Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5e1e_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 4.A N ASP 2.A OD1 no hydrogen 3.027 N/A THR 4.A OG1 ASP 2.A OD1 no hydrogen 2.883 N/A HIS 5.A N ASP 2.A O no hydrogen 3.073 N/A PHE 6.A N ILE 74.A O no hydrogen 3.010 N/A GLU 7.A N TYR 30.A OH no hydrogen 3.081 N/A ARG 9.A NE GLU 7.A OE2 no hydrogen 3.127 N/A PHE 10.A N GLU 7.A O no hydrogen 3.155 N/A LEU 11.A N LYS 8.A O no hydrogen 3.183 N/A LYS 12.A N ARG 29.A O no hydrogen 2.967 N/A LYS 12.A NZ ARG 9.A O no hydrogen 3.512 N/A ARG 13.A NE GLU 26.A OE2 no hydrogen 3.013 N/A ARG 13.A NH2 ASP 16.A OD1 no hydrogen 2.890 N/A ILE 14.A N LEU 27.A O no hydrogen 2.715 N/A ARG 15.A N.A LEU 27.A O no hydrogen 3.336 N/A ARG 15.A N.B LEU 27.A O no hydrogen 3.343 N/A LEU 17.A N VAL 25.A O no hydrogen 2.819 N/A GLY 18.A N VAL 25.A O no hydrogen 3.269 N/A GLY 20.A N GLY 23.A O no hydrogen 3.018 N/A LYS 24.A N SER 45.A O no hydrogen 2.908 N/A LYS 24.A NZ SER 45.A OG no hydrogen 3.253 N/A VAL 25.A N GLY 18.A O no hydrogen 2.782 N/A GLU 26.A N VAL 43.A O no hydrogen 2.774 N/A LEU 27.A N ARG 15.A O.A no hydrogen 2.769 N/A LEU 27.A N ARG 15.A O.B no hydrogen 2.746 N/A CYS 28.A N VAL 41.A O no hydrogen 2.929 N/A ARG 29.A N LYS 12.A O no hydrogen 2.791 N/A ARG 29.A NH1 GLY 38.A O no hydrogen 2.760 N/A TYR 30.A N GLU 39.A O no hydrogen 2.819 N/A ASP 31.A N PHE 10.A O no hydrogen 2.834 N/A GLY 34.A N ASP 31.A O no hydrogen 3.101 N/A ASN 36.A N ASP 31.A OD2 no hydrogen 2.755 N/A THR 37.A N ASP 31.A OD1 no hydrogen 3.177 N/A THR 37.A OG1 ASP 35.A OD1 no hydrogen 2.659 N/A THR 37.A OG1 ASP 35.A OD2 no hydrogen 3.440 N/A GLY 38.A N ASP 31.A OD1 no hydrogen 2.858 N/A VAL 41.A N CYS 28.A O no hydrogen 2.843 N/A ALA 42.A N MET 83.A O no hydrogen 3.001 N/A VAL 43.A N GLU 26.A O no hydrogen 2.737 N/A LYS 44.A N LEU 81.A O no hydrogen 2.872 N/A LYS 44.A NZ GLU 56.A OE1 no hydrogen 3.416 N/A LYS 44.A NZ GLU 56.A OE2 no hydrogen 2.794 N/A LYS 44.A NZ ASP 148.A OD1 no hydrogen 3.206 N/A SER 45.A N LYS 24.A O no hydrogen 2.974 N/A LYS 47.A N PHE 22.A O no hydrogen 3.195 N/A LYS 47.A NZ GLU 19.A OE1 no hydrogen 3.354 N/A LEU 53.A N HIS 49.A O no hydrogen 3.489 N/A LYS 54.A N ILE 50.A O no hydrogen 2.990 N/A LYS 55.A N ALA 51.A O no hydrogen 3.143 N/A GLU 56.A N ASP 52.A O no hydrogen 2.991 N/A ILE 57.A N LEU 53.A O no hydrogen 2.932 N/A GLU 58.A N LYS 54.A O no hydrogen 3.096 N/A ILE 59.A N LYS 55.A O no hydrogen 2.987 N/A LEU 60.A N GLU 56.A O no hydrogen 2.997 N/A ARG 61.A N ILE 57.A O no hydrogen 2.987 N/A ARG 61.A NE GLU 58.A OE2 no hydrogen 2.816 N/A ARG 61.A NH1 GLU 58.A OE1 no hydrogen 3.210 N/A ARG 61.A NH1 GLU 58.A OE2 no hydrogen 3.566 N/A ASN 62.A N ILE 59.A O no hydrogen 3.283 N/A ASN 62.A ND2 GLU 58.A O no hydrogen 2.834 N/A ASN 62.A ND2 GLU 58.A OE1 no hydrogen 3.406 N/A LEU 63.A N LEU 60.A O no hydrogen 3.250 N/A TYR 64.A N.A TYR 120.A OH no hydrogen 2.960 N/A TYR 64.A N.B TYR 120.A OH no hydrogen 2.985 N/A ASN 67.A N HIS 65.A ND1 no hydrogen 2.783 N/A ASN 67.A ND2 VAL 144.A O no hydrogen 2.944 N/A ILE 68.A N HIS 65.A O no hydrogen 3.132 N/A VAL 69.A N ILE 146.A O no hydrogen 2.955 N/A LYS 70.A N GLU 84.A OE2 no hydrogen 3.020 N/A LYS 72.A N ILE 82.A O no hydrogen 2.833 N/A LYS 72.A NZ GLU 39.A OE1 no hydrogen 3.387 N/A GLY 73.A N ILE 82.A O no hydrogen 3.155 N/A ILE 74.A N THR 4.A O no hydrogen 2.919 N/A CYS 75.A N LYS 80.A O no hydrogen 3.075 N/A CYS 75.A SG PHE 6.A O no hydrogen 3.519 N/A LYS 80.A N CYS 75.A O no hydrogen 2.781 N/A LEU 81.A N LYS 44.A O no hydrogen 2.888 N/A ILE 82.A N GLY 73.A O no hydrogen 2.911 N/A MET 83.A N ALA 42.A O no hydrogen 2.810 N/A GLU 84.A N LYS 70.A O no hydrogen 2.984 N/A GLY 89.A N LEU 86.A O no hydrogen 3.164 N/A SER 90.A N GLU 93.A OE1 no hydrogen 2.803 N/A SER 90.A OG GLU 93.A OE1 no hydrogen 2.619 N/A SER 90.A OG ARG 134.A O.A no hydrogen 3.286 N/A SER 90.A OG ARG 134.A O.B no hydrogen 3.265 N/A LEU 91.A N VAL 136.A O no hydrogen 2.926 N/A LYS 92.A N SER 90.A OG no hydrogen 3.316 N/A GLU 93.A N SER 90.A O no hydrogen 3.099 N/A TYR 94.A N SER 90.A O no hydrogen 2.877 N/A LEU 95.A N LEU 91.A O no hydrogen 2.884 N/A LYS 97.A N TYR 94.A O no hydrogen 3.232 N/A ASN 98.A N LEU 95.A O no hydrogen 3.162 N/A ASN 98.A ND2 TYR 94.A O no hydrogen 2.728 N/A LYS 101.A N ASN 98.A O no hydrogen 3.040 N/A ILE 102.A N ASN 98.A O no hydrogen 2.936 N/A GLN 106.A N ASN 103.A OD1 no hydrogen 3.275 N/A GLN 106.A NE2 GLN 106.A O no hydrogen 3.197 N/A GLN 107.A N ASN 103.A O no hydrogen 3.075 N/A GLN 107.A NE2 LEU 199.A O no hydrogen 2.797 N/A LEU 108.A N LEU 104.A O no hydrogen 2.982 N/A LYS 109.A N LYS 105.A O no hydrogen 3.088 N/A TYR 110.A N GLN 106.A O no hydrogen 2.939 N/A TYR 110.A OH GLU 141.A O no hydrogen 2.852 N/A ALA 111.A N GLN 107.A O no hydrogen 2.931 N/A VAL 112.A N LEU 108.A O no hydrogen 3.062 N/A GLN 113.A N LYS 109.A O no hydrogen 3.133 N/A GLN 113.A NE2 HIS 142.A O no hydrogen 2.915 N/A ILE 114.A N TYR 110.A O no hydrogen 2.899 N/A CYS 115.A N ALA 111.A O no hydrogen 2.932 N/A CYS 115.A SG ALA 111.A O no hydrogen 3.438 N/A LYS 116.A N VAL 112.A O no hydrogen 2.893 N/A GLY 117.A N GLN 113.A O no hydrogen 3.114 N/A MET 118.A N ILE 114.A O no hydrogen 3.038 N/A ASP 119.A N CYS 115.A O no hydrogen 2.757 N/A TYR 120.A N LYS 116.A O no hydrogen 3.006 N/A LEU 121.A N GLY 117.A O no hydrogen 3.126 N/A GLY 122.A N MET 118.A O no hydrogen 2.936 N/A SER 123.A N ASP 119.A O no hydrogen 2.969 N/A SER 123.A OG TYR 120.A O no hydrogen 2.773 N/A ARG 124.A N LEU 121.A O no hydrogen 3.121 N/A GLN 125.A N GLY 122.A O no hydrogen 3.048 N/A TYR 126.A N LEU 121.A O no hydrogen 3.137 N/A VAL 127.A N LYS 153.A O no hydrogen 2.816 N/A HIS 128.A N ASP 188.A OD2 no hydrogen 2.785 N/A ARG 129.A N ASP 188.A OD1 no hydrogen 3.136 N/A ARG 129.A NH1 LEU 151.A O no hydrogen 2.797 N/A ASP 130.A N HIS 128.A ND1 no hydrogen 3.004 N/A ALA 133.A N GLU 198.A OE1 no hydrogen 3.046 N/A ASN 135.A N ALA 132.A O no hydrogen 3.016 N/A ASN 135.A ND2 ASP 130.A O no hydrogen 2.813 N/A VAL 136.A N ALA 133.A O no hydrogen 3.146 N/A LEU 137.A N LYS 145.A O no hydrogen 2.718 N/A VAL 138.A N GLY 89.A O no hydrogen 2.817 N/A GLU 139.A N GLN 143.A O no hydrogen 2.973 N/A SER 140.A N GLN 143.A O no hydrogen 3.241 N/A HIS 142.A N SER 140.A OG no hydrogen 3.342 N/A GLN 143.A N SER 140.A O no hydrogen 3.357 N/A VAL 144.A N GLN 113.A OE1 no hydrogen 2.864 N/A LYS 145.A N LEU 137.A O no hydrogen 2.828 N/A LYS 145.A NZ GLU 84.A OE2 no hydrogen 2.749 N/A LYS 145.A NZ GLU 139.A OE2 no hydrogen 3.346 N/A ILE 146.A N ASN 67.A O no hydrogen 2.802 N/A GLY 147.A N ASN 135.A O no hydrogen 2.928 N/A GLY 150.A N ASP 148.A OD1 no hydrogen 3.237 N/A THR 152.A N PHE 149.A O no hydrogen 3.437 N/A THR 152.A OG1 HIS 128.A O no hydrogen 3.547 N/A LYS 153.A N VAL 127.A O no hydrogen 2.939 N/A ILE 155.A N GLN 125.A O no hydrogen 2.872 N/A THR 157.A OG1 GLN 125.A OE1 no hydrogen 3.365 N/A LYS 159.A N GLU 156.A O no hydrogen 3.186 N/A VAL 162.A N SER 181.A O no hydrogen 2.813 N/A LYS 163.A NZ THR 161.A O no hydrogen 2.803 N/A SER 168.A N ASP 165.A O no hydrogen 3.135 N/A SER 168.A OG ASP 165.A O no hydrogen 2.723 N/A VAL 170.A N SER 168.A O no hydrogen 2.808 N/A TRP 172.A N PRO 169.A O no hydrogen 3.032 N/A TRP 172.A NE1 GLU 198.A OE1 no hydrogen 2.769 N/A TYR 173.A N VAL 170.A O no hydrogen 3.149 N/A TYR 173.A OH ARG 129.A O no hydrogen 2.830 N/A GLU 176.A N GLU 176.A OE1 no hydrogen 2.816 N/A CYS 177.A N ALA 174.A O no hydrogen 3.030 N/A CYS 177.A SG LYS 182.A O no hydrogen 3.328 N/A CYS 177.A SG SER 187.A OG no hydrogen 3.412 N/A LEU 178.A N ALA 174.A O no hydrogen 3.250 N/A MET 179.A N PRO 175.A O no hydrogen 2.812 N/A GLN 180.A N GLU 176.A O no hydrogen 3.054 N/A LYS 182.A N GLU 176.A O no hydrogen 3.287 N/A TYR 184.A N SER 187.A OG no hydrogen 2.975 N/A SER 187.A N TYR 184.A O no hydrogen 3.029 N/A SER 187.A OG GLU 176.A OE2 no hydrogen 2.712 N/A ASP 188.A N ILE 185.A O no hydrogen 2.987 N/A VAL 189.A N ILE 185.A O no hydrogen 3.347 N/A TRP 190.A N ALA 186.A O no hydrogen 3.105 N/A SER 191.A N SER 187.A O no hydrogen 3.201 N/A SER 191.A OG TRP 172.A O no hydrogen 2.724 N/A SER 191.A OG SER 187.A O no hydrogen 3.465 N/A PHE 192.A N ASP 188.A O no hydrogen 2.843 N/A GLY 193.A N VAL 189.A O no hydrogen 3.083 N/A VAL 194.A N TRP 190.A O no hydrogen 3.402 N/A THR 195.A N SER 191.A O no hydrogen 2.997 N/A THR 195.A OG1 SER 191.A O no hydrogen 2.841 N/A LEU 196.A N PHE 192.A O no hydrogen 2.799 N/A HIS 197.A N GLY 193.A O no hydrogen 3.136 N/A HIS 197.A NE2 PRO 240.A O no hydrogen 2.776 N/A GLU 198.A N VAL 194.A O no hydrogen 3.174 N/A LEU 199.A N THR 195.A O no hydrogen 3.013 N/A LEU 200.A N LEU 196.A O no hydrogen 2.963 N/A THR 201.A N HIS 197.A O no hydrogen 3.137 N/A THR 201.A N GLU 198.A O no hydrogen 3.125 N/A THR 201.A OG1 HIS 197.A O no hydrogen 3.339 N/A THR 201.A OG1 GLU 198.A O no hydrogen 3.036 N/A TYR 202.A N LEU 199.A O no hydrogen 3.054 N/A TYR 202.A OH ILE 102.A O no hydrogen 2.711 N/A CYS 203.A N GLU 198.A O no hydrogen 2.796 N/A ASP 204.A N THR 201.A O no hydrogen 3.293 N/A SER 207.A N ASP 204.A O no hydrogen 3.023 N/A SER 207.A OG ASP 204.A OD2 no hydrogen 2.858 N/A SER 208.A N SER 205.A O no hydrogen 3.308 N/A SER 208.A OG SER 205.A O no hydrogen 3.206 N/A ALA 211.A N SER 208.A OG no hydrogen 3.214 N/A LEU 212.A N SER 208.A O no hydrogen 2.827 N/A PHE 213.A N PRO 209.A O no hydrogen 2.830 N/A LEU 214.A N MET 210.A O no hydrogen 2.879 N/A LYS 215.A N ALA 211.A O no hydrogen 3.259 N/A LYS 215.A N LEU 212.A O no hydrogen 3.227 N/A MET 216.A N LEU 212.A O no hydrogen 3.231 N/A ILE 217.A N PHE 213.A O no hydrogen 2.940 N/A GLY 218.A N LEU 214.A O no hydrogen 2.882 N/A MET 224.A N.A HIS 221.A O no hydrogen 3.049 N/A MET 224.A N.B HIS 221.A O no hydrogen 3.054 N/A THR 225.A N GLY 222.A O no hydrogen 3.138 N/A THR 225.A OG1 GLY 222.A O no hydrogen 2.836 N/A ARG 228.A N MET 224.A O.A no hydrogen 3.097 N/A ARG 228.A N MET 224.A O.B no hydrogen 3.099 N/A LEU 229.A N THR 225.A O no hydrogen 2.845 N/A VAL 230.A N VAL 226.A O no hydrogen 2.814 N/A ASN 231.A N THR 227.A O no hydrogen 2.985 N/A THR 232.A N ARG 228.A O no hydrogen 3.060 N/A THR 232.A OG1 ARG 228.A O no hydrogen 2.701 N/A LEU 233.A N LEU 229.A O no hydrogen 3.098 N/A LYS 234.A N VAL 230.A O no hydrogen 3.052 N/A GLU 235.A N ASN 231.A O no hydrogen 3.223 N/A GLU 235.A N THR 232.A O no hydrogen 3.208 N/A GLY 236.A N LEU 233.A O no hydrogen 2.904 N/A LYS 237.A N THR 232.A O no hydrogen 3.359 N/A ARG 238.A NE TRP 257.A O no hydrogen 2.881 N/A ARG 238.A NH1 LEU 233.A O no hydrogen 2.869 N/A ARG 238.A NH1 LYS 237.A O no hydrogen 2.781 N/A ARG 238.A NH2 TRP 257.A O no hydrogen 3.097 N/A CYS 241.A SG PRO 242.A O no hydrogen 3.748 N/A CYS 241.A SG CYS 245.A O no hydrogen 3.476 N/A CYS 245.A N PRO 242.A O no hydrogen 3.213 N/A CYS 245.A SG PRO 246.A O no hydrogen 3.539 N/A GLU 248.A N GLU 248.A OE1 no hydrogen 2.815 N/A VAL 249.A N PRO 246.A O no hydrogen 2.977 N/A TYR 250.A N PRO 246.A O no hydrogen 3.154 N/A TYR 250.A OH LEU 239.A O no hydrogen 3.036 N/A GLN 251.A N ASP 247.A O no hydrogen 2.787 N/A GLN 251.A NE2 ASP 247.A OD1 no hydrogen 2.810 N/A LEU 252.A N GLU 248.A O no hydrogen 3.475 N/A MET 253.A N VAL 249.A O no hydrogen 3.253 N/A ARG 254.A N TYR 250.A O no hydrogen 3.007 N/A ARG 254.A NE TYR 250.A OH no hydrogen 3.103 N/A LYS 255.A N GLN 251.A O no hydrogen 3.229 N/A CYS 256.A N MET 253.A O no hydrogen 3.126 N/A CYS 256.A SG LEU 252.A O no hydrogen 3.725 N/A TRP 257.A N ARG 254.A O no hydrogen 3.137 N/A ASN 263.A N GLN 260.A O no hydrogen 3.060 N/A ARG 264.A N PRO 261.A O no hydrogen 3.259 N/A ARG 264.A NE GLU 258.A O no hydrogen 2.842 N/A ARG 264.A NH1 GLU 176.A OE2 no hydrogen 2.848 N/A ARG 264.A NH1 ALA 186.A O no hydrogen 2.993 N/A ARG 264.A NH2 GLU 176.A OE1 no hydrogen 2.800 N/A ARG 264.A NH2 GLU 176.A OE2 no hydrogen 3.458 N/A ARG 264.A NH2 GLU 258.A O no hydrogen 3.375 N/A ARG 264.A NH2 PHE 259.A O no hydrogen 2.964 N/A THR 265.A N LYS 255.A O no hydrogen 3.112 N/A THR 265.A OG1 SER 266.A O no hydrogen 3.296 N/A ASN 269.A N SER 266.A OG no hydrogen 3.021 N/A ASN 269.A ND2 THR 265.A OG1 no hydrogen 2.923 N/A LEU 270.A N SER 266.A O no hydrogen 3.258 N/A ILE 271.A N PHE 267.A O no hydrogen 3.013 N/A GLU 272.A N GLN 268.A O no hydrogen 3.116 N/A GLY 273.A N ASN 269.A O no hydrogen 2.847 N/A PHE 274.A N LEU 270.A O no hydrogen 2.794 N/A GLU 275.A N ILE 271.A O no hydrogen 2.910 N/A ALA 276.A N GLU 272.A O no hydrogen 3.052 N/A LEU 277.A N GLY 273.A O no hydrogen 3.348 N/A LEU 278.A N PHE 274.A O no hydrogen 2.978 N/A LYS 279.A N GLU 275.A O no hydrogen 3.044 N/A