Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2nxe_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 2.A N PHE 39.A O no hydrogen 2.726 N/A VAL 3.A N GLU 52.A O no hydrogen 2.689 N/A TYR 4.A N ALA 37.A O no hydrogen 2.806 N/A ARG 5.A N VAL 50.A O no hydrogen 2.827 N/A LEU 6.A N VAL 35.A O no hydrogen 2.976 N/A GLY 8.A N GLY 33.A O no hydrogen 2.960 N/A LEU 10.A N GLU 30.A OE1 no hydrogen 2.807 N/A ALA 12.A N THR 9.A OG1 no hydrogen 3.264 N/A LEU 13.A N THR 9.A O no hydrogen 2.973 N/A ASP 14.A N GLU 11.A O no hydrogen 3.476 N/A ILE 16.A N LEU 13.A O no hydrogen 3.070 N/A LEU 17.A N ASP 14.A O no hydrogen 3.404 N/A GLY 19.A N ILE 16.A O no hydrogen 3.023 N/A LEU 20.A N ILE 16.A O no hydrogen 3.232 N/A PHE 21.A N LEU 17.A O no hydrogen 3.126 N/A ASP 22.A N PRO 18.A O no hydrogen 2.868 N/A GLY 23.A N GLY 19.A O no hydrogen 2.786 N/A GLY 24.A N PHE 21.A O no hydrogen 3.007 N/A ALA 25.A N LEU 20.A O no hydrogen 2.972 N/A ARG 26.A N PHE 38.A O no hydrogen 2.754 N/A ARG 26.A NH1 GLY 24.A O no hydrogen 2.790 N/A TRP 29.A N TRP 36.A O no hydrogen 2.852 N/A ARG 31.A N GLU 34.A O no hydrogen 2.738 N/A GLU 34.A N ARG 31.A O no hydrogen 3.435 N/A VAL 35.A N LEU 6.A O no hydrogen 2.818 N/A TRP 36.A N TRP 29.A O no hydrogen 2.792 N/A TRP 36.A NE1 GLU 34.A OE1 no hydrogen 2.726 N/A ALA 37.A N TYR 4.A O no hydrogen 3.030 N/A PHE 38.A N GLY 27.A O no hydrogen 2.959 N/A PHE 39.A N TRP 2.A O no hydrogen 2.876 N/A GLY 49.A N TYR 4.A OH no hydrogen 2.726 N/A VAL 50.A N ARG 5.A O no hydrogen 2.979 N/A GLU 52.A N VAL 3.A O no hydrogen 2.799 N/A VAL 54.A N MET 1.A O no hydrogen 2.969 N/A LEU 60.A N ASP 58.A OD1 no hydrogen 2.960 N/A ALA 62.A N ASP 58.A O no hydrogen 3.092 N/A TRP 63.A N TRP 59.A O no hydrogen 3.029 N/A ARG 64.A N LEU 60.A O no hydrogen 2.885 N/A ARG 65.A N GLU 61.A O no hydrogen 2.898 N/A ASP 66.A N ALA 62.A O no hydrogen 3.081 N/A ASP 66.A N TRP 63.A O no hydrogen 3.183 N/A LEU 67.A N ARG 64.A O no hydrogen 3.246 N/A ALA 70.A N VAL 77.A O no hydrogen 2.943 N/A ALA 72.A N PHE 75.A O no hydrogen 2.828 N/A PHE 75.A N ALA 72.A O no hydrogen 2.792 N/A VAL 76.A N ILE 89.A O no hydrogen 2.995 N/A VAL 77.A N ALA 70.A O no hydrogen 2.761 N/A LEU 78.A N LEU 91.A O no hydrogen 2.821 N/A ALA 79.A N HIS 82.A ND1 no hydrogen 2.873 N/A HIS 82.A N ALA 79.A O no hydrogen 3.032 N/A HIS 82.A NE2 LEU 67.A O no hydrogen 2.911 N/A TRP 84.A NE1 GLU 88.A OE1 no hydrogen 2.825 N/A ILE 89.A N PRO 74.A O no hydrogen 2.887 N/A LEU 91.A N VAL 76.A O no hydrogen 2.935 N/A VAL 92.A N ASN 165.A OD1 no hydrogen 2.814 N/A ILE 93.A N LEU 78.A O no hydrogen 2.807 N/A GLU 94.A N ASN 161.A OD1 no hydrogen 3.208 N/A ALA 98.A N GLN 157.A OE1 no hydrogen 3.113 N/A GLY 100.A N GLU 32.A OE2 no hydrogen 2.802 N/A THR 101.A N GLU 32.A OE2 no hydrogen 2.805 N/A THR 101.A OG1 GLU 32.A OE1 no hydrogen 2.610 N/A THR 101.A OG1 GLU 32.A OE2 no hydrogen 3.295 N/A THR 101.A OG1 HIS 103.A ND1 no hydrogen 3.194 N/A HIS 103.A N THR 101.A OG1 no hydrogen 3.007 N/A HIS 103.A ND1 THR 101.A OG1 no hydrogen 3.194 N/A HIS 103.A NE2 LYS 68.A O no hydrogen 3.036 N/A HIS 104.A ND1 THR 106.A OG1 no hydrogen 2.809 N/A GLU 105.A N GLU 105.A OE1 no hydrogen 2.759 N/A THR 106.A N HIS 104.A ND1 no hydrogen 3.171 N/A THR 106.A OG1 HIS 104.A ND1 no hydrogen 2.809 N/A ARG 108.A N HIS 104.A O no hydrogen 3.205 N/A ARG 108.A NH1 GLY 102.A O no hydrogen 3.310 N/A ARG 108.A NH2 GLU 244.A OE2 no hydrogen 2.988 N/A LEU 109.A N GLU 105.A O no hydrogen 2.873 N/A ALA 110.A N THR 106.A O no hydrogen 2.931 N/A LEU 111.A N THR 107.A O no hydrogen 2.897 N/A LYS 112.A N ARG 108.A O no hydrogen 2.989 N/A ALA 113.A N LEU 109.A O no hydrogen 3.012 N/A LEU 114.A N ALA 110.A O no hydrogen 2.966 N/A ALA 115.A N LEU 111.A O no hydrogen 3.440 N/A ARG 116.A N LYS 112.A O no hydrogen 3.319 N/A ARG 116.A NE GLU 240.A OE2 no hydrogen 3.200 N/A ARG 116.A NH2 GLU 240.A OE2 no hydrogen 2.801 N/A HIS 117.A N ALA 113.A O no hydrogen 3.122 N/A HIS 117.A N LEU 114.A O no hydrogen 3.202 N/A HIS 117.A NE2 GLU 240.A OE1 no hydrogen 2.902 N/A HIS 117.A NE2 GLU 240.A OE2 no hydrogen 2.803 N/A LEU 118.A N LEU 114.A O no hydrogen 2.812 N/A ARG 119.A N ASP 122.A OD2 no hydrogen 2.955 N/A GLY 121.A N GLY 142.A O no hydrogen 2.708 N/A ASP 122.A N ARG 119.A O no hydrogen 2.955 N/A LYS 123.A N ASP 186.A OD1 no hydrogen 2.863 N/A LYS 123.A NZ PHE 182.A O no hydrogen 2.702 N/A VAL 124.A N LYS 144.A O no hydrogen 2.874 N/A LEU 125.A N LEU 187.A O no hydrogen 2.801 N/A ASP 126.A N LEU 146.A O no hydrogen 2.891 N/A LEU 127.A N VAL 189.A O no hydrogen 2.977 N/A GLY 128.A N VAL 148.A O no hydrogen 2.886 N/A THR 129.A N VAL 148.A O no hydrogen 2.881 N/A THR 129.A OG1 ASP 126.A OD2 no hydrogen 2.547 N/A GLY 130.A N ASP 149.A OD1 no hydrogen 2.876 N/A SER 131.A N PHE 99.A O no hydrogen 2.987 N/A SER 131.A OG GLY 100.A O no hydrogen 2.716 N/A GLY 132.A N THR 129.A O no hydrogen 2.907 N/A VAL 133.A N SER 131.A OG no hydrogen 3.211 N/A ILE 136.A N GLY 132.A O no hydrogen 2.951 N/A ALA 137.A N VAL 133.A O no hydrogen 2.886 N/A ALA 138.A N LEU 134.A O no hydrogen 2.817 N/A GLU 139.A N ALA 135.A O no hydrogen 3.037 N/A LYS 140.A N ILE 136.A O no hydrogen 3.038 N/A LYS 140.A NZ ASN 165.A O no hydrogen 2.934 N/A LEU 141.A N ALA 137.A O no hydrogen 3.126 N/A LEU 141.A N ALA 138.A O no hydrogen 3.160 N/A GLY 142.A N GLU 139.A O no hydrogen 3.090 N/A GLY 143.A N ALA 138.A O no hydrogen 2.827 N/A LYS 144.A N ASP 122.A O no hydrogen 2.776 N/A ALA 145.A N GLU 139.A OE1 no hydrogen 2.803 N/A LEU 146.A N VAL 124.A O no hydrogen 2.912 N/A GLY 147.A N ARG 170.A O no hydrogen 2.828 N/A VAL 148.A N ASP 126.A O no hydrogen 3.086 N/A ASP 149.A N LEU 172.A O no hydrogen 3.200 N/A ASP 151.A N ASP 149.A OD2 no hydrogen 2.869 N/A MET 153.A N ASP 151.A OD1 no hydrogen 3.073 N/A VAL 154.A N ASP 151.A O no hydrogen 3.102 N/A LEU 155.A N PRO 152.A O no hydrogen 3.188 N/A GLN 157.A NE2 MET 153.A O no hydrogen 3.206 N/A ALA 158.A N VAL 154.A O no hydrogen 2.929 N/A GLU 159.A N LEU 155.A O no hydrogen 2.848 N/A ALA 160.A N PRO 156.A O no hydrogen 2.969 N/A ASN 161.A N GLN 157.A O no hydrogen 2.887 N/A ASN 161.A ND2 SER 131.A O no hydrogen 2.828 N/A ALA 162.A N ALA 158.A O no hydrogen 2.841 N/A LYS 163.A N GLU 159.A O no hydrogen 2.964 N/A ARG 164.A N ALA 160.A O no hydrogen 3.093 N/A ARG 164.A NE ASN 161.A OD1 no hydrogen 3.120 N/A ARG 164.A NH2 ASN 161.A OD1 no hydrogen 3.171 N/A ASN 165.A N ASN 161.A O no hydrogen 3.266 N/A ASN 165.A N ALA 162.A O no hydrogen 3.013 N/A ASN 165.A ND2 VAL 92.A O no hydrogen 2.803 N/A ASN 165.A ND2 ASN 161.A O no hydrogen 2.788 N/A GLY 166.A N LYS 163.A O no hydrogen 3.189 N/A VAL 167.A N ALA 162.A O no hydrogen 3.359 N/A ARG 170.A N ALA 145.A O no hydrogen 3.069 N/A LEU 172.A N GLY 147.A O no hydrogen 2.988 N/A GLY 174.A N ASP 149.A O no hydrogen 2.962 N/A ALA 179.A N SER 175.A O no hydrogen 3.184 N/A LEU 180.A N LEU 176.A O no hydrogen 3.058 N/A PHE 182.A N ALA 179.A O no hydrogen 2.807 N/A GLY 183.A N LEU 180.A O no hydrogen 3.050 N/A PHE 185.A N ALA 207.A O no hydrogen 2.681 N/A ASP 186.A N LYS 123.A O no hydrogen 2.827 N/A LEU 187.A N LYS 123.A O no hydrogen 3.068 N/A LEU 188.A N ARG 213.A O no hydrogen 2.914 N/A VAL 189.A N LEU 125.A O no hydrogen 2.777 N/A ALA 190.A N LEU 215.A O no hydrogen 2.929 N/A ASN 191.A ND2 THR 106.A OG1 no hydrogen 2.836 N/A LEU 192.A N THR 217.A O no hydrogen 3.022 N/A GLU 195.A N GLU 195.A OE1 no hydrogen 2.744 N/A LEU 196.A N TYR 193.A O no hydrogen 3.217 N/A HIS 197.A N TYR 193.A O no hydrogen 3.205 N/A HIS 197.A ND1 TYR 204.A OH no hydrogen 2.916 N/A HIS 197.A NE2 THR 217.A O no hydrogen 2.779 N/A ALA 198.A N ALA 194.A O no hydrogen 3.062 N/A ALA 199.A N GLU 195.A O no hydrogen 3.167 N/A LEU 200.A N LEU 196.A O no hydrogen 3.023 N/A LEU 200.A N HIS 197.A O no hydrogen 3.186 N/A TYR 204.A N LEU 200.A O no hydrogen 2.923 N/A TYR 204.A OH HIS 197.A ND1 no hydrogen 2.916 N/A ARG 205.A N ALA 201.A O no hydrogen 3.329 N/A ARG 205.A NH1 ALA 234.A O no hydrogen 3.352 N/A GLU 206.A N PRO 202.A O no hydrogen 3.453 N/A ALA 207.A N ARG 203.A O no hydrogen 2.898 N/A ALA 207.A N TYR 204.A O no hydrogen 2.988 N/A LEU 208.A N ARG 205.A O no hydrogen 3.293 N/A VAL 209.A N PHE 185.A O no hydrogen 2.862 N/A GLY 211.A N ARG 254.A O no hydrogen 3.040 N/A GLY 212.A N VAL 209.A O no hydrogen 2.888 N/A ARG 213.A N ASP 186.A O no hydrogen 2.961 N/A ARG 213.A NE GLY 211.A O no hydrogen 3.334 N/A ARG 213.A NH1 HIS 117.A O no hydrogen 2.737 N/A ARG 213.A NH1 ASP 122.A OD2 no hydrogen 2.862 N/A ARG 213.A NH2 GLY 211.A O no hydrogen 3.504 N/A ALA 214.A N TYR 252.A O no hydrogen 2.812 N/A LEU 215.A N LEU 188.A O no hydrogen 2.760 N/A LEU 216.A N LEU 250.A O no hydrogen 2.918 N/A THR 217.A N ALA 190.A O no hydrogen 2.933 N/A THR 217.A OG1 VAL 248.A O no hydrogen 2.773 N/A GLY 218.A N THR 217.A OG1 no hydrogen 2.717 N/A LYS 221.A N GLU 246.A O no hydrogen 2.895 N/A ARG 223.A N LEU 220.A O no hydrogen 2.852 N/A ALA 224.A N LYS 221.A O no hydrogen 3.280 N/A VAL 227.A N ALA 224.A O no hydrogen 2.692 N/A ARG 228.A N ALA 224.A O no hydrogen 3.051 N/A ARG 228.A NE GLU 241.A OE2 no hydrogen 2.734 N/A ARG 228.A NH2 GLU 241.A OE1 no hydrogen 2.856 N/A GLU 229.A N PRO 225.A O no hydrogen 2.934 N/A ALA 230.A N LEU 226.A O no hydrogen 3.375 N/A MET 231.A N VAL 227.A O no hydrogen 2.987 N/A ALA 232.A N ARG 228.A O no hydrogen 3.002 N/A GLY 233.A N GLU 229.A O no hydrogen 2.868 N/A ALA 234.A N ALA 230.A O no hydrogen 3.096 N/A ALA 234.A N MET 231.A O no hydrogen 3.120 N/A GLY 235.A N ALA 232.A O no hydrogen 3.022 N/A PHE 236.A N MET 231.A O no hydrogen 3.001 N/A ARG 237.A N GLY 253.A O no hydrogen 2.811 N/A LEU 239.A N ALA 251.A O no hydrogen 2.902 N/A ALA 242.A N LEU 249.A O no hydrogen 2.946 N/A GLU 244.A N TRP 247.A O no hydrogen 2.929 N/A TRP 247.A N GLU 244.A O no hydrogen 3.088 N/A VAL 248.A N ILE 219.A O no hydrogen 2.834 N/A LEU 249.A N ALA 242.A O no hydrogen 2.780 N/A LEU 250.A N LEU 216.A O no hydrogen 2.708 N/A ALA 251.A N GLU 240.A O no hydrogen 3.029 N/A TYR 252.A N ALA 214.A O no hydrogen 2.731 N/A GLY 253.A N ARG 237.A O no hydrogen 2.795 N/A ARG 254.A N GLY 212.A O no hydrogen 2.974 N/A ARG 254.A NE ARG 205.A O no hydrogen 2.589 N/A ARG 254.A NE LEU 208.A O no hydrogen 3.096 N/A ARG 254.A NH2 LEU 208.A O no hydrogen 2.942 N/A