen 3.182 N/A LEU 257.A N THR 253.A O no hydrogen 2.982 N/A LEU 258.A N PHE 254.A O no hydrogen 2.915 N/A SER 259.A N LYS 255.A O no hydrogen 3.205 N/A SER 259.A OG ILE 256.A O no hydrogen 2.663 N/A ASN 260.A N ILE 256.A O no hydrogen 2.861 N/A ILE 261.A N LEU 257.A O no hydrogen 2.934 N/A LEU 262.A N LEU 258.A O no hydrogen 2.966 N/A ASP 263.A N SER 259.A O no hydrogen 3.051 N/A VAL 264.A N ASN 260.A O no hydrogen 3.151 N/A MET 265.A N ILE 261.A O no hydrogen 2.871 N/A ASP 266.A N LEU 262.A O no hydrogen 2.906 N/A GLU 267.A N ASP 263.A O no hydrogen 3.144 N/A GLU 268.A N VAL 264.A O no hydrogen 2.657 N/A