Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4trr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N ALA 236.A O no hydrogen 2.939 N/A LEU 4.A N ALA 29.A O no hydrogen 2.882 N/A ASN 5.A N ASN 3.A OD1 no hydrogen 3.009 N/A LYS 7.A N LEU 4.A O no hydrogen 2.970 N/A THR 8.A N ASP 85.A OD2 no hydrogen 2.738 N/A THR 8.A OG1 SER 83.A O no hydrogen 2.878 N/A THR 8.A OG1 SER 83.A OG no hydrogen 3.191 N/A THR 8.A OG1 ASP 85.A OD2 no hydrogen 2.946 N/A ALA 9.A N ALA 32.A O no hydrogen 2.760 N/A VAL 10.A N ILE 86.A O no hydrogen 2.854 N/A VAL 11.A N ALA 34.A O no hydrogen 3.042 N/A THR 12.A N VAL 88.A O no hydrogen 3.021 N/A THR 12.A OG1 ASN 90.A O no hydrogen 3.304 N/A ALA 14.A N ALA 36.A O no hydrogen 3.096 N/A ALA 15.A N ASP 37.A OD1 no hydrogen 3.240 N/A LYS 20.A N SER 16.A O no hydrogen 3.169 N/A LYS 20.A NZ GLU 49.A OE1 no hydrogen 3.518 N/A GLU 21.A N GLY 17.A O no hydrogen 3.208 N/A ILE 22.A N ILE 18.A O no hydrogen 2.969 N/A ALA 23.A N GLY 19.A O no hydrogen 3.025 N/A LEU 24.A N LYS 20.A O no hydrogen 2.911 N/A GLU 25.A N GLU 21.A O no hydrogen 2.883 N/A LEU 26.A N ILE 22.A O no hydrogen 2.907 N/A ALA 27.A N ALA 23.A O no hydrogen 3.107 N/A LYS 28.A N LEU 24.A O no hydrogen 2.908 N/A ALA 29.A N GLU 25.A O no hydrogen 3.113 N/A ALA 29.A N LEU 26.A O no hydrogen 3.180 N/A GLY 30.A N ALA 27.A O no hydrogen 2.966 N/A ALA 31.A N LEU 26.A O no hydrogen 3.045 N/A ALA 32.A N LYS 7.A O no hydrogen 2.901 N/A VAL 33.A N LYS 56.A O no hydrogen 2.878 N/A ALA 34.A N ALA 9.A O no hydrogen 2.799 N/A ILE 35.A N ILE 58.A O no hydrogen 2.783 N/A ALA 36.A N VAL 11.A O no hydrogen 2.883 N/A ASP 37.A N VAL 60.A O no hydrogen 3.156 N/A ASN 39.A N ASP 37.A OD2 no hydrogen 3.041 N/A GLN 40.A NE2 ASN 44.A OD1 no hydrogen 3.167 N/A GLY 42.A N ASN 39.A OD1 no hydrogen 3.031 N/A ALA 43.A N ASN 39.A O no hydrogen 3.067 N/A ASN 44.A N GLN 40.A O no hydrogen 2.936 N/A ALA 45.A N ASP 41.A O no hydrogen 3.035 N/A VAL 46.A N GLY 42.A O no hydrogen 3.458 N/A ALA 47.A N ALA 43.A O no hydrogen 3.103 N/A ASP 48.A N ASN 44.A O no hydrogen 2.680 N/A GLU 49.A N ALA 45.A O no hydrogen 2.948 N/A ILE 50.A N VAL 46.A O no hydrogen 2.971 N/A ASN 51.A N ALA 47.A O no hydrogen 2.962 N/A ASN 51.A ND2 ALA 57.A O no hydrogen 3.115 N/A LYS 52.A N ASP 48.A O no hydrogen 2.813 N/A ALA 53.A N GLU 49.A O no hydrogen 3.102 N/A ALA 53.A N ILE 50.A O no hydrogen 3.128 N/A GLY 54.A N ASN 51.A O no hydrogen 2.985 N/A GLY 55.A N ILE 50.A O no hydrogen 2.865 N/A ALA 57.A N ASN 51.A OD1 no hydrogen 2.953 N/A ILE 58.A N VAL 33.A O no hydrogen 3.161 N/A VAL 60.A N ILE 35.A O no hydrogen 2.779 N/A MET 62.A N ASP 37.A O no hydrogen 2.923 N/A THR 65.A N ASP 63.A OD1 no hydrogen 3.018 N/A THR 65.A OG1 ASP 63.A OD1 no hydrogen 2.593 N/A THR 65.A OG1 ASP 63.A OD2 no hydrogen 3.313 N/A ASN 66.A N ASP 63.A O no hydrogen 2.981 N/A ALA 69.A N ASN 66.A OD1 no hydrogen 2.965 N/A VAL 70.A N ASN 66.A O no hydrogen 2.922 N/A ASN 71.A N GLU 67.A O no hydrogen 2.860 N/A THR 72.A N GLU 68.A O no hydrogen 2.926 N/A THR 72.A OG1.A GLU 68.A O no hydrogen 3.101 N/A THR 72.A OG1.A ALA 69.A O no hydrogen 3.095 N/A THR 72.A OG1.B GLU 68.A O no hydrogen 2.944 N/A GLY 73.A N ALA 69.A O no hydrogen 2.989 N/A ILE 74.A N VAL 70.A O no hydrogen 2.843 N/A ASP 75.A N ASN 71.A O no hydrogen 2.995 N/A LYS 76.A N THR 72.A O no hydrogen 2.899 N/A VAL 77.A N GLY 73.A O no hydrogen 3.314 N/A VAL 77.A N ILE 74.A O no hydrogen 3.059 N/A ALA 78.A N ILE 74.A O no hydrogen 3.316 N/A GLU 79.A N ASP 75.A O no hydrogen 2.906 N/A ALA 80.A N LYS 76.A O no hydrogen 2.965 N/A PHE 81.A N VAL 77.A O no hydrogen 2.876 N/A GLY 82.A N ALA 78.A O no hydrogen 2.794 N/A SER 83.A OG THR 8.A OG1 no hydrogen 3.191 N/A SER 83.A OG ASP 85.A OD2 no hydrogen 3.440 N/A ASP 85.A N THR 8.A O no hydrogen 2.830 N/A ASP 85.A N THR 8.A OG1 no hydrogen 2.921 N/A ILE 86.A N THR 8.A O no hydrogen 2.840 N/A LEU 87.A N VAL 137.A O no hydrogen 2.940 N/A VAL 88.A N VAL 10.A O no hydrogen 2.890 N/A SER 89.A N ILE 139.A O no hydrogen 2.887 N/A ASN 90.A N THR 12.A OG1 no hydrogen 2.874 N/A ASN 90.A ND2 THR 12.A O no hydrogen 3.461 N/A ASN 90.A ND2 GLY 13.A O no hydrogen 2.993 N/A ASN 97.A N LEU 152.A O no hydrogen 3.037 N/A GLU 100.A N GLU 100.A OE1 no hydrogen 2.781 N/A ASN 101.A N PRO 98.A O no hydrogen 2.911 N/A TYR 102.A N ILE 99.A O no hydrogen 2.995 N/A TYR 102.A OH ILE 95.A O no hydrogen 2.644 N/A ASP 106.A N SER 103.A OG no hydrogen 2.894 N/A TRP 107.A N SER 103.A O no hydrogen 2.890 N/A LYS 108.A N PHE 104.A O no hydrogen 2.889 N/A LYS 109.A N ALA 105.A O no hydrogen 2.991 N/A MET 110.A N ASP 106.A O no hydrogen 2.924 N/A GLN 111.A N TRP 107.A O no hydrogen 3.104 N/A GLN 111.A NE2 ALA 155.A O no hydrogen 2.994 N/A ALA 112.A N LYS 108.A O no hydrogen 2.909 N/A ILE 113.A N LYS 109.A O no hydrogen 3.049 N/A HIS 114.A N MET 110.A O no hydrogen 3.004 N/A HIS 114.A NE2 ILE 93.A O no hydrogen 2.716 N/A VAL 115.A N GLN 111.A O no hydrogen 2.856 N/A ASP 116.A N GLN 111.A O no hydrogen 3.008 N/A GLY 117.A N ALA 112.A O no hydrogen 2.898 N/A PHE 119.A N VAL 115.A O no hydrogen 2.858 N/A LEU 120.A N ASP 116.A O no hydrogen 2.781 N/A THR 121.A N GLY 117.A O no hydrogen 3.001 N/A THR 121.A OG1 GLY 117.A O no hydrogen 2.711 N/A THR 121.A OG1 ALA 118.A O no hydrogen 3.352 N/A THR 122.A N ALA 118.A O no hydrogen 3.061 N/A THR 122.A OG1 ALA 118.A O no hydrogen 2.613 N/A THR 122.A OG1 TYR 140.A OH.A no hydrogen 2.691 N/A THR 122.A OG1 TYR 140.A OH.B no hydrogen 2.664 N/A LYS 123.A N PHE 119.A O no hydrogen 2.899 N/A LYS 123.A NZ.A GLU 67.A OE2 no hydrogen 2.621 N/A ALA 124.A N LEU 120.A O no hydrogen 2.963 N/A ALA 125.A N THR 121.A O no hydrogen 2.823 N/A LEU 126.A N THR 122.A O no hydrogen 2.861 N/A LYS 127.A N LYS 123.A O no hydrogen 3.424 N/A LYS 127.A NZ ASP 75.A OD1 no hydrogen 2.875 N/A LYS 127.A NZ ASP 75.A OD2 no hydrogen 3.161 N/A HIS 128.A N ALA 125.A O no hydrogen 3.006 N/A HIS 128.A NE2 ASP 75.A OD1 no hydrogen 2.835 N/A MET 129.A N ALA 125.A O no hydrogen 2.883 N/A TYR 130.A N LEU 126.A O no hydrogen 2.783 N/A LYS 131.A N HIS 128.A O no hydrogen 3.361 N/A ASP 133.A N TYR 130.A O no hydrogen 2.982 N/A ARG 134.A N LYS 131.A O no hydrogen 3.074 N/A ARG 134.A NH2 ASP 85.A OD1 no hydrogen 3.492 N/A GLY 135.A N MET 129.A O no hydrogen 2.845 N/A GLY 136.A N ASN 178.A O no hydrogen 3.076 N/A VAL 137.A N ASP 85.A O no hydrogen 2.873 N/A VAL 138.A N ARG 180.A O no hydrogen 2.948 N/A ILE 139.A N LEU 87.A O no hydrogen 2.681 N/A TYR 140.A N HIS 182.A O no hydrogen 2.914 N/A TYR 140.A OH.A THR 122.A OG1 no hydrogen 2.691 N/A TYR 140.A OH.B THR 122.A OG1 no hydrogen 2.664 N/A MET 141.A N SER 89.A O no hydrogen 2.910 N/A GLY 142.A N VAL 184.A O no hydrogen 2.787 N/A SER 143.A N SER 146.A OG no hydrogen 3.294 N/A VAL 144.A N PRO 186.A O no hydrogen 3.081 N/A HIS 145.A N SER 143.A OG no hydrogen 2.842 N/A HIS 145.A NE2 SER 150.A OG no hydrogen 2.825 N/A SER 146.A N SER 143.A O no hydrogen 2.865 N/A SER 146.A OG SER 143.A O no hydrogen 3.334 N/A SER 146.A OG LYS 160.A O no hydrogen 2.785 N/A HIS 147.A N VAL 144.A O no hydrogen 2.832 N/A HIS 147.A NE2 SER 246.A OG no hydrogen 3.107 N/A GLU 148.A N VAL 144.A O no hydrogen 3.032 N/A SER 150.A OG HIS 145.A NE2 no hydrogen 2.825 N/A VAL 157.A N LYS 153.A O no hydrogen 2.912 N/A THR 158.A N SER 154.A O no hydrogen 2.970 N/A THR 158.A OG1 SER 154.A O no hydrogen 2.734 N/A ALA 159.A N ALA 155.A O no hydrogen 2.931 N/A LYS 160.A N TYR 156.A O no hydrogen 2.892 N/A LYS 160.A NZ ALA 91.A O no hydrogen 3.356 N/A LYS 160.A NZ HIS 114.A ND1 no hydrogen 3.285 N/A LYS 160.A NZ MET 141.A O no hydrogen 3.075 N/A HIS 161.A N VAL 157.A O no hydrogen 2.915 N/A HIS 161.A ND1 VAL 157.A O no hydrogen 2.862 N/A GLY 162.A N THR 158.A O no hydrogen 3.028 N/A LEU 163.A N ALA 159.A O no hydrogen 2.984 N/A LEU 164.A N HIS 161.A O no hydrogen 3.135 N/A LEU 166.A N GLY 162.A O no hydrogen 3.085 N/A ALA 167.A N LEU 163.A O no hydrogen 2.930 N/A ARG 168.A N LEU 164.A O no hydrogen 2.926 N/A VAL 169.A N GLY 165.A O no hydrogen 3.074 N/A LEU 170.A N LEU 166.A O no hydrogen 2.915 N/A ALA 171.A N ALA 167.A O no hydrogen 2.856 N/A LYS 172.A N ARG 168.A O no hydrogen 3.293 N/A GLU 173.A N VAL 169.A O no hydrogen 2.883 N/A GLY 174.A N LEU 170.A O no hydrogen 2.745 N/A LYS 176.A NZ GLU 173.A O no hydrogen 3.226 N/A HIS 177.A N GLY 174.A O no hydrogen 2.787 N/A HIS 177.A ND1 ASP 133.A OD1 no hydrogen 2.791 N/A ASN 178.A N ALA 175.A O no hydrogen 3.016 N/A ASN 178.A ND2 ASP 133.A O no hydrogen 2.796 N/A VAL 179.A N GLY 174.A O no hydrogen 2.875 N/A ARG 180.A N GLY 136.A O no hydrogen 2.995 N/A SER 181.A N THR 243.A OG1 no hydrogen 2.917 N/A SER 181.A OG.A ALA 167.A O no hydrogen 3.103 N/A SER 181.A OG.B ALA 167.A O no hydrogen 2.657 N/A HIS 182.A N VAL 138.A O no hydrogen 2.988 N/A HIS 182.A ND1 LEU 242.A O no hydrogen 2.899 N/A VAL 183.A N GLN 245.A O no hydrogen 3.093 N/A VAL 184.A N TYR 140.A O no hydrogen 2.987 N/A CYS 185.A N PHE 247.A O no hydrogen 2.703 N/A CYS 185.A SG HIS 147.A NE2 no hydrogen 3.768 N/A GLY 187.A N VAL 249.A O no hydrogen 2.914 N/A ARG 190.A NE ASP 195.A OD1 no hydrogen 2.701 N/A ARG 190.A NH2 ASP 195.A OD1 no hydrogen 3.464 N/A THR 191.A N VAL 189.A O no hydrogen 3.024 N/A ASP 195.A N THR 191.A O no hydrogen 2.901 N/A LYS 196.A N PRO 192.A O no hydrogen 3.331 N/A LYS 196.A N LEU 193.A O no hydrogen 3.000 N/A GLN 197.A N LEU 193.A O no hydrogen 3.050 N/A GLN 201.A N GLN 197.A O no hydrogen 3.169 N/A VAL 207.A N SER 203.A O no hydrogen 3.159 N/A ILE 208.A N GLU 204.A O no hydrogen 2.922 N/A LYS 209.A N GLU 205.A O no hydrogen 3.168 N/A LYS 209.A NZ GLY 219.A O no hydrogen 2.576 N/A LYS 210.A N GLU 206.A O no hydrogen 2.839 N/A VAL 211.A N GLU 206.A O no hydrogen 3.475 N/A MET 212.A N VAL 207.A O no hydrogen 2.934 N/A LEU 213.A N ILE 208.A O no hydrogen 2.824 N/A THR 216.A N LEU 213.A O no hydrogen 3.006 N/A THR 216.A OG1 LEU 213.A O no hydrogen 2.730 N/A VAL 217.A N HIS 251.A O no hydrogen 2.949 N/A GLY 219.A N THR 216.A OG1 no hydrogen 2.859 N/A VAL 220.A N ASP 218.A OD1 no hydrogen 3.118 N/A THR 222.A N PHE 188.A O no hydrogen 2.845 N/A THR 222.A OG1 VAL 249.A O no hydrogen 3.097 N/A THR 223.A N ASP 226.A OD2 no hydrogen 3.187 N/A GLN 225.A NE2.B GLU 21.A OE2 no hydrogen 2.723 N/A GLN 225.A NE2.B GLU 25.A OE2 no hydrogen 3.221 N/A ASP 226.A N THR 223.A OG1 no hydrogen 2.877 N/A VAL 227.A N THR 223.A O no hydrogen 3.264 N/A ALA 228.A N VAL 224.A O no hydrogen 2.845 N/A GLN 229.A N GLN 225.A O no hydrogen 2.903 N/A GLN 229.A NE2 GLU 25.A OE1 no hydrogen 2.786 N/A GLN 229.A NE2 GLN 225.A OE1.B no hydrogen 2.990 N/A THR 230.A N ASP 226.A O no hydrogen 3.291 N/A THR 230.A OG1 ASP 226.A O no hydrogen 3.112 N/A VAL 231.A N VAL 227.A O no hydrogen 2.959 N/A LEU 232.A N ALA 228.A O no hydrogen 2.810 N/A PHE 233.A N GLN 229.A O no hydrogen 2.999 N/A LEU 234.A N THR 230.A O no hydrogen 3.060 N/A SER 235.A N VAL 231.A O no hydrogen 2.889 N/A SER 235.A OG VAL 231.A O no hydrogen 2.995 N/A ALA 236.A N LEU 232.A O no hydrogen 3.112 N/A PHE 237.A N LEU 234.A O no hydrogen 3.292 N/A ALA 241.A N SER 239.A OG no hydrogen 2.978 N/A THR 243.A N ALA 240.A O no hydrogen 3.130 N/A GLY 244.A N SER 181.A O no hydrogen 2.694 N/A GLN 245.A N LEU 242.A O no hydrogen 3.308 N/A SER 246.A OG HIS 147.A NE2 no hydrogen 3.107 N/A PHE 247.A N VAL 183.A O no hydrogen 2.739 N/A VAL 249.A N CYS 185.A O no hydrogen 2.831 N/A SER 250.A OG TRP 253.A O no hydrogen 2.601 N/A HIS 251.A ND1 ASP 218.A OD2 no hydrogen 2.618 N/A TRP 253.A N SER 250.A O no hydrogen 3.369 N/A TRP 253.A NE1 GLU 148.A OE2 no hydrogen 2.640 N/A