Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ppk_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 3.A N ASP 2.A OD2 no hydrogen 2.796 N/A ILE 5.A N TYR 72.A O no hydrogen 2.865 N/A GLN 9.A N PRO 6.A O no hydrogen 3.268 N/A THR 11.A N LYS 28.A O no hydrogen 3.062 N/A GLY 13.A N LYS 26.A O no hydrogen 2.686 N/A ILE 16.A N VAL 24.A O no hydrogen 3.071 N/A GLY 17.A N VAL 24.A O no hydrogen 3.461 N/A GLY 19.A N GLY 22.A O no hydrogen 3.018 N/A SER 20.A N ASP 147.A OD2 no hydrogen 3.108 N/A SER 20.A OG ASP 147.A OD1 no hydrogen 2.573 N/A GLY 22.A N GLY 19.A O no hydrogen 2.783 N/A THR 23.A N MET 37.A O no hydrogen 3.141 N/A VAL 24.A N GLY 17.A O no hydrogen 2.760 N/A TYR 25.A N VAL 35.A O no hydrogen 2.680 N/A LYS 26.A N GLN 14.A O no hydrogen 2.789 N/A GLY 27.A N VAL 33.A O no hydrogen 2.753 N/A LYS 28.A N THR 11.A O no hydrogen 2.867 N/A LYS 28.A NZ ASP 32.A OD1 no hydrogen 3.316 N/A TRP 29.A N GLY 31.A O no hydrogen 2.769 N/A TRP 29.A NE1 GLN 9.A OE1 no hydrogen 3.016 N/A VAL 33.A N GLY 27.A O no hydrogen 2.794 N/A ALA 34.A N THR 82.A O no hydrogen 2.979 N/A VAL 35.A N TYR 25.A O no hydrogen 2.895 N/A LYS 36.A N ILE 80.A O no hydrogen 2.950 N/A LYS 36.A NZ SER 20.A O no hydrogen 2.862 N/A LYS 36.A NZ SER 20.A OG no hydrogen 3.171 N/A LYS 36.A NZ GLU 54.A OE2 no hydrogen 2.860 N/A MET 37.A N THR 23.A O no hydrogen 2.988 N/A LEU 38.A N LEU 78.A O no hydrogen 2.869 N/A ASN 39.A ND2 LEU 78.A O no hydrogen 3.171 N/A LEU 48.A N THR 44.A O no hydrogen 2.802 N/A GLN 49.A N PRO 45.A O no hydrogen 2.821 N/A ALA 50.A N GLN 46.A O no hydrogen 3.228 N/A PHE 51.A N GLN 47.A O no hydrogen 2.795 N/A LYS 52.A N LEU 48.A O no hydrogen 3.027 N/A ASN 53.A N GLN 49.A O no hydrogen 3.062 N/A ASN 53.A ND2 GLY 149.A O no hydrogen 3.482 N/A ASN 53.A ND2 ALA 151.A O no hydrogen 3.164 N/A GLU 54.A N ALA 50.A O no hydrogen 3.228 N/A VAL 55.A N PHE 51.A O no hydrogen 3.087 N/A GLY 56.A N LYS 52.A O no hydrogen 3.095 N/A VAL 57.A N ASN 53.A O no hydrogen 3.046 N/A LEU 58.A N GLU 54.A O no hydrogen 2.828 N/A ARG 59.A N VAL 55.A O no hydrogen 2.947 N/A LYS 60.A N VAL 57.A O no hydrogen 3.153 N/A THR 61.A N LEU 58.A O no hydrogen 2.813 N/A THR 61.A OG1 LEU 58.A O no hydrogen 2.612 N/A ARG 62.A N TYR 119.A OH no hydrogen 2.889 N/A ASN 65.A N HIS 63.A ND1 no hydrogen 3.050 N/A ASN 65.A ND2 GLN 112.A OE1 no hydrogen 2.995 N/A ASN 65.A ND2 VAL 143.A O no hydrogen 3.000 N/A ILE 66.A N HIS 63.A O no hydrogen 3.018 N/A LEU 67.A N ILE 145.A O no hydrogen 2.954 N/A LEU 68.A N GLN 83.A OE1 no hydrogen 2.849 N/A MET 70.A N VAL 81.A O no hydrogen 2.744 N/A GLY 71.A N VAL 81.A O no hydrogen 3.039 N/A TYR 72.A N TRP 3.A O no hydrogen 3.149 N/A SER 73.A N ALA 79.A O no hydrogen 2.873 N/A SER 73.A OG ILE 5.A O no hydrogen 3.408 N/A THR 74.A OG1 GLU 4.A OE1 no hydrogen 3.448 N/A ALA 79.A N SER 73.A O no hydrogen 2.716 N/A ILE 80.A N LYS 36.A O no hydrogen 2.882 N/A VAL 81.A N GLY 71.A O no hydrogen 2.756 N/A THR 82.A N ALA 34.A O no hydrogen 3.015 N/A THR 82.A OG1 GLN 83.A O no hydrogen 3.184 N/A GLN 83.A N LEU 68.A O no hydrogen 2.938 N/A TRP 84.A NE1 GLU 86.A OE1 no hydrogen 2.826 N/A SER 89.A N SER 88.A OG no hydrogen 2.575 N/A LEU 90.A N ILE 135.A O no hydrogen 2.672 N/A TYR 91.A N SER 132.A O no hydrogen 3.111 N/A HIS 92.A N SER 89.A OG no hydrogen 3.348 N/A HIS 93.A N SER 89.A O no hydrogen 2.992 N/A HIS 93.A ND1 THR 99.A OG1 no hydrogen 3.023 N/A LEU 94.A N LEU 90.A O no hydrogen 2.873 N/A HIS 95.A N TYR 91.A O no hydrogen 2.741 N/A HIS 95.A NE2 GLU 187.A OE1 no hydrogen 2.680 N/A ILE 96.A N HIS 92.A O no hydrogen 3.100 N/A ILE 97.A N HIS 92.A O no hydrogen 3.039 N/A THR 99.A N HIS 93.A O no hydrogen 2.753 N/A THR 99.A OG1 HIS 93.A ND1 no hydrogen 3.023 N/A LYS 105.A NZ ASP 140.A O no hydrogen 2.848 N/A LEU 106.A N GLU 102.A O no hydrogen 2.751 N/A ILE 107.A N MET 103.A O no hydrogen 2.830 N/A ASP 108.A N ILE 104.A O no hydrogen 3.201 N/A ILE 109.A N LYS 105.A O no hydrogen 3.010 N/A ALA 110.A N LEU 106.A O no hydrogen 3.147 N/A ARG 111.A N ILE 107.A O no hydrogen 2.891 N/A GLN 112.A N ASP 108.A O no hydrogen 2.926 N/A GLN 112.A NE2 ASP 108.A OD2 no hydrogen 3.075 N/A GLN 112.A NE2 LEU 141.A O no hydrogen 3.283 N/A THR 113.A N ILE 109.A O no hydrogen 3.148 N/A THR 113.A OG1 ILE 109.A O no hydrogen 2.689 N/A ALA 114.A N ALA 110.A O no hydrogen 2.837 N/A GLN 115.A N ARG 111.A O no hydrogen 2.829 N/A GLN 115.A NE2 GLN 115.A O no hydrogen 3.180 N/A GLY 116.A N GLN 112.A O no hydrogen 3.048 N/A MET 117.A N THR 113.A O no hydrogen 3.072 N/A ASP 118.A N ALA 114.A O no hydrogen 2.996 N/A TYR 119.A N GLN 115.A O no hydrogen 3.368 N/A LEU 120.A N GLY 116.A O no hydrogen 3.011 N/A HIS 121.A N MET 117.A O no hydrogen 2.831 N/A HIS 121.A NE2 ASP 177.A OD2 no hydrogen 3.105 N/A ALA 122.A N ASP 118.A O no hydrogen 2.822 N/A LYS 123.A N LEU 120.A O no hydrogen 3.115 N/A LYS 123.A NZ LYS 60.A O no hydrogen 3.262 N/A SER 124.A N HIS 121.A O no hydrogen 2.864 N/A ILE 125.A N LEU 120.A O no hydrogen 2.687 N/A ILE 126.A N THR 152.A O no hydrogen 2.934 N/A HIS 127.A N ASP 177.A OD2 no hydrogen 2.938 N/A HIS 127.A NE2 GLY 146.A O no hydrogen 2.999 N/A ARG 128.A N ASP 177.A OD1 no hydrogen 3.104 N/A ASP 129.A N HIS 127.A ND1 no hydrogen 3.000 N/A LYS 131.A NZ SER 155.A OG no hydrogen 3.127 N/A SER 132.A OG GLU 187.A OE1 no hydrogen 2.597 N/A SER 132.A OG GLU 187.A OE2 no hydrogen 3.207 N/A ASN 134.A N LYS 131.A O no hydrogen 2.795 N/A ASN 134.A ND2 ASP 129.A O no hydrogen 3.278 N/A ILE 135.A N SER 132.A O no hydrogen 3.302 N/A PHE 136.A N LYS 144.A O no hydrogen 2.905 N/A LEU 137.A N SER 88.A O no hydrogen 3.290 N/A HIS 138.A N THR 142.A O no hydrogen 2.757 N/A LEU 141.A N HIS 138.A O no hydrogen 3.146 N/A THR 142.A N HIS 138.A O no hydrogen 3.127 N/A VAL 143.A N GLN 112.A OE1 no hydrogen 2.882 N/A LYS 144.A N PHE 136.A O no hydrogen 2.819 N/A LYS 144.A NZ GLN 83.A OE1 no hydrogen 3.028 N/A ILE 145.A N ASN 65.A O no hydrogen 2.835 N/A GLY 146.A N ASN 134.A O no hydrogen 2.820 N/A GLY 149.A N ASP 147.A OD1 no hydrogen 3.369 N/A ALA 151.A N PHE 148.A O no hydrogen 3.370 N/A THR 152.A N ILE 126.A O no hydrogen 3.092 N/A SER 155.A OG ASP 129.A OD1 no hydrogen 2.948 N/A TRP 158.A NE1 GLU 187.A OE2 no hydrogen 2.720 N/A MET 159.A N ILE 156.A O no hydrogen 2.768 N/A ILE 164.A N ALA 160.A O no hydrogen 2.903 N/A ARG 165.A N PRO 161.A O no hydrogen 3.034 N/A ARG 165.A NE GLY 209.A O no hydrogen 2.830 N/A ARG 165.A NH1 GLN 167.A OE1 no hydrogen 3.064 N/A ASN 170.A N ASP 168.A OD1 no hydrogen 2.890 N/A SER 173.A N SER 176.A OG no hydrogen 2.910 N/A SER 173.A OG GLN 175.A OE1 no hydrogen 3.093 N/A GLN 175.A N SER 173.A OG no hydrogen 3.176 N/A GLN 175.A N GLN 175.A OE1 no hydrogen 2.678 N/A SER 176.A OG SER 173.A O no hydrogen 2.679 N/A ASP 177.A N SER 173.A O no hydrogen 3.159 N/A VAL 178.A N PHE 174.A O no hydrogen 2.904 N/A TYR 179.A N GLN 175.A O no hydrogen 2.879 N/A ALA 180.A N SER 176.A O no hydrogen 3.059 N/A PHE 181.A N ASP 177.A O no hydrogen 2.911 N/A GLY 182.A N VAL 178.A O no hydrogen 2.914 N/A ILE 183.A N TYR 179.A O no hydrogen 3.212 N/A VAL 184.A N ALA 180.A O no hydrogen 3.275 N/A LEU 185.A N PHE 181.A O no hydrogen 2.992 N/A TYR 186.A N GLY 182.A O no hydrogen 3.004 N/A GLU 187.A N ILE 183.A O no hydrogen 2.769 N/A LEU 188.A N VAL 184.A O no hydrogen 2.844 N/A MET 189.A N LEU 185.A O no hydrogen 2.984 N/A THR 190.A N TYR 186.A O no hydrogen 2.796 N/A THR 190.A OG1 TYR 186.A O no hydrogen 2.679 N/A THR 190.A OG1 GLN 192.A O no hydrogen 3.310 N/A GLY 191.A N GLU 187.A O no hydrogen 2.904 N/A GLN 192.A N THR 190.A OG1 no hydrogen 3.090 N/A ILE 198.A N TYR 195.A O no hydrogen 3.082 N/A ARG 201.A NH1 GLY 154.A O no hydrogen 2.904 N/A GLN 203.A N ASN 200.A OD1 no hydrogen 2.872 N/A ILE 204.A N ASN 200.A O no hydrogen 3.086 N/A ILE 205.A N ARG 201.A O no hydrogen 3.079 N/A PHE 206.A N ASP 202.A O no hydrogen 2.883 N/A MET 207.A N GLN 203.A O no hydrogen 3.001 N/A VAL 208.A N ILE 204.A O no hydrogen 3.036 N/A GLY 209.A N ILE 205.A O no hydrogen 2.997 N/A ARG 210.A N PHE 206.A O no hydrogen 2.933 N/A GLY 211.A N VAL 208.A O no hydrogen 2.937 N/A TYR 212.A N MET 207.A O no hydrogen 2.802 N/A LEU 213.A N MET 207.A O no hydrogen 3.389 N/A SER 218.A N ASP 216.A OD1 no hydrogen 3.137 N/A LYS 219.A N ASP 216.A O no hydrogen 3.287 N/A LYS 219.A NZ GLN 192.A OE1 no hydrogen 2.903 N/A ARG 221.A N MET 189.A O no hydrogen 3.167 N/A ARG 221.A NH1 PHE 101.A O no hydrogen 3.196 N/A CYS 224.A N ARG 221.A O no hydrogen 2.936 N/A CYS 224.A SG PRO 225.A O no hydrogen 3.540 N/A MET 228.A N PRO 225.A O no hydrogen 3.190 N/A LYS 229.A N PRO 225.A O no hydrogen 3.246 N/A ARG 230.A N LYS 226.A O no hydrogen 2.786 N/A LEU 231.A N ALA 227.A O no hydrogen 2.966 N/A MET 232.A N MET 228.A O no hydrogen 2.917 N/A ALA 233.A N LYS 229.A O no hydrogen 3.417 N/A CYS 235.A N LEU 231.A O no hydrogen 3.174 N/A CYS 235.A SG LEU 231.A O no hydrogen 3.551 N/A LEU 236.A N MET 232.A O no hydrogen 2.971 N/A LYS 238.A NZ GLY 211.A O no hydrogen 3.215 N/A GLU 242.A N LYS 239.A O no hydrogen 3.057 N/A ARG 243.A N ARG 240.A O no hydrogen 3.316 N/A ARG 243.A NE LYS 237.A O no hydrogen 2.967 N/A ARG 243.A NH1 GLU 162.A OE1 no hydrogen 2.566 N/A ARG 243.A NH1 GLN 175.A O no hydrogen 2.946 N/A ARG 243.A NH2 GLU 162.A OE1 no hydrogen 2.723 N/A ARG 243.A NH2 LYS 237.A O no hydrogen 2.895 N/A ILE 249.A N LEU 245.A O no hydrogen 2.998 N/A LEU 250.A N PHE 246.A O no hydrogen 2.764 N/A ALA 251.A N PRO 247.A O no hydrogen 3.203 N/A SER 252.A N GLN 248.A O no hydrogen 3.142 N/A SER 252.A OG GLN 248.A O no hydrogen 2.630 N/A ILE 253.A N ILE 249.A O no hydrogen 3.033 N/A GLU 254.A N LEU 250.A O no hydrogen 2.973 N/A LEU 255.A N ALA 251.A O no hydrogen 3.212 N/A LEU 256.A N SER 252.A O no hydrogen 3.298 N/A ALA 257.A N ILE 253.A O no hydrogen 3.072 N/A ARG 258.A N GLU 254.A O no hydrogen 3.116 N/A SER 259.A N LEU 255.A O no hydrogen 3.426 N/A SER 259.A OG LEU 255.A O no hydrogen 3.399 N/A