Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2gtp_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 1.A NE ASP 155.A O no hydrogen 3.095 N/A VAL 3.A N HIS 157.A O no hydrogen 2.818 N/A LYS 4.A N THR 181.A OG1 no hydrogen 3.356 N/A LYS 4.A NZ CYS 176.A O no hydrogen 2.865 N/A LYS 4.A NZ GLU 178.A O no hydrogen 2.530 N/A LEU 5.A N LYS 159.A O no hydrogen 2.963 N/A LEU 6.A N ALA 182.A O no hydrogen 2.972 N/A LEU 7.A N PHE 161.A O no hydrogen 2.870 N/A LEU 8.A N ILE 184.A O no hydrogen 2.998 N/A SER 13.A N ALA 10.A O no hydrogen 3.287 N/A SER 13.A OG ALA 10.A O no hydrogen 2.375 N/A SER 13.A OG CYS 186.A O no hydrogen 3.409 N/A LYS 15.A NZ GLY 9.A O no hydrogen 3.083 N/A SER 16.A OG THR 143.A OG1 no hydrogen 2.684 N/A SER 16.A OG ASP 162.A OD2 no hydrogen 3.334 N/A ILE 18.A N GLY 14.A O no hydrogen 3.075 N/A VAL 19.A N LYS 15.A O no hydrogen 3.078 N/A LYS 20.A N SER 16.A O no hydrogen 2.938 N/A GLN 21.A N THR 17.A O no hydrogen 2.953 N/A GLN 21.A NE2 ALA 288.A O no hydrogen 2.582 N/A MET 22.A N ILE 18.A O no hydrogen 2.891 N/A LYS 23.A N VAL 19.A O no hydrogen 3.151 N/A ILE 24.A N LYS 20.A O no hydrogen 3.033 N/A ILE 25.A N GLN 21.A O no hydrogen 2.782 N/A HIS 26.A N MET 22.A O no hydrogen 3.054 N/A GLU 27.A N LYS 23.A O no hydrogen 2.974 N/A GLY 29.A N ILE 24.A O no hydrogen 3.180 N/A TYR 30.A N GLN 133.A OE1 no hydrogen 3.170 N/A SER 31.A N GLU 34.A OE2 no hydrogen 2.684 N/A SER 31.A OG GLU 34.A OE2 no hydrogen 3.452 N/A GLU 34.A N SER 31.A OG no hydrogen 3.263 N/A CYS 35.A N SER 31.A O no hydrogen 2.976 N/A CYS 35.A SG SER 31.A O no hydrogen 3.389 N/A CYS 35.A SG PRO 131.A O no hydrogen 3.308 N/A LYS 36.A N GLU 32.A O no hydrogen 3.058 N/A GLN 37.A N GLU 34.A O no hydrogen 3.204 N/A TYR 38.A N CYS 35.A O no hydrogen 3.102 N/A LYS 39.A N LYS 36.A O no hydrogen 3.340 N/A VAL 42.A N TYR 38.A O no hydrogen 2.989 N/A TYR 43.A N LYS 39.A O no hydrogen 2.940 N/A TYR 43.A OH ILE 124.A O no hydrogen 2.810 N/A SER 44.A N ALA 40.A O no hydrogen 2.847 N/A ASN 45.A N VAL 41.A O no hydrogen 2.770 N/A ASN 45.A ND2 ARG 140.A O no hydrogen 3.401 N/A THR 46.A N VAL 42.A O no hydrogen 2.916 N/A THR 46.A OG1 VAL 42.A O no hydrogen 2.980 N/A ILE 47.A N TYR 43.A O no hydrogen 2.847 N/A GLN 48.A N SER 44.A O no hydrogen 2.864 N/A SER 49.A N ASN 45.A O no hydrogen 2.906 N/A SER 49.A OG ASN 45.A O no hydrogen 2.970 N/A ILE 50.A N THR 46.A O no hydrogen 3.095 N/A ILE 51.A N ILE 47.A O no hydrogen 3.132 N/A ALA 52.A N GLN 48.A O no hydrogen 2.999 N/A ILE 53.A N SER 49.A O no hydrogen 3.215 N/A ILE 54.A N ILE 50.A O no hydrogen 3.031 N/A ARG 55.A N ILE 51.A O no hydrogen 2.943 N/A ALA 56.A N ALA 52.A O no hydrogen 3.040 N/A MET 57.A N ILE 53.A O no hydrogen 3.083 N/A ARG 59.A N ARG 55.A O no hydrogen 3.290 N/A LEU 60.A N ALA 56.A O no hydrogen 2.729 N/A ILE 62.A N MET 57.A O no hydrogen 3.003 N/A GLY 65.A N ASP 95.A OD2 no hydrogen 2.948 N/A ASP 66.A N ASP 95.A OD1 no hydrogen 3.065 N/A ALA 68.A N ASP 66.A OD2 no hydrogen 2.937 N/A ARG 69.A N ASP 66.A O no hydrogen 3.084 N/A ARG 69.A NE ASP 72.A OD2 no hydrogen 2.947 N/A ARG 69.A NH2 ASP 72.A OD2 no hydrogen 3.391 N/A ALA 70.A N SER 67.A O no hydrogen 3.208 N/A ALA 73.A N ARG 69.A O no hydrogen 2.856 N/A ARG 74.A N ALA 70.A O no hydrogen 3.110 N/A ARG 74.A NH2 ASP 71.A OD2 no hydrogen 2.842 N/A GLN 75.A N ASP 71.A O no hydrogen 2.992 N/A GLN 75.A NE2 ASP 71.A OD1 no hydrogen 3.413 N/A LEU 76.A N ASP 72.A O no hydrogen 2.746 N/A PHE 77.A N ALA 73.A O no hydrogen 3.199 N/A VAL 78.A N ARG 74.A O no hydrogen 3.072 N/A LEU 79.A N GLN 75.A O no hydrogen 2.729 N/A ALA 80.A N LEU 76.A O no hydrogen 2.852 N/A LEU 85.A N THR 82.A OG1 no hydrogen 2.901 N/A ALA 86.A N THR 82.A O no hydrogen 2.857 N/A GLY 87.A N ALA 83.A O no hydrogen 2.990 N/A VAL 88.A N GLU 84.A O no hydrogen 3.028 N/A ILE 89.A N LEU 85.A O no hydrogen 2.880 N/A LYS 90.A N ALA 86.A O no hydrogen 2.856 N/A ARG 91.A N GLY 87.A O no hydrogen 3.147 N/A LEU 92.A N VAL 88.A O no hydrogen 3.117 N/A TRP 93.A N ILE 89.A O no hydrogen 2.919 N/A TRP 93.A NE1 ASN 119.A OD1 no hydrogen 2.964 N/A LYS 94.A N LYS 90.A O no hydrogen 3.163 N/A ASP 95.A N LEU 92.A O no hydrogen 3.080 N/A GLY 97.A N ASP 95.A OD2 no hydrogen 3.271 N/A GLN 99.A N ASP 95.A O no hydrogen 2.996 N/A GLN 99.A NE2 TRP 93.A O no hydrogen 2.679 N/A ALA 100.A N SER 96.A O no hydrogen 2.959 N/A CYS 101.A N GLY 97.A O no hydrogen 2.925 N/A CYS 101.A SG ILE 53.A O no hydrogen 3.425 N/A CYS 101.A SG TYR 108.A OH no hydrogen 3.675 N/A PHE 102.A N VAL 98.A O no hydrogen 2.767 N/A ASN 103.A N GLN 99.A O no hydrogen 2.984 N/A ARG 104.A N CYS 101.A O no hydrogen 3.120 N/A ARG 104.A NE GLU 107.A OE2 no hydrogen 2.928 N/A ARG 104.A NH2 GLU 107.A OE1 no hydrogen 3.168 N/A ARG 104.A NH2 GLU 107.A OE2 no hydrogen 3.227 N/A SER 105.A N PHE 102.A O no hydrogen 2.954 N/A ARG 106.A NE ASP 193.A O no hydrogen 3.025 N/A ARG 106.A NH2 ASP 193.A O no hydrogen 3.211 N/A GLU 107.A N ARG 104.A O no hydrogen 2.846 N/A TYR 108.A N SER 105.A O no hydrogen 3.179 N/A TYR 108.A OH CYS 101.A O no hydrogen 2.679 N/A GLN 109.A NE2 VAL 195.A O no hydrogen 3.039 N/A ASN 111.A ND2 SER 49.A OG no hydrogen 3.159 N/A SER 113.A OG ARG 138.A O no hydrogen 2.781 N/A ALA 114.A N ASN 111.A O no hydrogen 3.121 N/A TYR 116.A OH ASP 135.A OD1 no hydrogen 2.570 N/A TYR 117.A N SER 113.A O no hydrogen 3.054 N/A TYR 117.A OH ASP 135.A O no hydrogen 2.757 N/A LEU 118.A N ALA 114.A O no hydrogen 2.796 N/A ASN 119.A N ALA 115.A O no hydrogen 2.738 N/A ASP 120.A N TYR 117.A O no hydrogen 3.035 N/A ARG 123.A NH1 ASP 135.A OD2 no hydrogen 2.856 N/A ARG 123.A NH2 ASP 120.A OD2 no hydrogen 3.259 N/A ARG 123.A NH2 ASP 135.A OD1 no hydrogen 3.293 N/A ILE 124.A N ASP 120.A O no hydrogen 3.001 N/A ALA 125.A N LEU 121.A O no hydrogen 2.755 N/A GLN 126.A N ARG 123.A O no hydrogen 3.475 N/A GLN 126.A NE2 ASP 122.A O no hydrogen 2.781 N/A TYR 129.A N GLN 126.A O no hydrogen 3.056 N/A TYR 129.A OH ASP 135.A OD2 no hydrogen 2.805 N/A THR 132.A N ASP 135.A OD2 no hydrogen 3.109 N/A GLN 134.A NE2 THR 289.A O no hydrogen 2.981 N/A ASP 135.A N THR 132.A OG1 no hydrogen 3.073 N/A VAL 136.A N THR 132.A O no hydrogen 3.115 N/A LEU 137.A N GLN 133.A O no hydrogen 2.990 N/A ARG 138.A N GLN 134.A O no hydrogen 2.910 N/A ARG 138.A NE GLN 134.A OE1 no hydrogen 3.180 N/A THR 139.A N VAL 136.A O no hydrogen 3.068 N/A THR 139.A OG1 VAL 136.A O no hydrogen 2.583 N/A ARG 140.A N ASN 45.A OD1 no hydrogen 2.907 N/A THR 143.A OG1 SER 16.A OG no hydrogen 2.684 N/A THR 144.A OG1 GLU 169.A OE1 no hydrogen 2.627 N/A THR 144.A OG1 GLU 169.A OE2 no hydrogen 3.360 N/A GLY 145.A N GLU 169.A OE2 no hydrogen 2.979 N/A VAL 147.A N ASP 162.A O no hydrogen 2.908 N/A THR 149.A N MET 160.A O no hydrogen 2.750 N/A PHE 151.A N PHE 158.A O no hydrogen 3.231 N/A THR 152.A OG1 HIS 157.A ND1 no hydrogen 2.910 N/A PHE 153.A N LEU 156.A O no hydrogen 2.883 N/A LYS 154.A NZ ASP 299.A O no hydrogen 3.357 N/A LYS 154.A NZ ASP 299.A OD1 no hydrogen 3.227 N/A LYS 154.A NZ ASP 299.A OD2 no hydrogen 3.043 N/A LYS 154.A NZ ASP 303.A OD1 no hydrogen 2.970 N/A LYS 154.A NZ ASP 303.A OD2 no hydrogen 3.402 N/A LEU 156.A N PHE 153.A O no hydrogen 2.768 N/A HIS 157.A N ARG 1.A O no hydrogen 3.177 N/A HIS 157.A ND1 THR 152.A OG1 no hydrogen 2.910 N/A PHE 158.A N PHE 151.A O no hydrogen 2.723 N/A LYS 159.A N VAL 3.A O no hydrogen 2.863 N/A MET 160.A N THR 149.A O no hydrogen 2.780 N/A PHE 161.A N LEU 5.A O no hydrogen 2.845 N/A ASP 162.A N VAL 147.A O no hydrogen 2.865 N/A GLY 164.A N GLY 145.A O no hydrogen 3.391 N/A ARG 167.A N GLU 198.A OE1 no hydrogen 2.951 N/A ARG 167.A NE GLU 207.A OE2 no hydrogen 3.115 N/A ARG 167.A NH1 ASP 199.A OD2 no hydrogen 3.035 N/A ARG 167.A NH2 GLU 207.A OE1 no hydrogen 2.982 N/A GLU 169.A N GLN 166.A O no hydrogen 2.748 N/A ARG 170.A N ARG 167.A O no hydrogen 3.100 N/A ARG 170.A NH2 GLY 165.A O no hydrogen 2.659 N/A LYS 172.A N GLU 169.A O no hydrogen 3.112 N/A LYS 172.A NZ GLU 169.A OE2 no hydrogen 2.754 N/A TRP 173.A N ARG 170.A O no hydrogen 2.956 N/A TRP 173.A NE1 GLY 164.A O no hydrogen 2.677 N/A HIS 175.A N LYS 172.A O no hydrogen 3.394 N/A CYS 176.A N TRP 173.A O no hydrogen 2.833 N/A PHE 177.A N ILE 174.A O no hydrogen 3.083 N/A THR 181.A N LYS 4.A O no hydrogen 2.917 N/A ALA 182.A N LYS 4.A O no hydrogen 3.187 N/A ILE 183.A N SER 225.A O no hydrogen 2.962 N/A ILE 184.A N LEU 6.A O no hydrogen 2.839 N/A PHE 185.A N ILE 227.A O no hydrogen 2.734 N/A CYS 186.A N LEU 8.A O no hydrogen 2.691 N/A VAL 187.A N PHE 229.A O no hydrogen 2.956 N/A LEU 189.A N ASN 231.A O no hydrogen 2.903 N/A ASP 191.A N ALA 188.A O no hydrogen 3.093 N/A TYR 192.A OH SER 243.A O no hydrogen 2.489 N/A LEU 194.A N ASP 191.A O no hydrogen 3.073 N/A LEU 196.A N MET 202.A O no hydrogen 2.965 N/A GLU 198.A N GLU 198.A OE2 no hydrogen 2.871 N/A ASP 199.A N LEU 196.A O no hydrogen 3.139 N/A GLU 201.A N ASP 199.A OD1 no hydrogen 2.869 N/A MET 202.A N ASP 199.A O no hydrogen 3.175 N/A ASN 203.A ND2 TYR 192.A O no hydrogen 2.715 N/A ARG 204.A N LEU 194.A O no hydrogen 2.971 N/A ARG 204.A NE VAL 195.A O no hydrogen 2.854 N/A ARG 204.A NH1 GLU 12.A OE1 no hydrogen 3.277 N/A ARG 204.A NH1 ASP 191.A OD2 no hydrogen 3.331 N/A ARG 204.A NH2 GLU 12.A OE2 no hydrogen 3.279 N/A HIS 206.A N ASN 203.A OD1 no hydrogen 2.793 N/A HIS 206.A NE2 CYS 248.A O no hydrogen 2.600 N/A GLU 207.A N ASN 203.A O no hydrogen 3.055 N/A SER 208.A N ARG 204.A O no hydrogen 3.039 N/A MET 209.A N MET 205.A O no hydrogen 2.901 N/A LYS 210.A N HIS 206.A O no hydrogen 3.128 N/A LEU 211.A N GLU 207.A O no hydrogen 2.848 N/A PHE 212.A N SER 208.A O no hydrogen 2.827 N/A ASP 213.A N MET 209.A O no hydrogen 2.817 N/A SER 214.A N LYS 210.A O no hydrogen 3.211 N/A ILE 215.A N LEU 211.A O no hydrogen 2.992 N/A CYS 216.A N PHE 212.A O no hydrogen 2.854 N/A ASN 217.A N ASP 213.A O no hydrogen 3.391 N/A ASN 217.A ND2 ASP 213.A O no hydrogen 3.275 N/A ASN 217.A ND2 ASP 213.A OD1 no hydrogen 2.920 N/A ASN 217.A ND2 LEU 272.A O no hydrogen 2.792 N/A ASN 218.A N ILE 215.A O no hydrogen 3.191 N/A TRP 220.A N ASN 218.A OD1 no hydrogen 3.030 N/A PHE 221.A N ASN 218.A O no hydrogen 2.923 N/A THR 222.A OG1 LYS 219.A O no hydrogen 2.879 N/A THR 224.A N PHE 221.A O no hydrogen 2.956 N/A THR 224.A OG1 VAL 180.A O no hydrogen 2.904 N/A SER 225.A N THR 181.A O no hydrogen 2.985 N/A ILE 227.A N ILE 183.A O no hydrogen 2.807 N/A LEU 228.A N TYR 282.A O no hydrogen 2.847 N/A PHE 229.A N PHE 185.A O no hydrogen 2.919 N/A LEU 230.A N HIS 284.A O no hydrogen 2.899 N/A ASN 231.A N VAL 187.A O no hydrogen 2.717 N/A ASN 231.A ND2 SER 13.A O no hydrogen 3.032 N/A LYS 232.A NZ GLU 12.A O no hydrogen 2.603 N/A LYS 232.A NZ ASP 112.A OD2 no hydrogen 3.066 N/A LYS 233.A N THR 286.A O no hydrogen 3.382 N/A LYS 233.A NZ PHE 285.A O no hydrogen 3.267 N/A PHE 236.A N LYS 232.A O no hydrogen 2.893 N/A GLU 237.A N LYS 233.A O no hydrogen 2.793 N/A GLU 238.A N ASP 234.A O no hydrogen 3.332 N/A LYS 239.A N LEU 235.A O no hydrogen 3.098 N/A LYS 239.A N PHE 236.A O no hydrogen 3.016 N/A LYS 239.A NZ SER 190.A O no hydrogen 2.813 N/A LYS 239.A NZ ASP 193.A OD1 no hydrogen 2.664 N/A ILE 240.A N PHE 236.A O no hydrogen 2.963 N/A LYS 242.A N LYS 239.A O no hydrogen 2.915 N/A SER 243.A N LYS 239.A O no hydrogen 2.892 N/A SER 243.A OG ASP 193.A OD2 no hydrogen 2.591 N/A LEU 245.A N ASN 256.A OD1 no hydrogen 3.139 N/A ILE 247.A N PRO 244.A O no hydrogen 3.167 N/A CYS 248.A N LEU 245.A O no hydrogen 2.857 N/A CYS 248.A SG ASN 203.A OD1 no hydrogen 3.591 N/A TYR 249.A N LEU 245.A O no hydrogen 2.858 N/A TYR 252.A N TYR 249.A O no hydrogen 2.882 N/A TYR 252.A OH SER 255.A O no hydrogen 2.916 N/A SER 255.A N GLU 260.A OE2 no hydrogen 3.184 N/A SER 255.A OG THR 257.A OG1 no hydrogen 2.698 N/A SER 255.A OG GLU 260.A OE2 no hydrogen 2.591 N/A THR 257.A OG1 SER 255.A OG no hydrogen 2.698 N/A ALA 261.A N THR 257.A O no hydrogen 3.178 N/A ALA 262.A N TYR 258.A O no hydrogen 2.990 N/A ALA 263.A N GLU 259.A O no hydrogen 3.150 N/A TYR 264.A N GLU 260.A O no hydrogen 2.982 N/A ILE 265.A N ALA 261.A O no hydrogen 3.054 N/A GLN 266.A N ALA 262.A O no hydrogen 3.035 N/A GLN 266.A NE2 GLU 270.A OE2 no hydrogen 2.781 N/A CYS 267.A N ALA 263.A O no hydrogen 3.048 N/A CYS 267.A SG ALA 263.A O no hydrogen 3.565 N/A GLN 268.A N TYR 264.A O no hydrogen 2.942 N/A PHE 269.A N ILE 265.A O no hydrogen 3.106 N/A GLU 270.A N GLN 266.A O no hydrogen 2.837 N/A ASP 271.A N CYS 267.A O no hydrogen 2.940 N/A LEU 272.A N PHE 269.A O no hydrogen 3.008 N/A ASN 273.A ND2 LYS 279.A O no hydrogen 3.070 N/A LYS 274.A N ASN 217.A OD1 no hydrogen 2.895 N/A LYS 274.A NZ ASP 213.A OD1 no hydrogen 3.037 N/A LYS 274.A NZ ASP 213.A OD2 no hydrogen 3.070 N/A LYS 274.A NZ LEU 272.A O no hydrogen 3.266 N/A ARG 275.A N ASN 273.A OD1 no hydrogen 2.881 N/A ARG 275.A NH1 ASN 218.A O no hydrogen 3.566 N/A ARG 275.A NH2 ASN 218.A O no hydrogen 3.247 N/A LYS 276.A NZ ASP 271.A O no hydrogen 3.008 N/A LYS 276.A NZ ASN 273.A O no hydrogen 3.256 N/A THR 278.A N ARG 275.A O no hydrogen 3.149 N/A LYS 279.A N ARG 275.A O no hydrogen 2.911 N/A LYS 279.A NZ PHE 221.A O no hydrogen 2.904 N/A LYS 279.A NZ THR 222.A O no hydrogen 2.655 N/A LYS 279.A NZ THR 224.A O no hydrogen 3.104 N/A TYR 282.A N ILE 226.A O no hydrogen 3.011 N/A THR 283.A OG1 GLU 270.A OE2 no hydrogen 2.778 N/A HIS 284.A N LEU 228.A O no hydrogen 2.877 N/A THR 286.A N LEU 230.A O no hydrogen 2.985 N/A THR 286.A OG1 ASN 231.A OD1 no hydrogen 2.739 N/A CYS 287.A N ASN 293.A OD1 no hydrogen 2.863 N/A CYS 287.A SG THR 289.A OG1 no hydrogen 3.577 N/A ALA 288.A N ASN 231.A OD1 no hydrogen 2.867 N/A ASP 290.A N CYS 287.A O no hydrogen 2.798 N/A THR 291.A OG1 GLN 21.A OE1 no hydrogen 2.534 N/A ASN 293.A N ASP 290.A OD1 no hydrogen 3.320 N/A VAL 294.A N ASP 290.A O no hydrogen 2.927 N/A GLN 295.A N THR 291.A O no hydrogen 2.819 N/A PHE 296.A N LYS 292.A O no hydrogen 3.178 N/A VAL 297.A N ASN 293.A O no hydrogen 3.014 N/A PHE 298.A N VAL 294.A O no hydrogen 2.826 N/A ASP 299.A N GLN 295.A O no hydrogen 3.177 N/A ALA 300.A N PHE 296.A O no hydrogen 3.249 N/A VAL 301.A N VAL 297.A O no hydrogen 2.959 N/A THR 302.A N PHE 298.A O no hydrogen 2.893 N/A THR 302.A OG1 PHE 298.A O no hydrogen 3.166 N/A ASP 303.A N ASP 299.A O no hydrogen 3.099 N/A VAL 304.A N ALA 300.A O no hydrogen 2.953 N/A ILE 305.A N VAL 301.A O no hydrogen 2.958 N/A ILE 306.A N THR 302.A O no hydrogen 2.871 N/A LYS 307.A N ASP 303.A O no hydrogen 3.032 N/A ASN 308.A N VAL 304.A O no hydrogen 3.008 N/A ASN 308.A ND2 SER 225.A OG no hydrogen 3.071 N/A ASN 308.A ND2 TYR 282.A OH no hydrogen 2.775 N/A ASN 309.A N ILE 306.A O no hydrogen 3.241 N/A ASN 309.A ND2 ILE 305.A O no hydrogen 3.115 N/A