Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3pp1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 6.A N ASP 6.A OD1 no hydrogen 2.515 N/A ASP 7.A N LYS 4.A O no hydrogen 3.022 N/A PHE 8.A N ASP 5.A O no hydrogen 3.320 N/A GLU 9.A N SER 26.A O no hydrogen 2.948 N/A ILE 11.A N LYS 24.A O no hydrogen 2.844 N/A SER 12.A N LYS 24.A O no hydrogen 3.221 N/A LEU 14.A N VAL 22.A O no hydrogen 2.785 N/A GLY 17.A N GLY 20.A O no hydrogen 3.027 N/A VAL 21.A N LEU 38.A O no hydrogen 2.925 N/A VAL 22.A N GLY 15.A O no hydrogen 2.925 N/A PHE 23.A N ARG 36.A O no hydrogen 2.808 N/A LYS 24.A N SER 12.A O no hydrogen 2.818 N/A VAL 25.A N MET 34.A O no hydrogen 2.791 N/A SER 26.A N GLU 9.A O no hydrogen 2.927 N/A HIS 27.A N LEU 32.A O no hydrogen 3.035 N/A HIS 27.A ND1 SER 30.A OG no hydrogen 2.836 N/A LYS 28.A N ASP 7.A O no hydrogen 2.742 N/A LYS 28.A NZ ASP 6.A O no hydrogen 3.462 N/A SER 30.A N HIS 27.A O no hydrogen 3.238 N/A SER 30.A OG HIS 27.A ND1 no hydrogen 2.836 N/A SER 30.A OG HIS 27.A O no hydrogen 3.471 N/A GLY 31.A N HIS 27.A O no hydrogen 2.776 N/A LEU 32.A N SER 30.A OG no hydrogen 3.018 N/A MET 34.A N VAL 25.A O no hydrogen 2.855 N/A ALA 35.A N MET 83.A O no hydrogen 2.867 N/A ARG 36.A N PHE 23.A O no hydrogen 2.748 N/A ARG 36.A NE SER 80.A OG no hydrogen 2.563 N/A ARG 36.A NH1 ASP 5.A OD1 no hydrogen 3.032 N/A ARG 36.A NH2 ASP 5.A OD1 no hydrogen 2.605 N/A ARG 36.A NH2 SER 80.A OG no hydrogen 3.147 N/A LYS 37.A N ILE 81.A O no hydrogen 2.816 N/A LYS 37.A NZ ASP 148.A OD1 no hydrogen 3.246 N/A LYS 37.A NZ ASP 148.A OD2 no hydrogen 3.170 N/A LEU 38.A N VAL 21.A O no hydrogen 2.633 N/A ILE 39.A N ILE 79.A O no hydrogen 2.970 N/A ILE 47.A N LYS 44.A O no hydrogen 3.120 N/A ARG 48.A N LYS 44.A O no hydrogen 3.204 N/A ARG 48.A NH2 PRO 45.A O no hydrogen 3.195 N/A ASN 49.A N PRO 45.A O no hydrogen 2.980 N/A ILE 51.A N ILE 47.A O no hydrogen 2.909 N/A ILE 52.A N ARG 48.A O no hydrogen 3.394 N/A ARG 53.A N ASN 49.A O no hydrogen 2.900 N/A GLU 54.A N GLN 50.A O no hydrogen 2.759 N/A LEU 55.A N ILE 51.A O no hydrogen 2.851 N/A GLN 56.A N ARG 53.A O no hydrogen 3.270 N/A LEU 58.A N LEU 55.A O no hydrogen 3.202 N/A HIS 59.A N GLN 56.A O no hydrogen 3.270 N/A GLU 60.A N VAL 57.A O no hydrogen 2.983 N/A CYS 61.A N LEU 58.A O no hydrogen 3.347 N/A CYS 61.A SG HIS 124.A NE2 no hydrogen 3.629 N/A ASN 62.A N TYR 119.A OH no hydrogen 2.929 N/A ASN 62.A ND2 HIS 59.A O no hydrogen 3.289 N/A TYR 65.A N SER 63.A OG no hydrogen 3.159 N/A ILE 66.A N SER 63.A O no hydrogen 3.275 N/A VAL 67.A N LEU 146.A O no hydrogen 3.028 N/A GLY 68.A N GLU 84.A OE2 no hydrogen 2.779 N/A TYR 70.A N CYS 82.A O no hydrogen 2.713 N/A GLY 71.A N CYS 82.A O no hydrogen 3.448 N/A PHE 73.A N SER 80.A O no hydrogen 3.152 N/A SER 75.A N GLU 78.A O no hydrogen 2.892 N/A SER 75.A OG ASP 76.A OD1 no hydrogen 3.321 N/A GLY 77.A N SER 75.A O no hydrogen 2.928 N/A ILE 79.A N ILE 39.A O no hydrogen 3.016 N/A SER 80.A N PHE 73.A O no hydrogen 2.781 N/A ILE 81.A N LYS 37.A O no hydrogen 2.958 N/A CYS 82.A N GLY 71.A O no hydrogen 3.036 N/A MET 83.A N ALA 35.A O no hydrogen 2.861 N/A GLU 84.A N GLY 68.A O no hydrogen 3.023 N/A GLY 88.A N VAL 138.A O no hydrogen 3.223 N/A GLY 89.A N MET 86.A O no hydrogen 3.014 N/A SER 90.A N GLN 93.A OE1 no hydrogen 3.084 N/A SER 90.A OG ASP 92.A OD2 no hydrogen 2.361 N/A SER 90.A OG GLN 93.A OE1 no hydrogen 3.494 N/A LEU 91.A N ILE 136.A O no hydrogen 2.930 N/A ASP 92.A N PRO 133.A O no hydrogen 3.169 N/A VAL 94.A N SER 90.A O no hydrogen 2.936 N/A LEU 95.A N LEU 91.A O no hydrogen 2.825 N/A LYS 96.A N ASP 92.A O no hydrogen 3.054 N/A LYS 97.A N GLN 93.A O no hydrogen 3.262 N/A ALA 98.A N VAL 94.A O no hydrogen 2.777 N/A GLY 99.A N LEU 95.A O no hydrogen 2.782 N/A ARG 100.A NE VAL 198.A O no hydrogen 3.435 N/A ILE 101.A N MET 196.A O no hydrogen 2.858 N/A LEU 106.A N PRO 102.A O no hydrogen 2.961 N/A GLY 107.A N GLU 103.A O no hydrogen 2.914 N/A LYS 108.A N GLN 104.A O no hydrogen 3.380 N/A LYS 108.A NZ SER 273.A O no hydrogen 2.758 N/A LYS 108.A NZ GLU 276.A O no hydrogen 2.862 N/A VAL 109.A N ILE 105.A O no hydrogen 2.969 N/A SER 110.A N LEU 106.A O no hydrogen 2.802 N/A SER 110.A OG LEU 106.A O no hydrogen 2.777 N/A ILE 111.A N GLY 107.A O no hydrogen 3.191 N/A ALA 112.A N LYS 108.A O no hydrogen 3.114 N/A VAL 113.A N VAL 109.A O no hydrogen 2.934 N/A ILE 114.A N SER 110.A O no hydrogen 2.791 N/A LYS 115.A N ILE 111.A O no hydrogen 2.887 N/A GLY 116.A N ALA 112.A O no hydrogen 2.901 N/A LEU 117.A N VAL 113.A O no hydrogen 2.904 N/A THR 118.A N ILE 114.A O no hydrogen 2.989 N/A THR 118.A OG1 ILE 114.A O no hydrogen 2.695 N/A TYR 119.A N LYS 115.A O no hydrogen 2.854 N/A TYR 119.A OH HIS 124.A NE2 no hydrogen 3.131 N/A LEU 120.A N GLY 116.A O no hydrogen 3.151 N/A ARG 121.A N LEU 117.A O no hydrogen 2.949 N/A ARG 121.A NE GLU 122.A OE1 no hydrogen 3.303 N/A ARG 121.A NH2 GLU 122.A OE1 no hydrogen 3.280 N/A GLU 122.A N THR 118.A O no hydrogen 2.833 N/A LYS 123.A N TYR 119.A O no hydrogen 2.789 N/A HIS 124.A NE2 TYR 119.A OH no hydrogen 3.131 N/A LYS 125.A N ARG 121.A O no hydrogen 2.913 N/A ILE 126.A N LEU 120.A O no hydrogen 3.265 N/A HIS 128.A N ASP 185.A OD2 no hydrogen 2.590 N/A ARG 129.A N ASP 185.A OD1 no hydrogen 2.931 N/A LYS 132.A NZ SER 134.A OG no hydrogen 3.376 N/A ASN 135.A N LYS 132.A O no hydrogen 2.773 N/A ASN 135.A ND2 ASP 130.A O no hydrogen 2.739 N/A ILE 136.A N PRO 133.A O no hydrogen 3.416 N/A LEU 137.A N LYS 145.A O no hydrogen 2.706 N/A VAL 138.A N GLY 89.A O no hydrogen 2.878 N/A ASN 139.A N GLU 143.A O no hydrogen 3.258 N/A ASN 139.A ND2 GLU 143.A OE2 no hydrogen 3.037 N/A SER 140.A N ASP 87.A OD2 no hydrogen 2.858 N/A SER 140.A OG ASP 87.A OD1 no hydrogen 2.622 N/A SER 140.A OG ASP 87.A OD2 no hydrogen 3.568 N/A ARG 141.A N ASN 139.A OD1 no hydrogen 2.921 N/A GLY 142.A N ASN 139.A O no hydrogen 2.783 N/A LYS 145.A N LEU 137.A O no hydrogen 2.727 N/A LYS 145.A NZ GLU 84.A OE1 no hydrogen 2.995 N/A LYS 145.A NZ GLU 84.A OE2 no hydrogen 3.163 N/A LEU 146.A N TYR 65.A O no hydrogen 2.843 N/A CYS 147.A N ASN 135.A O no hydrogen 3.058 N/A CYS 147.A SG ASN 135.A O no hydrogen 3.984 N/A GLY 150.A N HIS 128.A O no hydrogen 2.965 N/A SER 152.A OG GLU 54.A OE1 no hydrogen 2.592 N/A GLN 154.A N GLU 54.A OE1 no hydrogen 2.979 N/A LEU 155.A N SER 152.A OG no hydrogen 3.141 N/A ILE 156.A N SER 152.A O no hydrogen 3.087 N/A ASP 157.A N GLY 153.A O no hydrogen 2.979 N/A SER 158.A N GLN 154.A O no hydrogen 2.901 N/A SER 158.A OG GLN 154.A O no hydrogen 2.858 N/A MET 159.A N ILE 156.A O no hydrogen 3.250 N/A ALA 160.A N ASP 157.A O no hydrogen 3.391 N/A SER 162.A OG MET 159.A O no hydrogen 3.294 N/A ARG 167.A N THR 166.A OG1 no hydrogen 2.736 N/A TYR 169.A OH GLU 195.A OE1 no hydrogen 3.359 N/A TYR 169.A OH GLU 195.A OE2 no hydrogen 2.635 N/A MET 170.A N SER 168.A OG no hydrogen 3.419 N/A SER 171.A OG SER 184.A OG no hydrogen 2.698 N/A GLU 173.A N GLU 173.A OE1 no hydrogen 3.114 N/A ARG 174.A N SER 171.A OG no hydrogen 3.157 N/A ARG 174.A NH1 ARG 129.A O no hydrogen 2.707 N/A LEU 175.A N SER 171.A O no hydrogen 3.098 N/A GLN 176.A N PRO 172.A O no hydrogen 3.198 N/A GLN 176.A N GLU 173.A O no hydrogen 3.229 N/A GLN 176.A NE2 PRO 172.A O no hydrogen 3.242 N/A TYR 180.A N THR 178.A O no hydrogen 3.071 N/A VAL 182.A N SER 181.A OG no hydrogen 2.649 N/A GLN 183.A NE2 PRO 255.A O no hydrogen 3.086 N/A GLN 183.A NE2 ALA 259.A O no hydrogen 2.876 N/A SER 184.A N SER 181.A O no hydrogen 2.849 N/A SER 184.A OG SER 171.A OG no hydrogen 2.698 N/A ASP 185.A N VAL 182.A O no hydrogen 3.134 N/A SER 188.A N SER 184.A O no hydrogen 3.375 N/A SER 188.A OG TYR 169.A O no hydrogen 2.549 N/A SER 188.A OG SER 184.A O no hydrogen 3.417 N/A MET 189.A N ASP 185.A O no hydrogen 2.956 N/A GLY 190.A N ILE 186.A O no hydrogen 3.023 N/A LEU 191.A N TRP 187.A O no hydrogen 2.992 N/A SER 192.A N SER 188.A O no hydrogen 2.901 N/A SER 192.A OG SER 188.A O no hydrogen 2.791 N/A LEU 193.A N MET 189.A O no hydrogen 2.967 N/A VAL 194.A N GLY 190.A O no hydrogen 3.140 N/A GLU 195.A N LEU 191.A O no hydrogen 3.088 N/A MET 196.A N SER 192.A O no hydrogen 2.941 N/A ALA 197.A N LEU 193.A O no hydrogen 2.896 N/A VAL 198.A N GLU 195.A O no hydrogen 3.233 N/A GLY 199.A N GLU 195.A O no hydrogen 2.740 N/A ARG 200.A NE GLU 210.A OE2 no hydrogen 3.073 N/A ARG 200.A NH1 TYR 201.A O no hydrogen 2.882 N/A ARG 200.A NH1 PRO 204.A O no hydrogen 3.007 N/A ARG 200.A NH2 PRO 204.A O no hydrogen 3.360 N/A ARG 200.A NH2 GLU 210.A OE1 no hydrogen 3.055 N/A ARG 200.A NH2 GLU 210.A OE2 no hydrogen 3.151 N/A TYR 201.A OH SER 168.A O no hydrogen 2.518 N/A ASP 207.A N ASP 207.A OD1 no hydrogen 2.307 N/A LEU 211.A N ASP 207.A O no hydrogen 3.105 N/A GLU 212.A N ALA 208.A O no hydrogen 3.478 N/A LEU 213.A N LYS 209.A O no hydrogen 3.321 N/A MET 214.A N GLU 210.A O no hydrogen 3.026 N/A PHE 215.A N LEU 211.A O no hydrogen 2.981 N/A ALA 218.A N GLU 221.A OE2 no hydrogen 3.195 N/A LEU 222.A N ALA 218.A O no hydrogen 2.925 N/A LEU 223.A N ILE 219.A O no hydrogen 3.054 N/A ASP 224.A N PHE 220.A O no hydrogen 2.663 N/A TYR 225.A N GLU 221.A O no hydrogen 3.041 N/A ILE 226.A N LEU 222.A O no hydrogen 3.049 N/A VAL 227.A N LEU 223.A O no hydrogen 3.004 N/A ASN 228.A N ASP 224.A O no hydrogen 2.919 N/A ASN 228.A ND2 ASP 224.A OD1 no hydrogen 3.265 N/A GLU 229.A N TYR 225.A O no hydrogen 3.316 N/A SER 240.A N GLU 103.A OE1 no hydrogen 3.359 N/A SER 240.A OG GLU 103.A OE2 no hydrogen 2.589 N/A GLU 242.A N GLU 242.A OE2 no hydrogen 2.738 N/A PHE 243.A N SER 240.A OG no hydrogen 3.266 N/A GLN 244.A N SER 240.A O no hydrogen 3.081 N/A GLN 244.A NE2 PHE 239.A O no hydrogen 2.714 N/A ASP 245.A N LEU 241.A O no hydrogen 2.937 N/A PHE 246.A N GLU 242.A O no hydrogen 2.871 N/A VAL 247.A N PHE 243.A O no hydrogen 3.055 N/A ASN 248.A N GLN 244.A O no hydrogen 2.961 N/A LYS 249.A N ASP 245.A O no hydrogen 2.873 N/A CYS 250.A N PHE 246.A O no hydrogen 3.163 N/A CYS 250.A SG PHE 246.A O no hydrogen 3.486 N/A LEU 251.A N VAL 247.A O no hydrogen 2.827 N/A LEU 251.A N ASN 248.A O no hydrogen 3.277 N/A LYS 253.A NZ VAL 227.A O no hydrogen 2.985 N/A LYS 253.A NZ GLU 229.A O no hydrogen 2.634 N/A ALA 256.A N ASN 254.A OD1 no hydrogen 2.939 N/A GLU 257.A N ASN 254.A OD1 no hydrogen 3.213 N/A ARG 258.A N ASN 254.A O no hydrogen 2.918 N/A ARG 258.A NE GLN 183.A O no hydrogen 3.277 N/A ARG 258.A NH1 ILE 252.A O no hydrogen 2.438 N/A ARG 258.A NH1 LYS 253.A O no hydrogen 3.344 N/A ARG 258.A NH2 GLU 173.A OE1 no hydrogen 2.817 N/A ARG 258.A NH2 GLN 183.A O no hydrogen 3.348 N/A ALA 259.A N LYS 249.A O no hydrogen 3.129 N/A GLN 263.A N ASP 260.A OD1 no hydrogen 3.131 N/A LEU 264.A N ASP 260.A O no hydrogen 2.902 N/A MET 265.A N LEU 261.A O no hydrogen 2.882 N/A VAL 266.A N GLN 263.A O no hydrogen 3.209 N/A HIS 267.A N LEU 264.A O no hydrogen 2.997 N/A HIS 267.A NE2 ASP 245.A OD2 no hydrogen 2.721 N/A PHE 269.A N HIS 267.A ND1 no hydrogen 3.038 N/A LYS 271.A N HIS 267.A O no hydrogen 2.907 N/A ARG 272.A N ALA 268.A O no hydrogen 2.716 N/A ARG 272.A NE GLU 276.A OE2 no hydrogen 2.854 N/A ARG 272.A NH1 SER 240.A OG no hydrogen 2.731 N/A ARG 272.A NH2 GLU 103.A OE2 no hydrogen 3.080 N/A SER 273.A N PHE 269.A O no hydrogen 2.855 N/A SER 273.A OG PHE 269.A O no hydrogen 2.943 N/A SER 273.A OG GLU 276.A OE1 no hydrogen 3.539 N/A ASP 274.A N ILE 270.A O no hydrogen 2.675 N/A ALA 275.A N ARG 272.A O no hydrogen 3.215 N/A GLU 276.A N ARG 272.A O no hydrogen 3.270 N/A GLY 282.A N ASP 279.A OD1 no hydrogen 3.274 N/A TRP 283.A N ASP 279.A O no hydrogen 2.742 N/A LEU 284.A N PHE 280.A O no hydrogen 2.753 N/A CYS 285.A N ALA 281.A O no hydrogen 3.204 N/A CYS 285.A SG ALA 281.A O no hydrogen 3.217 N/A SER 286.A N GLY 282.A O no hydrogen 3.058 N/A THR 287.A N TRP 283.A O no hydrogen 3.031 N/A THR 287.A N LEU 284.A O no hydrogen 3.118 N/A THR 287.A OG1 TRP 283.A O no hydrogen 2.657 N/A THR 287.A OG1 LEU 284.A O no hydrogen 2.775 N/A ILE 288.A N LEU 284.A O no hydrogen 2.923 N/A GLY 289.A N CYS 285.A O no hydrogen 2.711 N/A LEU 290.A N CYS 285.A O no hydrogen 3.158 N/A