Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6how_D.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 4.A N ASP 87.A OD2 no hydrogen 2.822 N/A ALA 5.A N ARG 28.A O no hydrogen 2.910 N/A VAL 6.A N VAL 88.A O no hydrogen 2.903 N/A VAL 7.A N VAL 30.A O no hydrogen 3.104 N/A THR 8.A N VAL 90.A O no hydrogen 3.009 N/A THR 8.A OG1 VAL 90.A O no hydrogen 3.312 N/A GLY 9.A N HIS 32.A ND1 no hydrogen 2.839 N/A ALA 10.A N HIS 32.A O no hydrogen 2.864 N/A ARG 13.A NH1 LEU 187.A O no hydrogen 2.903 N/A ARG 13.A NH2 LEU 187.A O no hydrogen 2.930 N/A ARG 16.A N LYS 12.A O no hydrogen 3.189 N/A ARG 16.A NH2 GLU 46.A OE1.A no hydrogen 3.081 N/A ALA 17.A N ARG 13.A O no hydrogen 3.133 N/A ILE 18.A N ILE 14.A O no hydrogen 2.924 N/A ALA 19.A N GLY 15.A O no hydrogen 2.875 N/A VAL 20.A N ARG 16.A O no hydrogen 2.880 N/A LYS 21.A N ALA 17.A O no hydrogen 3.006 N/A LEU 22.A N ILE 18.A O no hydrogen 2.911 N/A HIS 23.A N ALA 19.A O no hydrogen 2.952 N/A HIS 23.A NE2 THR 54.A OG1 no hydrogen 2.576 N/A GLN 24.A N VAL 20.A O no hydrogen 2.894 N/A THR 25.A N LYS 21.A O no hydrogen 3.113 N/A THR 25.A N LEU 22.A O no hydrogen 3.069 N/A THR 25.A OG1 LYS 21.A O no hydrogen 2.709 N/A GLY 26.A N HIS 23.A O no hydrogen 2.846 N/A TYR 27.A N LEU 22.A O no hydrogen 2.906 N/A ARG 28.A N PRO 3.A O no hydrogen 2.811 N/A ARG 28.A NH2 ALA 2.A O no hydrogen 2.810 N/A VAL 29.A N THR 54.A O no hydrogen 2.848 N/A VAL 30.A N ALA 5.A O no hydrogen 2.827 N/A ILE 31.A N VAL 56.A O no hydrogen 2.761 N/A HIS 32.A N VAL 7.A O no hydrogen 3.088 N/A HIS 32.A NE2 ALA 60.A O no hydrogen 2.791 N/A TYR 33.A N CYS 58.A O no hydrogen 3.034 N/A ALA 37.A N ASN 35.A O no hydrogen 2.930 N/A ALA 40.A N SER 36.A O no hydrogen 2.957 N/A VAL 41.A N ALA 37.A O no hydrogen 2.943 N/A SER 42.A N GLU 38.A O no hydrogen 3.037 N/A LEU 43.A N ALA 39.A O no hydrogen 3.033 N/A ALA 44.A N ALA 40.A O no hydrogen 2.952 N/A ASP 45.A N VAL 41.A O no hydrogen 2.829 N/A GLU 46.A N SER 42.A O no hydrogen 3.121 N/A LEU 47.A N LEU 43.A O no hydrogen 2.932 N/A ASN 48.A N ALA 44.A O no hydrogen 2.885 N/A ASN 48.A ND2 ALA 55.A O no hydrogen 3.027 N/A LYS 49.A N ASP 45.A O no hydrogen 2.849 N/A GLU 50.A N GLU 46.A O no hydrogen 3.135 N/A ARG 51.A N LEU 47.A O no hydrogen 3.060 N/A ARG 51.A NH1 HIS 23.A O no hydrogen 3.032 N/A ARG 51.A NH2 HIS 23.A O no hydrogen 3.299 N/A THR 54.A N ASN 48.A OD1 no hydrogen 2.744 N/A THR 54.A OG1 HIS 23.A NE2 no hydrogen 2.576 N/A THR 54.A OG1 ARG 51.A O no hydrogen 2.640 N/A ALA 55.A N ASN 48.A OD1 no hydrogen 3.062 N/A VAL 56.A N VAL 29.A O no hydrogen 3.053 N/A CYS 58.A N ILE 31.A O no hydrogen 3.029 N/A CYS 58.A SG SER 78.A OG no hydrogen 3.671 N/A GLN 59.A NE2 HIS 34.A O no hydrogen 2.872 N/A ALA 60.A N TYR 33.A O no hydrogen 3.019 N/A THR 63.A N ASP 61.A OD1 no hydrogen 2.883 N/A THR 63.A OG1 ASP 61.A OD1 no hydrogen 2.659 N/A ASN 64.A N ALA 110.A O no hydrogen 2.961 N/A VAL 67.A N SER 65.A OG no hydrogen 3.122 N/A LEU 68.A N SER 65.A O no hydrogen 3.094 N/A SER 71.A N VAL 67.A O no hydrogen 2.978 N/A SER 71.A OG VAL 67.A O no hydrogen 3.342 N/A CYS 72.A N LEU 68.A O no hydrogen 2.928 N/A CYS 72.A SG LEU 68.A O no hydrogen 3.550 N/A CYS 72.A SG ALA 119.A O no hydrogen 3.964 N/A GLU 73.A N PRO 69.A O no hydrogen 2.922 N/A GLU 74.A N ALA 70.A O no hydrogen 2.945 N/A GLU 74.A N SER 71.A O no hydrogen 3.172 N/A ILE 75.A N SER 71.A O no hydrogen 2.951 N/A ILE 76.A N CYS 72.A O no hydrogen 3.197 N/A ASN 77.A N GLU 73.A O no hydrogen 2.870 N/A SER 78.A N GLU 74.A O no hydrogen 2.860 N/A SER 78.A OG ILE 75.A O no hydrogen 2.916 N/A CYS 79.A N ILE 76.A O no hydrogen 2.857 N/A CYS 79.A SG ARG 85.A O no hydrogen 3.350 N/A PHE 80.A N ILE 76.A O no hydrogen 3.343 N/A ARG 81.A N ASN 77.A O no hydrogen 2.861 N/A ALA 82.A N SER 78.A O no hydrogen 2.948 N/A PHE 83.A N CYS 79.A O no hydrogen 2.894 N/A GLY 84.A N PHE 80.A O no hydrogen 2.720 N/A ARG 85.A NE ASP 87.A OD1 no hydrogen 3.475 N/A ARG 85.A NE ASP 87.A OD2 no hydrogen 2.780 N/A ARG 85.A NH2 ASP 87.A OD1 no hydrogen 2.828 N/A ARG 85.A NH2 ASP 87.A OD2 no hydrogen 3.378 N/A CYS 86.A SG VAL 88.A O no hydrogen 3.858 N/A ASP 87.A N ALA 4.A O no hydrogen 2.736 N/A VAL 88.A N ALA 4.A O no hydrogen 3.149 N/A LEU 89.A N SER 135.A O no hydrogen 3.058 N/A VAL 90.A N VAL 6.A O no hydrogen 2.765 N/A ASN 91.A N VAL 137.A O no hydrogen 2.901 N/A ASN 91.A ND2 ASN 138.A OD1 no hydrogen 2.881 N/A ASN 92.A N THR 8.A OG1 no hydrogen 2.855 N/A ASN 92.A ND2 THR 8.A O no hydrogen 3.103 N/A ALA 93.A N THR 8.A OG1 no hydrogen 3.050 N/A SER 94.A OG ALA 95.A O no hydrogen 3.358 N/A SER 94.A OG ASN 116.A OD1 no hydrogen 2.717 N/A ALA 95.A N THR 115.A OG1 no hydrogen 3.165 N/A TYR 97.A OH GLU 111.A OE1 no hydrogen 2.659 N/A THR 99.A N ALA 149.A O no hydrogen 2.673 N/A THR 104.A OG1 THR 107.A OG1 no hydrogen 3.212 N/A THR 107.A N THR 104.A OG1 no hydrogen 3.118 N/A THR 107.A OG1 THR 104.A OG1 no hydrogen 3.212 N/A GLN 108.A N THR 104.A O no hydrogen 2.965 N/A VAL 109.A N VAL 105.A O no hydrogen 2.845 N/A ALA 110.A N GLU 106.A O no hydrogen 2.898 N/A GLU 111.A N THR 107.A O no hydrogen 2.837 N/A LEU 112.A N GLN 108.A O no hydrogen 2.736 N/A ILE 113.A N VAL 109.A O no hydrogen 2.821 N/A GLY 114.A N ALA 110.A O no hydrogen 2.993 N/A THR 115.A N GLU 111.A O no hydrogen 3.120 N/A THR 115.A OG1 GLU 111.A O no hydrogen 2.811 N/A ASN 116.A N LEU 112.A O no hydrogen 3.363 N/A ASN 116.A ND2 ALA 95.A O no hydrogen 2.976 N/A ASN 116.A ND2 LEU 112.A O no hydrogen 3.032 N/A ALA 117.A N ILE 113.A O no hydrogen 2.901 N/A ILE 118.A N ILE 113.A O no hydrogen 2.985 N/A ALA 119.A N GLY 114.A O no hydrogen 2.530 N/A PHE 121.A N ALA 117.A O no hydrogen 3.129 N/A LEU 122.A N ILE 118.A O no hydrogen 2.946 N/A LEU 123.A N ALA 119.A O no hydrogen 2.740 N/A THR 124.A N PRO 120.A O no hydrogen 2.922 N/A THR 124.A OG1 PRO 120.A O no hydrogen 2.575 N/A MET 125.A N PHE 121.A O no hydrogen 2.904 N/A SER 126.A N LEU 122.A O no hydrogen 2.956 N/A SER 126.A OG LEU 122.A O no hydrogen 3.264 N/A PHE 127.A N LEU 123.A O no hydrogen 2.787 N/A ALA 128.A N THR 124.A O no hydrogen 2.985 N/A GLN 129.A N MET 125.A O no hydrogen 2.879 N/A ARG 130.A N SER 126.A O no hydrogen 3.046 N/A ARG 130.A NH1 ASN 77.A OD1 no hydrogen 2.559 N/A GLN 131.A N ALA 128.A O no hydrogen 3.315 N/A GLN 131.A NE2 CYS 86.A O no hydrogen 2.786 N/A GLN 131.A NE2 PHE 127.A O no hydrogen 3.376 N/A SER 135.A N ASP 87.A O no hydrogen 3.011 N/A ILE 136.A N ARG 177.A O no hydrogen 2.811 N/A VAL 137.A N LEU 89.A O no hydrogen 2.816 N/A ASN 138.A N ASN 179.A O no hydrogen 2.954 N/A ASN 138.A ND2 THR 164.A OG1 no hydrogen 2.758 N/A LEU 139.A N ASN 91.A O no hydrogen 2.982 N/A CYS 140.A N VAL 181.A O no hydrogen 2.828 N/A CYS 140.A SG ASN 138.A O no hydrogen 3.722 N/A ALA 142.A N PRO 183.A O no hydrogen 2.911 N/A MET 143.A N ASP 141.A OD1 no hydrogen 2.731 N/A GLN 146.A N MET 143.A O no hydrogen 2.910 N/A GLN 146.A NE2 SER 243.A O no hydrogen 3.373 N/A SER 151.A OG.A THR 99.A O no hydrogen 3.348 N/A LEU 152.A N THR 99.A OG1 no hydrogen 3.239 N/A TYR 153.A OH ASP 141.A OD2 no hydrogen 2.728 N/A ASN 154.A N PHE 150.A O no hydrogen 2.835 N/A ASN 154.A ND2 VAL 144.A O no hydrogen 3.190 N/A MET 155.A N SER 151.A O.A no hydrogen 2.715 N/A MET 155.A N SER 151.A O.B no hydrogen 2.774 N/A GLY 156.A N LEU 152.A O no hydrogen 2.835 N/A LYS 157.A N TYR 153.A O no hydrogen 2.930 N/A LYS 157.A NZ LEU 139.A O no hydrogen 2.668 N/A HIS 158.A N ASN 154.A O no hydrogen 2.957 N/A HIS 158.A NE2 VAL 144.A O no hydrogen 3.004 N/A ALA 159.A N MET 155.A O no hydrogen 2.930 N/A LEU 160.A N GLY 156.A O no hydrogen 2.891 N/A VAL 161.A N LYS 157.A O no hydrogen 3.072 N/A GLY 162.A N HIS 158.A O no hydrogen 3.067 N/A LEU 163.A N ALA 159.A O no hydrogen 2.844 N/A THR 164.A N LEU 160.A O no hydrogen 2.768 N/A THR 164.A OG1 LEU 160.A O no hydrogen 2.853 N/A GLN 165.A N VAL 161.A O no hydrogen 3.012 N/A SER 166.A N GLY 162.A O no hydrogen 2.780 N/A SER 166.A OG GLY 162.A O no hydrogen 3.371 N/A ALA 167.A N LEU 163.A O no hydrogen 2.686 N/A ALA 168.A N THR 164.A O no hydrogen 3.004 N/A LEU 169.A N GLN 165.A O no hydrogen 3.247 N/A GLU 170.A N SER 166.A O no hydrogen 3.041 N/A LEU 171.A N ALA 167.A O no hydrogen 2.878 N/A ALA 172.A N ALA 168.A O no hydrogen 3.119 N/A TYR 174.A N LEU 171.A O no hydrogen 2.994 N/A GLY 175.A N ALA 172.A O no hydrogen 2.679 N/A ILE 176.A N LEU 171.A O no hydrogen 3.114 N/A ARG 177.A N LEU 134.A O no hydrogen 3.085 N/A ARG 177.A NH1 LEU 223.A O no hydrogen 2.894 N/A ARG 177.A NH1 ILE 231.A O no hydrogen 3.108 N/A ARG 177.A NH2 ASN 133.A OD1 no hydrogen 3.144 N/A ARG 177.A NH2 LEU 223.A O no hydrogen 2.791 N/A VAL 178.A N THR 232.A OG1 no hydrogen 2.895 N/A ASN 179.A N ILE 136.A O no hydrogen 2.927 N/A ASN 179.A ND2 ILE 231.A O no hydrogen 2.942 N/A GLY 180.A N SER 234.A O no hydrogen 2.770 N/A VAL 181.A N ASN 138.A O no hydrogen 2.938 N/A ALA 182.A N ILE 236.A O no hydrogen 2.841 N/A GLY 184.A N VAL 238.A O no hydrogen 3.418 N/A SER 186.A OG ALA 211.A O no hydrogen 3.044 N/A LEU 187.A N ALA 211.A O no hydrogen 2.878 N/A MET 192.A N PRO 189.A O no hydrogen 2.889 N/A GLU 195.A N GLU 195.A OE1 no hydrogen 2.719 N/A GLU 196.A N GLY 193.A O no hydrogen 2.760 N/A LYS 197.A N GLY 193.A O no hydrogen 3.140 N/A LYS 197.A NZ VAL 190.A O no hydrogen 3.197 N/A LYS 197.A NZ MET 192.A O no hydrogen 2.920 N/A LYS 197.A NZ GLU 194.A OE2 no hydrogen 2.695 N/A ASP 198.A N GLU 194.A O no hydrogen 3.098 N/A TRP 200.A N GLU 196.A O no hydrogen 3.399 N/A ARG 201.A N LYS 197.A O no hydrogen 2.890 N/A ARG 201.A NE GLU 210.A OE1 no hydrogen 2.680 N/A ARG 201.A NE GLU 210.A OE2 no hydrogen 3.284 N/A ARG 201.A NH1 GLU 194.A OE1 no hydrogen 2.953 N/A ARG 201.A NH2 GLU 210.A OE2 no hydrogen 2.718 N/A ARG 202.A N ASP 198.A O no hydrogen 2.884 N/A LYS 203.A N TRP 200.A O no hydrogen 2.927 N/A VAL 204.A N ARG 201.A O no hydrogen 3.091 N/A LEU 206.A N GLY 240.A O no hydrogen 2.946 N/A GLY 207.A N PRO 205.A O no hydrogen 2.901 N/A ARG 208.A N VAL 204.A O no hydrogen 3.114 N/A ARG 208.A NH1 ARG 202.A O no hydrogen 2.986 N/A GLU 210.A N GLU 210.A OE1 no hydrogen 2.737 N/A ALA 211.A N VAL 185.A O no hydrogen 2.887 N/A SER 212.A N GLN 215.A OE1 no hydrogen 2.965 N/A GLU 214.A N GLU 214.A OE1 no hydrogen 2.861 N/A GLN 215.A N SER 212.A O no hydrogen 3.113 N/A GLN 215.A N SER 212.A OG no hydrogen 3.017 N/A ILE 216.A N SER 212.A O no hydrogen 3.406 N/A ALA 217.A N ALA 213.A O no hydrogen 2.971 N/A ASP 218.A N GLU 214.A O no hydrogen 2.838 N/A ALA 219.A N ILE 216.A O no hydrogen 3.041 N/A VAL 220.A N ILE 216.A O no hydrogen 3.325 N/A ILE 221.A N ALA 217.A O no hydrogen 2.850 N/A PHE 222.A N ASP 218.A O no hydrogen 3.028 N/A LEU 223.A N ALA 219.A O no hydrogen 3.102 N/A VAL 224.A N VAL 220.A O no hydrogen 3.072 N/A SER 225.A N PHE 222.A O no hydrogen 2.970 N/A SER 225.A OG PHE 222.A O no hydrogen 2.691 N/A SER 227.A N SER 225.A OG no hydrogen 3.095 N/A ALA 228.A N SER 225.A O no hydrogen 3.102 N/A ILE 231.A N ALA 228.A O no hydrogen 2.777 N/A THR 232.A OG1 VAL 178.A O no hydrogen 3.438 N/A GLY 233.A N VAL 178.A O no hydrogen 2.743 N/A SER 234.A N ASN 179.A OD1 no hydrogen 2.930 N/A ILE 236.A N GLY 180.A O no hydrogen 2.917 N/A LYS 237.A NZ SER 243.A OG no hydrogen 3.172 N/A VAL 238.A N ALA 182.A O no hydrogen 2.972 N/A GLY 241.A N ASP 239.A OD1 no hydrogen 2.897 N/A LEU 242.A N ASP 239.A O no hydrogen 3.007 N/A SER 243.A N ASP 239.A OD2 no hydrogen 2.958 N/A SER 243.A OG ASP 239.A OD2 no hydrogen 2.812 N/A LEU 244.A N GLY 241.A O no hydrogen 2.988 N/A VAL 245.A N LEU 242.A O no hydrogen 3.207 N/A HIS 246.A ND1 ALA 247.A O no hydrogen 2.840 N/A