Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3gd1_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 7.A N LEU 20.A O no hydrogen 2.995 N/A LYS 8.A N GLU 341.A O no hydrogen 2.836 N/A LYS 9.A N VAL 18.A O no hydrogen 3.264 N/A SER 11.A N LEU 16.A O no hydrogen 2.986 N/A SER 11.A OG ASN 13.A OD1 no hydrogen 3.493 N/A SER 11.A OG LEU 16.A O no hydrogen 3.266 N/A GLY 14.A N SER 11.A O no hydrogen 2.874 N/A LYS 15.A N ASN 13.A OD1 no hydrogen 2.620 N/A THR 17.A N LEU 40.A O no hydrogen 2.927 N/A TYR 19.A N VAL 38.A O no hydrogen 2.929 N/A LEU 20.A N PHE 7.A O no hydrogen 2.957 N/A LYS 22.A NZ GLU 33.A OE1 no hydrogen 2.374 N/A ARG 23.A NE PHE 343.A O no hydrogen 2.669 N/A ARG 23.A NH2 ASP 342.A O no hydrogen 3.133 N/A PHE 25.A N ARG 157.A O no hydrogen 2.825 N/A VAL 26.A N GLU 33.A OE1 no hydrogen 2.864 N/A ASP 27.A N VAL 159.A O no hydrogen 2.815 N/A HIS 28.A N LEU 31.A O no hydrogen 2.696 N/A ILE 29.A N ASP 27.A OD1 no hydrogen 2.924 N/A ASP 30.A N HIS 28.A O no hydrogen 2.553 N/A GLU 33.A N VAL 26.A O no hydrogen 2.945 N/A VAL 35.A N PHE 105.A O no hydrogen 2.580 N/A ASP 36.A N ASP 36.A OD1 no hydrogen 2.570 N/A GLY 37.A N PHE 103.A O no hydrogen 2.939 N/A VAL 38.A N TYR 19.A O no hydrogen 3.006 N/A VAL 39.A N TYR 101.A O no hydrogen 2.822 N/A VAL 41.A N HIS 99.A O no hydrogen 2.883 N/A TYR 45.A N ASP 42.A OD2 no hydrogen 2.971 N/A LEU 46.A N ASP 42.A O no hydrogen 3.173 N/A ARG 49.A NH2 TYR 45.A O no hydrogen 2.582 N/A ARG 50.A NE GLU 140.A O no hydrogen 3.317 N/A ARG 50.A NH1 GLN 76.A OE1 no hydrogen 3.036 N/A VAL 51.A N PHE 78.A O no hydrogen 2.772 N/A TYR 52.A N PHE 137.A O no hydrogen 3.332 N/A TYR 52.A OH GLU 140.A O no hydrogen 3.134 N/A VAL 53.A N VAL 75.A O no hydrogen 2.928 N/A THR 54.A N LYS 135.A O no hydrogen 2.743 N/A LEU 55.A N ALA 73.A O no hydrogen 2.964 N/A THR 56.A N GLU 133.A O no hydrogen 3.011 N/A CYS 57.A N PHE 71.A O no hydrogen 2.747 N/A ALA 58.A N ASP 131.A O no hydrogen 3.110 N/A PHE 59.A N LYS 68.A O no hydrogen 2.900 N/A ARG 60.A N GLY 129.A O no hydrogen 2.965 N/A ARG 60.A NE ASP 131.A OD2 no hydrogen 2.861 N/A ARG 60.A NH2 ASP 131.A OD1 no hydrogen 3.515 N/A TYR 61.A N PHE 66.A O no hydrogen 2.968 N/A GLY 62.A N ALA 127.A O no hydrogen 2.807 N/A ARG 67.A NH2 ASP 69.A OD1 no hydrogen 2.296 N/A LEU 70.A N CYS 57.A O no hydrogen 2.698 N/A PHE 71.A N CYS 57.A O no hydrogen 3.147 N/A ALA 73.A N LEU 55.A O no hydrogen 3.157 N/A VAL 75.A N VAL 53.A O no hydrogen 3.028 N/A GLN 76.A NE2 PRO 79.A O no hydrogen 2.813 N/A SER 77.A OG VAL 51.A O no hydrogen 3.227 N/A PHE 78.A N VAL 51.A O no hydrogen 3.304 N/A GLU 90.A N THR 86.A O no hydrogen 3.230 N/A ARG 91.A N ARG 87.A O no hydrogen 3.147 N/A LEU 92.A N LEU 88.A O no hydrogen 2.833 N/A ILE 93.A N GLN 89.A O no hydrogen 2.743 N/A LYS 94.A N GLU 90.A O no hydrogen 3.017 N/A LEU 96.A N LYS 94.A O no hydrogen 2.327 N/A GLY 97.A N LYS 94.A O no hydrogen 3.149 N/A TYR 101.A N VAL 39.A O no hydrogen 3.371 N/A PHE 103.A N GLY 37.A O no hydrogen 2.996 N/A THR 104.A OG1 GLN 89.A OE1 no hydrogen 2.975 N/A PHE 105.A N VAL 35.A O no hydrogen 2.744 N/A LEU 111.A N PRO 108.A O no hydrogen 2.978 N/A CYS 113.A SG GLN 160.A OE1 no hydrogen 3.698 N/A SER 114.A N LYS 158.A O no hydrogen 2.734 N/A VAL 115.A N VAL 130.A O no hydrogen 3.240 N/A THR 116.A N LEU 275.A O no hydrogen 2.826 N/A THR 116.A OG1 GLY 277.A O no hydrogen 3.094 N/A LEU 117.A N CYS 128.A O no hydrogen 2.760 N/A GLN 118.A N LEU 273.A O no hydrogen 2.811 N/A LYS 126.A N ASP 123.A O no hydrogen 2.922 N/A GLY 129.A N ARG 60.A O no hydrogen 3.386 N/A VAL 130.A N VAL 115.A O no hydrogen 2.626 N/A ASP 131.A N ALA 58.A O no hydrogen 3.191 N/A TYR 132.A OH PRO 112.A O no hydrogen 2.573 N/A GLU 133.A N THR 56.A O no hydrogen 2.979 N/A VAL 134.A N LEU 154.A O no hydrogen 2.836 N/A LYS 135.A N THR 54.A O no hydrogen 2.774 N/A ALA 136.A N VAL 152.A O no hydrogen 3.052 N/A PHE 137.A N TYR 52.A O no hydrogen 3.166 N/A CYS 138.A N ASN 150.A O no hydrogen 3.165 N/A GLU 140.A N GLU 144.A OE1 no hydrogen 2.843 N/A GLU 144.A N ASN 141.A O no hydrogen 3.132 N/A ARG 149.A NH2 HIS 147.A ND1 no hydrogen 3.413 N/A SER 151.A OG ALA 136.A O no hydrogen 3.375 N/A VAL 152.A N ALA 136.A O no hydrogen 3.003 N/A LEU 154.A N VAL 134.A O no hydrogen 2.877 N/A ILE 156.A N TYR 132.A O no hydrogen 2.938 N/A ARG 157.A N ARG 23.A O no hydrogen 3.032 N/A ARG 157.A NH1 ASP 283.A O no hydrogen 3.186 N/A ARG 157.A NH2 ASP 24.A OD2 no hydrogen 3.400 N/A ARG 157.A NH2 ASP 283.A O no hydrogen 3.395 N/A LYS 158.A N SER 114.A OG no hydrogen 3.004 N/A LYS 158.A NZ PRO 109.A O no hydrogen 3.235 N/A LYS 158.A NZ LEU 111.A O no hydrogen 2.662 N/A VAL 159.A N PHE 25.A O no hydrogen 3.171 N/A GLN 160.A NE2 ASP 27.A OD1 no hydrogen 3.002 N/A GLN 160.A NE2 TYR 161.A O no hydrogen 3.049 N/A TYR 161.A N ASP 27.A O no hydrogen 2.985 N/A PRO 166.A N GLU 164.A O no hydrogen 3.040 N/A GLU 171.A N ALA 187.A O no hydrogen 2.914 N/A THR 173.A N LEU 185.A O no hydrogen 2.815 N/A THR 173.A OG1 ALA 323.A O no hydrogen 3.417 N/A LEU 177.A N SER 179.A OG no hydrogen 2.851 N/A SER 179.A OG LYS 181.A O no hydrogen 2.731 N/A LEU 183.A N GLN 175.A O no hydrogen 2.860 N/A LEU 185.A N THR 173.A O no hydrogen 2.790 N/A GLU 186.A N HIS 205.A O no hydrogen 2.957 N/A ALA 187.A N GLU 171.A O no hydrogen 3.219 N/A SER 188.A N ASN 203.A O no hydrogen 3.157 N/A SER 188.A OG ASN 203.A OD1 no hydrogen 3.480 N/A ASP 190.A N SER 201.A O no hydrogen 3.401 N/A LYS 191.A NZ GLU 198.A OE1 no hydrogen 3.438 N/A LYS 191.A NZ GLU 198.A OE2 no hydrogen 3.509 N/A TYR 194.A N THR 329.A O no hydrogen 2.805 N/A TYR 194.A OH ASP 190.A OD1 no hydrogen 3.241 N/A TYR 195.A N GLU 198.A OE1 no hydrogen 3.466 N/A TYR 195.A OH ALA 162.A O no hydrogen 2.593 N/A HIS 196.A NE2 LEU 286.A O no hydrogen 2.796 N/A ILE 200.A N LEU 260.A O no hydrogen 2.540 N/A SER 201.A N ASP 190.A OD1 no hydrogen 2.865 N/A SER 201.A OG THR 259.A OG1 no hydrogen 3.376 N/A VAL 202.A N TYR 258.A O no hydrogen 2.792 N/A ASN 203.A N SER 188.A O no hydrogen 2.987 N/A VAL 204.A N LYS 256.A O no hydrogen 2.752 N/A HIS 205.A N GLU 186.A O no hydrogen 2.983 N/A HIS 205.A NE2 THR 207.A OG1 no hydrogen 2.816 N/A THR 207.A N HIS 184.A O no hydrogen 2.693 N/A ASN 208.A ND2 LYS 212.A O no hydrogen 2.733 N/A ASN 208.A ND2 VAL 248.A O no hydrogen 3.552 N/A ASN 209.A N PRO 182.A O no hydrogen 3.184 N/A THR 210.A N ASN 208.A OD1 no hydrogen 2.578 N/A LYS 212.A NZ LEU 177.A O no hydrogen 3.105 N/A LYS 212.A NZ MET 178.A O no hydrogen 3.457 N/A LYS 212.A NZ ASN 211.A OD1 no hydrogen 3.123 N/A VAL 214.A N VAL 248.A O no hydrogen 2.966 N/A LYS 215.A N VAL 314.A O no hydrogen 2.991 N/A LYS 215.A NZ VAL 315.A O no hydrogen 3.508 N/A LYS 215.A NZ SER 316.A OG no hydrogen 3.088 N/A LYS 216.A NZ GLU 243.A OE1 no hydrogen 3.270 N/A ILE 217.A N ALA 244.A O no hydrogen 2.994 N/A LYS 218.A N LYS 312.A O no hydrogen 2.848 N/A ILE 219.A N GLU 242.A O no hydrogen 2.795 N/A SER 220.A N LYS 310.A O no hydrogen 2.985 N/A VAL 221.A N ALA 240.A O no hydrogen 3.305 N/A ARG 222.A N LYS 308.A O no hydrogen 2.804 N/A ARG 222.A NE TYR 224.A OH no hydrogen 2.935 N/A GLN 223.A N CYS 237.A O no hydrogen 2.665 N/A GLN 223.A NE2 GLN 223.A O no hydrogen 3.512 N/A TYR 224.A N SER 306.A O no hydrogen 2.722 N/A TYR 224.A OH GLU 325.A OE1 no hydrogen 3.111 N/A ALA 225.A N TYR 235.A O no hydrogen 2.646 N/A ASP 226.A N ILE 304.A O no hydrogen 3.041 N/A ILE 227.A N ALA 233.A O no hydrogen 2.996 N/A CYS 228.A N GLY 302.A O no hydrogen 2.575 N/A ASN 231.A N LEU 229.A O no hydrogen 2.492 N/A TYR 235.A N ALA 225.A O no hydrogen 2.687 N/A CYS 237.A SG PRO 238.A O no hydrogen 3.860 N/A CYS 237.A SG GLY 272.A O no hydrogen 4.016 N/A VAL 239.A N VAL 221.A O no hydrogen 2.818 N/A GLU 242.A N ILE 219.A O no hydrogen 2.610 N/A ALA 244.A N ILE 217.A O no hydrogen 3.003 N/A VAL 248.A N VAL 214.A O no hydrogen 3.312 N/A SER 251.A N THR 210.A O no hydrogen 3.394 N/A SER 252.A OG ALA 249.A O no hydrogen 2.553 N/A PHE 254.A N VAL 206.A O no hydrogen 2.736 N/A CYS 255.A SG VAL 204.A O no hydrogen 3.948 N/A LYS 256.A N VAL 204.A O no hydrogen 2.984 N/A LYS 256.A NZ ASP 246.A OD2 no hydrogen 2.621 N/A TYR 258.A N VAL 202.A O no hydrogen 2.913 N/A TYR 258.A OH ASP 246.A OD2 no hydrogen 2.472 N/A THR 259.A OG1 SER 201.A OG no hydrogen 3.376 N/A LEU 260.A N ILE 200.A O no hydrogen 2.719 N/A ASN 267.A ND2 VAL 239.A O no hydrogen 3.091 N/A ARG 268.A N ASN 266.A O no hydrogen 2.728 N/A LYS 270.A NZ PRO 238.A O no hydrogen 2.728 N/A LEU 273.A N GLN 118.A O no hydrogen 2.993 N/A LEU 275.A N THR 116.A O no hydrogen 2.831 N/A ASP 276.A N ASN 285.A O no hydrogen 2.702 N/A LYS 278.A NZ ASP 131.A OD1 no hydrogen 3.203 N/A ASP 283.A N HIS 281.A O no hydrogen 2.608 N/A THR 284.A N HIS 281.A O no hydrogen 2.977 N/A THR 284.A OG1 LYS 278.A O no hydrogen 2.482 N/A THR 284.A OG1 HIS 281.A O no hydrogen 2.984 N/A ASN 285.A N ASP 276.A OD1 no hydrogen 2.725 N/A ASN 285.A ND2 ASP 276.A OD2 no hydrogen 3.325 N/A ALA 287.A N ALA 274.A O no hydrogen 2.861 N/A SER 289.A N LEU 330.A O no hydrogen 2.987 N/A THR 290.A N VAL 305.A O no hydrogen 2.845 N/A THR 290.A OG1 VAL 305.A O no hydrogen 3.236 N/A ARG 293.A NE ILE 29.A O no hydrogen 3.395 N/A ARG 293.A NH2 ILE 29.A O no hydrogen 3.271 N/A GLU 299.A N ASN 297.A OD1 no hydrogen 2.854 N/A LEU 301.A N ARG 298.A O no hydrogen 2.834 N/A GLY 302.A N GLU 299.A O no hydrogen 3.098 N/A ILE 304.A N ASP 226.A O no hydrogen 2.859 N/A SER 306.A N TYR 224.A O no hydrogen 2.842 N/A SER 306.A OG TYR 224.A O no hydrogen 3.208 N/A TYR 307.A OH GLN 223.A OE1 no hydrogen 3.195 N/A TYR 307.A OH ALA 287.A O no hydrogen 2.460 N/A LYS 308.A N ARG 222.A O no hydrogen 3.034 N/A LYS 308.A NZ GLU 325.A OE1 no hydrogen 3.264 N/A VAL 309.A N LEU 326.A O no hydrogen 2.581 N/A LYS 310.A N SER 220.A O no hydrogen 2.686 N/A VAL 311.A N VAL 324.A O no hydrogen 3.017 N/A LYS 312.A N LYS 218.A O no hydrogen 2.862 N/A LYS 312.A NZ ASP 321.A OD2 no hydrogen 3.264 N/A LEU 313.A N VAL 322.A O no hydrogen 2.587 N/A VAL 314.A N LYS 216.A O no hydrogen 2.901 N/A SER 316.A N THR 213.A O no hydrogen 3.264 N/A SER 320.A N VAL 315.A O no hydrogen 2.764 N/A VAL 322.A N LEU 313.A O no hydrogen 2.992 N/A VAL 324.A N VAL 311.A O no hydrogen 3.220 N/A LEU 326.A N VAL 309.A O no hydrogen 2.638 N/A THR 329.A N GLU 192.A O no hydrogen 3.217 N/A LEU 330.A N SER 289.A OG no hydrogen 2.889 N/A MET 331.A N TYR 194.A O no hydrogen 2.758 N/A HIS 332.A N GLN 160.A O no hydrogen 3.013 N/A HIS 332.A ND1 PRO 333.A O no hydrogen 3.245 N/A GLU 341.A N VAL 6.A O no hydrogen 3.075 N/A PHE 343.A N LYS 8.A O no hydrogen 2.748 N/A ARG 345.A NE VAL 155.A O no hydrogen 3.261 N/A ARG 345.A NH1 ASP 24.A OD1 no hydrogen 3.271 N/A ARG 345.A NH1 ASP 283.A OD2 no hydrogen 2.921 N/A ARG 345.A NH2 ASP 24.A OD1 no hydrogen 3.157 N/A ARG 345.A NH2 VAL 155.A O no hydrogen 3.141 N/A