Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6tpd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 3.A N VAL 75.A O no hydrogen 3.181 N/A GLU 4.A N TYR 27.A OH no hydrogen 2.853 N/A HIS 7.A N GLU 4.A O no hydrogen 3.076 N/A LEU 8.A N GLU 5.A O no hydrogen 3.210 N/A LYS 9.A N ARG 26.A O no hydrogen 2.864 N/A LYS 9.A NZ ARG 6.A O no hydrogen 3.460 N/A LEU 11.A N MET 24.A O no hydrogen 2.828 N/A GLN 12.A N MET 24.A O no hydrogen 3.161 N/A GLN 12.A NE2 LEU 11.A O no hydrogen 3.012 N/A LEU 14.A N VAL 22.A O no hydrogen 2.842 N/A GLY 20.A N GLY 17.A O no hydrogen 3.121 N/A VAL 22.A N GLY 15.A O no hydrogen 3.335 N/A GLU 23.A N VAL 40.A O no hydrogen 2.939 N/A MET 24.A N GLN 12.A O no hydrogen 2.761 N/A CYS 25.A N VAL 38.A O no hydrogen 2.893 N/A CYS 25.A SG GLU 23.A OE1 no hydrogen 3.853 N/A ARG 26.A N LYS 9.A O no hydrogen 2.869 N/A ARG 26.A NH2 ASP 28.A OD2 no hydrogen 3.418 N/A TYR 27.A N GLU 36.A O no hydrogen 2.713 N/A ASP 28.A N HIS 7.A O no hydrogen 3.107 N/A GLN 31.A N ASP 28.A O no hydrogen 3.028 N/A ASP 32.A N ASP 28.A OD2 no hydrogen 2.893 N/A VAL 38.A N CYS 25.A O no hydrogen 2.722 N/A ALA 39.A N MET 88.A O no hydrogen 2.864 N/A VAL 40.A N GLU 23.A O no hydrogen 2.858 N/A LYS 41.A N LEU 86.A O no hydrogen 2.811 N/A LYS 41.A NZ GLU 57.A OE1 no hydrogen 3.335 N/A LYS 42.A N SER 21.A O no hydrogen 2.857 N/A LYS 42.A NZ GLU 23.A OE1 no hydrogen 3.198 N/A LYS 42.A NZ GLU 23.A OE2 no hydrogen 2.675 N/A GLN 44.A N PHE 19.A O no hydrogen 2.938 N/A THR 47.A N HIS 45.A O no hydrogen 2.859 N/A HIS 50.A N THR 47.A OG1 no hydrogen 3.129 N/A LEU 51.A N THR 47.A O no hydrogen 2.997 N/A ARG 52.A N GLU 48.A O no hydrogen 3.166 N/A ARG 52.A NH1 GLU 55.A OE1 no hydrogen 2.915 N/A ASP 53.A N GLU 49.A O no hydrogen 2.955 N/A PHE 54.A N HIS 50.A O no hydrogen 2.802 N/A GLU 55.A N LEU 51.A O no hydrogen 2.678 N/A ARG 56.A N ARG 52.A O no hydrogen 2.935 N/A ARG 56.A NH1 ASP 53.A OD1 no hydrogen 2.914 N/A GLU 57.A N ASP 53.A O no hydrogen 3.085 N/A ILE 58.A N PHE 54.A O no hydrogen 3.062 N/A GLU 59.A N GLU 55.A O no hydrogen 3.102 N/A ILE 60.A N ARG 56.A O no hydrogen 3.024 N/A LEU 61.A N GLU 57.A O no hydrogen 2.842 N/A LYS 62.A N ILE 58.A O no hydrogen 2.804 N/A SER 63.A N GLU 59.A O no hydrogen 3.034 N/A SER 63.A N ILE 60.A O no hydrogen 2.948 N/A SER 63.A OG ILE 60.A O no hydrogen 2.641 N/A SER 63.A OG TYR 131.A OH no hydrogen 2.820 N/A LEU 64.A N LEU 61.A O no hydrogen 3.368 N/A GLN 65.A N TYR 125.A OH no hydrogen 2.982 N/A ASN 68.A N HIS 66.A ND1 no hydrogen 3.165 N/A ASN 68.A ND2 VAL 149.A O no hydrogen 3.373 N/A ILE 69.A N HIS 66.A O no hydrogen 3.210 N/A VAL 70.A N ILE 151.A O no hydrogen 3.096 N/A LYS 71.A N GLU 89.A OE2 no hydrogen 2.787 N/A LYS 73.A N ILE 87.A O no hydrogen 2.877 N/A LYS 73.A NZ GLU 36.A OE1 no hydrogen 2.825 N/A LYS 73.A NZ GLU 36.A OE2 no hydrogen 3.227 N/A GLY 74.A N ILE 87.A O no hydrogen 3.147 N/A VAL 75.A N THR 1.A O no hydrogen 3.109 N/A CYS 76.A N LYS 85.A O no hydrogen 2.847 N/A CYS 76.A SG PHE 3.A O no hydrogen 3.387 N/A ALA 79.A N GLU 5.A OE1 no hydrogen 3.182 N/A ARG 82.A N SER 78.A O no hydrogen 3.060 N/A ARG 82.A NE ALA 79.A O no hydrogen 2.771 N/A ARG 82.A NH2 ALA 79.A O no hydrogen 2.792 N/A LYS 85.A N CYS 76.A O no hydrogen 2.843 N/A LYS 85.A NZ SER 78.A OG no hydrogen 2.931 N/A LEU 86.A N LYS 41.A O no hydrogen 3.044 N/A ILE 87.A N GLY 74.A O no hydrogen 2.911 N/A MET 88.A N ALA 39.A O no hydrogen 2.743 N/A GLU 89.A N LYS 71.A O no hydrogen 2.854 N/A TYR 93.A N VAL 143.A O no hydrogen 3.156 N/A LEU 96.A N ILE 141.A O no hydrogen 2.780 N/A ARG 97.A N THR 138.A O no hydrogen 3.069 N/A ARG 97.A NH1 ASP 98.A OD1 no hydrogen 3.259 N/A ASP 98.A N SER 95.A OG no hydrogen 3.004 N/A TYR 99.A N SER 95.A O no hydrogen 2.888 N/A LEU 100.A N LEU 96.A O no hydrogen 2.972 N/A GLN 101.A NE2 ARG 97.A O no hydrogen 3.482 N/A LYS 102.A N ASP 98.A O no hydrogen 2.746 N/A HIS 103.A N TYR 99.A O no hydrogen 2.707 N/A HIS 103.A ND1 GLU 105.A OE2 no hydrogen 2.842 N/A LYS 104.A NZ TYR 209.A O no hydrogen 3.344 N/A ARG 106.A N HIS 103.A O no hydrogen 3.206 N/A ARG 106.A NE GLU 105.A OE2 no hydrogen 2.722 N/A ARG 106.A NH2 GLU 105.A OE2 no hydrogen 3.115 N/A ILE 107.A N LYS 104.A O no hydrogen 3.025 N/A HIS 109.A NE2 GLY 252.A O no hydrogen 3.077 N/A LYS 111.A N ASP 108.A OD1 no hydrogen 3.028 N/A LYS 111.A NZ GLN 114.A OE1 no hydrogen 3.146 N/A LYS 111.A NZ GLU 146.A O no hydrogen 3.378 N/A LYS 111.A NZ ASN 147.A OD1 no hydrogen 2.321 N/A LEU 112.A N ASP 108.A O no hydrogen 2.988 N/A LEU 113.A N HIS 109.A O no hydrogen 2.837 N/A GLN 114.A N ILE 110.A O no hydrogen 2.981 N/A TYR 115.A N LYS 111.A O no hydrogen 2.986 N/A TYR 115.A OH GLU 146.A O no hydrogen 2.671 N/A THR 116.A N LEU 112.A O no hydrogen 2.967 N/A THR 116.A OG1 LEU 112.A O no hydrogen 2.585 N/A SER 117.A N LEU 113.A O no hydrogen 3.002 N/A SER 117.A OG ASP 283.A OD1 no hydrogen 2.745 N/A GLN 118.A N GLN 114.A O no hydrogen 2.973 N/A GLN 118.A NE2 ASN 147.A O no hydrogen 2.835 N/A ILE 119.A N TYR 115.A O no hydrogen 3.020 N/A CYS 120.A N THR 116.A O no hydrogen 3.041 N/A CYS 120.A SG THR 116.A O no hydrogen 3.435 N/A LYS 121.A N SER 117.A O no hydrogen 2.991 N/A LYS 121.A NZ SER 117.A OG no hydrogen 3.170 N/A LYS 121.A NZ ASP 283.A OD2 no hydrogen 2.785 N/A GLY 122.A N GLN 118.A O no hydrogen 3.045 N/A MET 123.A N ILE 119.A O no hydrogen 2.904 N/A GLU 124.A N CYS 120.A O no hydrogen 2.769 N/A TYR 125.A N LYS 121.A O no hydrogen 2.985 N/A LEU 126.A N GLY 122.A O no hydrogen 2.933 N/A GLY 127.A N MET 123.A O no hydrogen 3.111 N/A THR 128.A N GLU 124.A O no hydrogen 3.330 N/A THR 128.A N TYR 125.A O no hydrogen 3.086 N/A THR 128.A OG1 TYR 125.A O no hydrogen 2.662 N/A LYS 129.A N LEU 126.A O no hydrogen 3.085 N/A ARG 130.A N GLY 127.A O no hydrogen 3.057 N/A ARG 130.A NH2 PRO 161.A O no hydrogen 3.492 N/A ARG 130.A NH2 LYS 164.A O no hydrogen 3.325 N/A ARG 130.A NH2 GLU 165.A OE2 no hydrogen 3.191 N/A TYR 131.A N LEU 126.A O no hydrogen 3.042 N/A TYR 131.A OH SER 63.A OG no hydrogen 2.820 N/A ILE 132.A N LYS 158.A O no hydrogen 2.803 N/A HIS 133.A N ASP 195.A OD2 no hydrogen 2.913 N/A HIS 133.A NE2 GLY 152.A O no hydrogen 2.804 N/A ARG 134.A N ASP 195.A OD1 no hydrogen 2.949 N/A ARG 134.A NH1 LEU 156.A O no hydrogen 3.081 N/A ASP 135.A N HIS 133.A ND1 no hydrogen 3.043 N/A THR 138.A N GLU 205.A OE2 no hydrogen 3.090 N/A THR 138.A OG1 GLU 205.A OE1 no hydrogen 2.739 N/A ASN 140.A N ALA 137.A O no hydrogen 2.965 N/A ASN 140.A ND2 ASP 135.A O no hydrogen 2.619 N/A ILE 141.A N THR 138.A O no hydrogen 3.406 N/A LEU 142.A N LYS 150.A O no hydrogen 2.971 N/A VAL 143.A N GLY 94.A O no hydrogen 2.927 N/A GLU 144.A N ARG 148.A O no hydrogen 2.934 N/A ASN 145.A N ARG 148.A O no hydrogen 3.437 N/A ASN 147.A N ASN 145.A OD1 no hydrogen 2.775 N/A ARG 148.A N ASN 145.A O no hydrogen 3.066 N/A ARG 148.A NH1 ASP 67.A O no hydrogen 2.734 N/A VAL 149.A N GLN 118.A OE1 no hydrogen 2.900 N/A LYS 150.A N LEU 142.A O no hydrogen 2.853 N/A LYS 150.A NZ GLU 89.A OE1 no hydrogen 3.160 N/A LYS 150.A NZ GLU 89.A OE2 no hydrogen 2.742 N/A ILE 151.A N ASN 68.A O no hydrogen 2.760 N/A GLY 152.A N ASN 140.A O no hydrogen 3.138 N/A THR 157.A N PHE 154.A O no hydrogen 3.398 N/A LYS 158.A N ILE 132.A O no hydrogen 2.897 N/A LEU 160.A N ARG 130.A O no hydrogen 2.904 N/A GLN 162.A N GLN 162.A OE1 no hydrogen 2.782 N/A LYS 164.A N PRO 161.A O no hydrogen 3.134 N/A PHE 167.A N PHE 190.A O no hydrogen 2.811 N/A LYS 168.A NZ GLU 187.A O no hydrogen 3.350 N/A VAL 169.A N SER 188.A O no hydrogen 3.148 N/A SER 175.A OG TYR 180.A OH no hydrogen 3.336 N/A TRP 179.A N PRO 176.A O no hydrogen 3.035 N/A TRP 179.A NE1 GLU 205.A OE2 no hydrogen 2.878 N/A TYR 180.A N ILE 177.A O no hydrogen 3.252 N/A GLU 183.A N GLU 183.A OE1 no hydrogen 2.859 N/A SER 184.A OG LYS 189.A O no hydrogen 2.663 N/A LEU 185.A N ALA 181.A O no hydrogen 3.072 N/A THR 186.A N PRO 182.A O no hydrogen 2.750 N/A THR 186.A OG1 PRO 182.A O no hydrogen 3.035 N/A GLU 187.A N GLU 183.A O no hydrogen 2.911 N/A SER 188.A N SER 184.A O no hydrogen 3.007 N/A LYS 189.A N GLU 183.A O no hydrogen 3.352 N/A PHE 190.A N PHE 167.A O no hydrogen 2.822 N/A SER 191.A N SER 194.A OG no hydrogen 2.795 N/A SER 194.A N SER 191.A OG no hydrogen 3.151 N/A SER 194.A OG SER 191.A O no hydrogen 2.884 N/A ASP 195.A N SER 191.A O no hydrogen 3.078 N/A VAL 196.A N VAL 192.A O no hydrogen 3.016 N/A TRP 197.A N ALA 193.A O no hydrogen 3.130 N/A SER 198.A N SER 194.A O no hydrogen 3.076 N/A SER 198.A OG TRP 179.A O no hydrogen 2.404 N/A SER 198.A OG SER 194.A O no hydrogen 3.498 N/A PHE 199.A N ASP 195.A O no hydrogen 2.844 N/A GLY 200.A N VAL 196.A O no hydrogen 2.938 N/A VAL 201.A N TRP 197.A O no hydrogen 3.247 N/A VAL 202.A N SER 198.A O no hydrogen 2.900 N/A LEU 203.A N PHE 199.A O no hydrogen 2.754 N/A TYR 204.A N GLY 200.A O no hydrogen 3.038 N/A TYR 204.A OH LYS 214.A O no hydrogen 2.490 N/A GLU 205.A N VAL 201.A O no hydrogen 2.859 N/A LEU 206.A N VAL 202.A O no hydrogen 2.926 N/A PHE 207.A N LEU 203.A O no hydrogen 3.227 N/A THR 208.A N TYR 204.A O no hydrogen 2.886 N/A THR 208.A OG1 TYR 204.A O no hydrogen 3.518 N/A THR 208.A OG1 GLU 205.A O no hydrogen 2.859 N/A TYR 209.A N LEU 206.A O no hydrogen 3.178 N/A GLU 211.A N THR 208.A O no hydrogen 3.076 N/A LYS 214.A N GLU 211.A O no hydrogen 3.228 N/A LYS 214.A NZ SER 213.A OG no hydrogen 2.750 N/A ALA 218.A N SER 215.A OG no hydrogen 3.248 N/A GLU 219.A N SER 215.A O no hydrogen 2.903 N/A PHE 220.A N PRO 216.A O no hydrogen 2.881 N/A MET 221.A N PRO 217.A O no hydrogen 2.955 N/A ARG 222.A N ALA 218.A O no hydrogen 3.026 N/A ARG 222.A NE GLU 219.A OE1 no hydrogen 3.015 N/A ARG 222.A NH2 GLU 219.A OE1 no hydrogen 2.601 N/A MET 223.A N GLU 219.A O no hydrogen 3.046 N/A ILE 224.A N PHE 220.A O no hydrogen 2.940 N/A GLY 225.A N MET 221.A O no hydrogen 2.891 N/A LYS 228.A N GLY 225.A O no hydrogen 3.106 N/A LYS 228.A NZ ILE 224.A O no hydrogen 3.036 N/A LYS 228.A NZ ASP 227.A OD2 no hydrogen 3.083 N/A THR 235.A N GLN 231.A O no hydrogen 2.968 N/A THR 235.A OG1 GLN 231.A O no hydrogen 3.196 N/A HIS 236.A N SER 232.A O no hydrogen 2.931 N/A LEU 237.A N ILE 233.A O no hydrogen 2.921 N/A ILE 238.A N VAL 234.A O no hydrogen 2.995 N/A GLU 239.A N THR 235.A O no hydrogen 3.207 N/A LEU 240.A N HIS 236.A O no hydrogen 2.881 N/A LEU 241.A N LEU 237.A O no hydrogen 2.929 N/A LYS 242.A N ILE 238.A O no hydrogen 2.875 N/A ASN 243.A N GLU 239.A O no hydrogen 3.373 N/A ASN 243.A N LEU 240.A O no hydrogen 3.319 N/A ASN 243.A ND2 GLU 239.A O no hydrogen 3.162 N/A ASN 244.A N LEU 241.A O no hydrogen 3.194 N/A GLY 245.A N LEU 240.A O no hydrogen 2.854 N/A ARG 246.A NE TRP 265.A O no hydrogen 3.019 N/A ARG 246.A NH1 LEU 241.A O no hydrogen 2.880 N/A ARG 246.A NH1 GLY 245.A O no hydrogen 2.776 N/A ARG 246.A NH2 TRP 265.A O no hydrogen 2.905 N/A ARG 246.A NH2 ASN 267.A OD1 no hydrogen 2.808 N/A ARG 249.A NH1 CYS 253.A O no hydrogen 3.017 N/A CYS 253.A N PRO 250.A O no hydrogen 3.148 N/A CYS 253.A SG PRO 254.A O no hydrogen 3.519 N/A TYR 258.A N PRO 254.A O no hydrogen 3.035 N/A TYR 258.A OH LEU 247.A O no hydrogen 2.562 N/A MET 259.A N ASP 255.A O no hydrogen 2.799 N/A ILE 260.A N GLU 256.A O no hydrogen 3.350 N/A MET 261.A N ILE 257.A O no hydrogen 3.209 N/A THR 262.A N TYR 258.A O no hydrogen 2.903 N/A THR 262.A OG1 MET 259.A O no hydrogen 3.090 N/A GLU 263.A N MET 259.A O no hydrogen 2.923 N/A CYS 264.A N ILE 260.A O no hydrogen 3.055 N/A CYS 264.A SG ILE 260.A O no hydrogen 3.429 N/A TRP 265.A N MET 261.A O no hydrogen 3.038 N/A ASN 266.A ND2 GLN 271.A OE1 no hydrogen 3.464 N/A ASN 267.A ND2 LEU 241.A O no hydrogen 3.269 N/A ASN 268.A N ASN 266.A OD1 no hydrogen 2.892 N/A GLN 271.A N ASN 268.A O no hydrogen 3.088 N/A ARG 272.A N VAL 269.A O no hydrogen 3.458 N/A ARG 272.A NE ASN 266.A O no hydrogen 2.695 N/A ARG 272.A NH1 GLU 183.A OE2 no hydrogen 2.874 N/A ARG 272.A NH1 ALA 193.A O no hydrogen 3.094 N/A ARG 272.A NH2 GLU 183.A OE1 no hydrogen 2.900 N/A ARG 272.A NH2 ASN 266.A O no hydrogen 2.888 N/A SER 274.A N ASP 277.A OD2 no hydrogen 2.927 N/A ASP 277.A N SER 274.A OG no hydrogen 2.888 N/A LEU 278.A N SER 274.A O no hydrogen 2.993 N/A ALA 279.A N PHE 275.A O no hydrogen 2.902 N/A LEU 280.A N ARG 276.A O no hydrogen 3.162 N/A ARG 281.A N ASP 277.A O no hydrogen 3.050 N/A VAL 282.A N LEU 278.A O no hydrogen 2.932 N/A ASP 283.A N ALA 279.A O no hydrogen 2.906 N/A GLN 284.A N LEU 280.A O no hydrogen 2.808 N/A ILE 285.A N ARG 281.A O no hydrogen 2.855 N/A ARG 286.A N VAL 282.A O no hydrogen 3.006 N/A ARG 286.A NH1 ASP 283.A OD1 no hydrogen 2.749 N/A ASP 287.A N ASP 283.A O no hydrogen 2.892 N/A ASN 288.A N GLN 284.A O no hydrogen 2.838 N/A