Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4dfy_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N GLU 4.A OE1 no hydrogen 2.901 N/A PHE 5.A N SER 1.A O no hydrogen 3.267 N/A LEU 6.A N VAL 2.A O no hydrogen 3.050 N/A LYS 8.A N PHE 5.A O no hydrogen 2.686 N/A ALA 9.A N PHE 5.A O no hydrogen 3.183 N/A LYS 10.A N LEU 6.A O no hydrogen 2.794 N/A GLU 11.A N ALA 7.A O no hydrogen 2.901 N/A ASP 12.A N LYS 8.A O no hydrogen 2.699 N/A PHE 13.A N ALA 9.A O no hydrogen 2.897 N/A LEU 14.A N LYS 10.A O no hydrogen 2.946 N/A LYS 15.A N GLU 11.A O no hydrogen 3.286 N/A LYS 16.A N ASP 12.A O no hydrogen 3.250 N/A LYS 16.A NZ ASP 12.A OD2 no hydrogen 3.466 N/A TRP 17.A N PHE 13.A O no hydrogen 2.860 N/A GLU 18.A N LEU 14.A O no hydrogen 3.012 N/A THR 19.A N LYS 15.A O no hydrogen 3.218 N/A SER 21.A N GLN 83.A OE1 no hydrogen 2.878 N/A SER 21.A OG GLN 83.A OE1 no hydrogen 3.075 N/A THR 24.A N SER 96.A O no hydrogen 2.995 N/A THR 24.A OG1 SER 96.A O no hydrogen 3.556 N/A GLN 26.A NE2 ASP 28.A OD1 no hydrogen 2.795 N/A GLN 26.A NE2 ASP 28.A OD2 no hydrogen 3.542 N/A GLN 29.A N GLN 26.A O no hydrogen 2.885 N/A PHE 30.A N LEU 27.A O no hydrogen 3.464 N/A ASP 31.A N LYS 48.A O no hydrogen 2.843 N/A ARG 32.A NH2 GLU 294.A O no hydrogen 3.047 N/A ILE 33.A N LEU 46.A O no hydrogen 2.864 N/A LEU 36.A N VAL 44.A O no hydrogen 2.680 N/A GLY 37.A N VAL 44.A O no hydrogen 3.359 N/A GLY 39.A N GLY 42.A O no hydrogen 2.988 N/A ARG 43.A NH2 GLU 295.A O no hydrogen 2.683 N/A VAL 44.A N GLY 37.A O no hydrogen 2.658 N/A MET 45.A N MET 58.A O no hydrogen 2.848 N/A LEU 46.A N LYS 34.A O no hydrogen 2.863 N/A VAL 47.A N TYR 56.A O no hydrogen 2.754 N/A LYS 48.A N ASP 31.A O no hydrogen 2.842 N/A HIS 49.A N ASN 54.A O no hydrogen 2.734 N/A HIS 49.A ND1 SER 52.A OG no hydrogen 2.808 N/A LYS 50.A N GLN 29.A O no hydrogen 2.809 N/A LYS 50.A NZ ASP 28.A O no hydrogen 2.722 N/A SER 52.A N HIS 49.A ND1 no hydrogen 3.117 N/A SER 52.A OG HIS 49.A ND1 no hydrogen 2.808 N/A GLY 53.A N HIS 49.A O no hydrogen 2.801 N/A ASN 54.A N SER 52.A OG no hydrogen 3.205 N/A ASN 54.A ND2 TYR 56.A OH no hydrogen 3.426 N/A TYR 56.A N VAL 47.A O no hydrogen 2.706 N/A ALA 57.A N MET 107.A O no hydrogen 2.909 N/A MET 58.A N MET 45.A O no hydrogen 2.726 N/A LYS 59.A N MET 105.A O no hydrogen 2.631 N/A ILE 60.A N ARG 43.A O no hydrogen 3.012 N/A LEU 61.A N LEU 103.A O no hydrogen 2.833 N/A ASP 62.A N PHE 41.A O no hydrogen 2.946 N/A LYS 63.A N SER 101.A O no hydrogen 3.112 N/A LYS 63.A NZ ASP 99.A O no hydrogen 2.763 N/A LYS 63.A NZ LYS 302.A O no hydrogen 2.874 N/A LYS 65.A N ASP 62.A OD2 no hydrogen 2.860 N/A VAL 66.A N ASP 62.A O no hydrogen 2.981 N/A VAL 67.A N LYS 63.A O no hydrogen 2.921 N/A LYS 68.A N GLN 64.A O no hydrogen 2.983 N/A LEU 69.A N LYS 65.A O no hydrogen 2.936 N/A LYS 70.A N VAL 67.A O no hydrogen 2.696 N/A GLN 71.A N VAL 66.A O no hydrogen 2.998 N/A GLN 71.A NE2 LEU 69.A O no hydrogen 2.890 N/A THR 75.A N GLN 71.A O no hydrogen 3.230 N/A THR 75.A OG1 GLN 71.A O no hydrogen 2.491 N/A LEU 76.A N ILE 72.A O no hydrogen 3.075 N/A ASN 77.A N GLU 73.A O no hydrogen 3.063 N/A GLU 78.A N HIS 74.A O no hydrogen 2.689 N/A LYS 79.A N THR 75.A O no hydrogen 2.845 N/A LYS 79.A NZ SER 21.A O no hydrogen 3.172 N/A LYS 79.A NZ SER 96.A OG no hydrogen 3.340 N/A LYS 79.A NZ PHE 310.A O no hydrogen 3.192 N/A ARG 80.A N LEU 76.A O no hydrogen 2.834 N/A ILE 81.A N ASN 77.A O no hydrogen 3.065 N/A LEU 82.A N GLU 78.A O no hydrogen 2.947 N/A GLN 83.A N LYS 79.A O no hydrogen 2.891 N/A GLN 83.A NE2 LYS 16.A O no hydrogen 2.963 N/A GLN 83.A NE2 ARG 80.A O no hydrogen 3.018 N/A ALA 84.A N ARG 80.A O no hydrogen 3.281 N/A ALA 84.A N ILE 81.A O no hydrogen 2.864 N/A VAL 85.A N ILE 81.A O no hydrogen 3.044 N/A ASN 86.A N TYR 143.A OH no hydrogen 3.348 N/A LEU 90.A N PHE 87.A O no hydrogen 3.084 N/A VAL 91.A N VAL 169.A O no hydrogen 3.347 N/A GLU 94.A N VAL 106.A O no hydrogen 2.809 N/A PHE 95.A N VAL 106.A O no hydrogen 3.305 N/A SER 96.A N THR 24.A OG1 no hydrogen 3.170 N/A PHE 97.A N TYR 104.A O no hydrogen 3.019 N/A LYS 98.A NZ PHE 307.A O no hydrogen 2.648 N/A LYS 98.A NZ PHE 310.A OXT no hydrogen 3.149 N/A ASP 99.A N ASN 102.A O no hydrogen 3.113 N/A SER 101.A N ASP 99.A OD1 no hydrogen 2.928 N/A ASN 102.A N ASP 99.A OD1 no hydrogen 2.809 N/A ASN 102.A ND2 LEU 61.A O no hydrogen 3.684 N/A ASN 102.A ND2 ASP 62.A OD1 no hydrogen 3.299 N/A LEU 103.A N LEU 61.A O no hydrogen 2.682 N/A TYR 104.A N PHE 97.A O no hydrogen 2.728 N/A TYR 104.A OH ASP 99.A OD2 no hydrogen 2.701 N/A MET 105.A N LYS 59.A O no hydrogen 3.030 N/A VAL 106.A N PHE 95.A O no hydrogen 2.747 N/A MET 107.A N ALA 57.A O no hydrogen 2.648 N/A GLU 108.A N LYS 92.A O no hydrogen 2.889 N/A MET 115.A N LEU 159.A O no hydrogen 3.075 N/A SER 117.A N GLU 114.A O no hydrogen 3.198 N/A SER 117.A OG GLU 114.A O no hydrogen 2.614 N/A LEU 119.A N MET 115.A O no hydrogen 2.919 N/A ARG 120.A N PHE 116.A O no hydrogen 2.759 N/A ARG 120.A NH1 GLU 205.A OE2 no hydrogen 3.286 N/A ARG 120.A NH2 GLU 205.A OE2 no hydrogen 2.814 N/A ARG 121.A N SER 117.A O no hydrogen 2.973 N/A ILE 122.A N HIS 118.A O no hydrogen 2.858 N/A GLY 123.A N LEU 119.A O no hydrogen 2.774 N/A PHE 125.A N MET 206.A O no hydrogen 2.905 N/A HIS 129.A N SER 126.A OG no hydrogen 3.169 N/A ALA 130.A N SER 126.A O no hydrogen 2.977 N/A ARG 131.A N GLU 127.A O no hydrogen 2.802 N/A ARG 131.A NH1 TRP 271.A O no hydrogen 2.486 N/A PHE 132.A N PRO 128.A O no hydrogen 2.965 N/A ALA 134.A N ALA 130.A O no hydrogen 2.892 N/A ALA 135.A N ARG 131.A O no hydrogen 2.811 N/A GLN 136.A NE2 PHE 132.A O no hydrogen 3.180 N/A ILE 137.A N TYR 133.A O no hydrogen 3.094 N/A VAL 138.A N ALA 134.A O no hydrogen 2.750 N/A LEU 139.A N ALA 135.A O no hydrogen 2.935 N/A THR 140.A N GLN 136.A O no hydrogen 2.822 N/A THR 140.A OG1 GLN 136.A O no hydrogen 2.607 N/A THR 140.A OG1 ILE 137.A O no hydrogen 3.498 N/A PHE 141.A N ILE 137.A O no hydrogen 2.921 N/A GLU 142.A N VAL 138.A O no hydrogen 2.997 N/A TYR 143.A N LEU 139.A O no hydrogen 2.826 N/A LEU 144.A N THR 140.A O no hydrogen 2.830 N/A HIS 145.A N PHE 141.A O no hydrogen 2.996 N/A HIS 145.A NE2 ASP 195.A OD2 no hydrogen 2.729 N/A SER 146.A N GLU 142.A O no hydrogen 3.141 N/A SER 146.A OG TYR 143.A O no hydrogen 2.497 N/A LEU 147.A N LEU 144.A O no hydrogen 2.961 N/A ASP 148.A N HIS 145.A O no hydrogen 2.742 N/A LEU 149.A N LEU 144.A O no hydrogen 2.917 N/A TYR 151.A N ASP 195.A OD2 no hydrogen 2.946 N/A ARG 152.A N ASP 195.A OD1 no hydrogen 2.628 N/A ASP 153.A N TYR 151.A O no hydrogen 2.888 N/A LYS 155.A N TYR 151.A OH no hydrogen 3.283 N/A ASN 158.A N LYS 155.A O no hydrogen 2.680 N/A LEU 159.A N PRO 156.A O no hydrogen 3.035 N/A LEU 160.A N GLN 168.A O no hydrogen 3.146 N/A ILE 161.A N GLY 113.A O no hydrogen 3.049 N/A ASP 162.A N TYR 166.A O no hydrogen 3.072 N/A GLN 164.A N ASP 162.A OD1 no hydrogen 3.092 N/A GLY 165.A N ASP 162.A O no hydrogen 2.996 N/A TYR 166.A N ASP 162.A OD1 no hydrogen 2.827 N/A TYR 166.A OH VAL 285.A O no hydrogen 2.652 N/A ILE 167.A N GLN 136.A OE1 no hydrogen 2.690 N/A GLN 168.A N LEU 160.A O no hydrogen 3.016 N/A GLN 168.A NE2 PRO 88.A O no hydrogen 2.509 N/A GLN 168.A NE2 ILE 167.A O no hydrogen 2.744 N/A VAL 169.A N PHE 89.A O no hydrogen 2.786 N/A THR 170.A N ASN 158.A O no hydrogen 2.977 N/A ASP 171.A N THR 170.A OG1 no hydrogen 2.691 N/A GLU 178.A N GLU 178.A OE1 no hydrogen 2.931 N/A TYR 179.A N THR 176.A O no hydrogen 3.116 N/A TYR 179.A OH GLU 205.A OE1 no hydrogen 2.626 N/A LEU 180.A N PRO 177.A O no hydrogen 2.942 N/A GLU 183.A N GLU 183.A OE1 no hydrogen 2.759 N/A ILE 185.A N ALA 181.A O no hydrogen 3.299 N/A LEU 186.A N PRO 182.A O no hydrogen 2.980 N/A SER 187.A N ILE 184.A O no hydrogen 2.701 N/A LYS 188.A N GLU 183.A O no hydrogen 2.772 N/A LYS 192.A NZ HIS 145.A O no hydrogen 3.496 N/A LYS 192.A NZ ASP 148.A OD1 no hydrogen 2.966 N/A ALA 193.A N ASN 191.A OD1 no hydrogen 3.242 N/A VAL 194.A N ASN 191.A O no hydrogen 3.009 N/A ASP 195.A N LYS 192.A O no hydrogen 3.325 N/A TRP 196.A N ALA 193.A O no hydrogen 2.786 N/A TRP 197.A N ALA 193.A O no hydrogen 3.490 N/A ALA 198.A N VAL 194.A O no hydrogen 2.979 N/A LEU 199.A N ASP 195.A O no hydrogen 2.718 N/A GLY 200.A N TRP 196.A O no hydrogen 2.764 N/A VAL 201.A N TRP 197.A O no hydrogen 2.804 N/A LEU 202.A N ALA 198.A O no hydrogen 2.712 N/A ILE 203.A N LEU 199.A O no hydrogen 2.838 N/A TYR 204.A N GLY 200.A O no hydrogen 2.991 N/A TYR 204.A OH ARG 231.A O no hydrogen 3.047 N/A GLU 205.A N VAL 201.A O no hydrogen 2.900 N/A MET 206.A N LEU 202.A O no hydrogen 2.895 N/A ALA 207.A N ILE 203.A O no hydrogen 2.774 N/A ALA 208.A N TYR 204.A O no hydrogen 2.622 N/A GLY 209.A N GLU 205.A O no hydrogen 2.560 N/A ILE 221.A N GLN 217.A O no hydrogen 3.282 N/A TYR 222.A N PRO 218.A O no hydrogen 2.935 N/A GLU 223.A N ILE 219.A O no hydrogen 3.213 N/A LYS 224.A N GLN 220.A O no hydrogen 3.322 N/A ILE 225.A N ILE 221.A O no hydrogen 3.035 N/A VAL 226.A N TYR 222.A O no hydrogen 2.841 N/A SER 227.A N GLU 223.A O no hydrogen 2.707 N/A SER 227.A OG LYS 224.A O no hydrogen 2.643 N/A GLY 228.A N LYS 224.A O no hydrogen 3.114 N/A LYS 229.A N SER 227.A OG no hydrogen 3.425 N/A PHE 236.A N PRO 233.A O no hydrogen 2.980 N/A SER 237.A N GLU 127.A OE1 no hydrogen 2.765 N/A SER 237.A OG GLU 127.A OE2 no hydrogen 2.776 N/A LEU 240.A N SER 237.A OG no hydrogen 3.019 N/A LYS 241.A N SER 237.A O no hydrogen 2.893 N/A ASP 242.A N SER 238.A O no hydrogen 2.749 N/A LEU 243.A N ASP 239.A O no hydrogen 2.922 N/A LEU 244.A N LEU 240.A O no hydrogen 3.006 N/A ARG 245.A N LYS 241.A O no hydrogen 3.030 N/A ASN 246.A N ASP 242.A O no hydrogen 3.034 N/A LEU 247.A N LEU 243.A O no hydrogen 2.675 N/A LEU 248.A N LEU 244.A O no hydrogen 2.564 N/A THR 253.A N ASP 251.A OD1 no hydrogen 3.358 N/A THR 253.A OG1 ASP 251.A OD1 no hydrogen 2.737 N/A LYS 254.A N ASP 251.A O no hydrogen 2.680 N/A ARG 255.A NE GLN 249.A O no hydrogen 2.963 N/A ARG 255.A NH1 GLU 183.A OE2 no hydrogen 3.111 N/A ARG 255.A NH1 ALA 193.A O no hydrogen 3.142 N/A ARG 255.A NH2 GLU 183.A OE1 no hydrogen 2.606 N/A ARG 255.A NH2 GLU 183.A OE2 no hydrogen 3.145 N/A ARG 255.A NH2 GLN 249.A O no hydrogen 3.441 N/A PHE 256.A N ASN 246.A O no hydrogen 3.370 N/A ASN 258.A N ARG 255.A O no hydrogen 3.009 N/A ASN 258.A ND2 LEU 252.A O no hydrogen 2.655 N/A ASN 261.A ND2 ASP 265.A OD1 no hydrogen 3.164 N/A GLY 262.A N LEU 259.A O no hydrogen 2.841 N/A ASP 265.A N GLY 262.A O no hydrogen 3.342 N/A ILE 266.A N VAL 263.A O no hydrogen 3.143 N/A LYS 267.A N VAL 263.A O no hydrogen 3.442 N/A LYS 267.A NZ GLU 142.A OE1 no hydrogen 3.259 N/A LYS 267.A NZ GLU 142.A OE2 no hydrogen 3.322 N/A ASN 268.A N ASN 264.A O no hydrogen 3.288 N/A HIS 269.A N ILE 266.A O no hydrogen 3.177 N/A HIS 269.A NE2 ASP 242.A OD2 no hydrogen 2.641 N/A TRP 271.A N HIS 269.A ND1 no hydrogen 2.940 N/A TRP 271.A NE1 GLU 127.A OE2 no hydrogen 2.723 N/A PHE 272.A N HIS 269.A O no hydrogen 2.785 N/A ALA 273.A N LYS 270.A O no hydrogen 3.000 N/A THR 275.A N PHE 272.A O no hydrogen 3.340 N/A ALA 279.A N ASP 276.A OD1 no hydrogen 2.771 N/A ILE 280.A N ASP 276.A O no hydrogen 2.857 N/A TYR 281.A N TRP 277.A O no hydrogen 3.003 N/A GLN 282.A N ILE 278.A O no hydrogen 2.720 N/A ARG 283.A N ALA 279.A O no hydrogen 3.016 N/A ARG 283.A N ILE 280.A O no hydrogen 2.841 N/A ARG 283.A NH1 ASP 162.A OD2 no hydrogen 3.488 N/A ARG 283.A NH2 ASP 162.A OD2 no hydrogen 3.171 N/A ARG 283.A NH2 GLN 164.A OE1 no hydrogen 2.765 N/A LYS 284.A N ALA 279.A O no hydrogen 2.985 N/A LYS 284.A NZ GLN 282.A OE1 no hydrogen 3.459 N/A LYS 302.A N ASN 100.A O no hydrogen 2.967 N/A GLU 306.A N CYS 303.A O no hydrogen 3.263 N/A GLU 306.A N GLU 306.A OE1 no hydrogen 2.662 N/A PHE 307.A N CYS 303.A O no hydrogen 3.417 N/A PHE 307.A N GLY 304.A O no hydrogen 3.310 N/A THR 308.A OG1 GLY 304.A O no hydrogen 3.354 N/A THR 308.A OG1 LYS 305.A O no hydrogen 2.680 N/A PHE 310.A N PHE 307.A O no hydrogen 3.202 N/A