Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3l95_X.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 4.A N GLY 1.A O no hydrogen 3.422 N/A CYS 4.A SG GLY 1.A O no hydrogen 3.699 N/A CYS 4.A SG ASN 24.A OD1 no hydrogen 2.664 N/A GLU 5.A N SER 2.A O no hydrogen 3.270 N/A LEU 6.A N ALA 3.A O no hydrogen 3.048 N/A CYS 9.A N LEU 6.A O no hydrogen 3.153 N/A CYS 9.A SG ALA 3.A O no hydrogen 3.176 N/A GLN 10.A N LEU 6.A O no hydrogen 3.214 N/A GLN 10.A NE2 CYS 4.A O no hydrogen 2.689 N/A GLU 11.A N PRO 7.A O no hydrogen 2.850 N/A ASP 12.A N GLU 8.A O no hydrogen 3.407 N/A GLY 14.A N ASP 30.A O no hydrogen 3.096 N/A ASN 15.A N ASP 33.A OD2 no hydrogen 3.116 N/A LYS 16.A N ASP 33.A OD1 no hydrogen 2.859 N/A VAL 17.A N ASN 15.A OD1 no hydrogen 3.228 N/A SER 19.A N ASP 30.A OD2 no hydrogen 3.028 N/A CYS 22.A N SER 19.A O no hydrogen 3.155 N/A CYS 22.A SG ASP 12.A OD2 no hydrogen 3.916 N/A ASN 23.A N LEU 20.A O no hydrogen 3.134 N/A ASN 23.A ND2 SER 212.A O no hydrogen 3.009 N/A ASN 24.A N CYS 22.A O no hydrogen 2.868 N/A ASN 24.A ND2 GLN 21.A O no hydrogen 3.437 N/A CYS 27.A N ASN 24.A O no hydrogen 3.410 N/A CYS 27.A SG CYS 22.A O no hydrogen 3.146 N/A CYS 27.A SG ASN 24.A O no hydrogen 3.811 N/A CYS 27.A SG ASN 24.A OD1 no hydrogen 3.259 N/A GLY 28.A N HIS 25.A O no hydrogen 3.071 N/A TRP 29.A N ASN 24.A O no hydrogen 2.927 N/A TRP 29.A NE1 ASP 40.A OD1 no hydrogen 3.015 N/A GLY 31.A N CYS 27.A O no hydrogen 2.716 N/A GLY 32.A N TRP 29.A O no hydrogen 3.249 N/A ASP 33.A N ASP 30.A O no hydrogen 3.173 N/A CYS 34.A N TRP 29.A O no hydrogen 3.012 N/A CYS 34.A SG SER 19.A O no hydrogen 3.674 N/A SER 35.A N GLY 32.A O no hydrogen 3.167 N/A SER 35.A OG PHE 38.A O no hydrogen 2.986 N/A PHE 38.A N SER 35.A O no hydrogen 3.101 N/A TRP 42.A N ASP 40.A OD1 no hydrogen 3.171 N/A LYS 43.A N ASP 40.A O no hydrogen 2.913 N/A CYS 45.A N TRP 42.A O no hydrogen 3.077 N/A GLN 47.A N GLN 47.A OE1 no hydrogen 2.605 N/A LEU 49.A N THR 46.A O no hydrogen 3.353 N/A GLN 50.A N GLN 47.A O no hydrogen 3.057 N/A LYS 53.A N GLN 50.A O no hydrogen 2.975 N/A LYS 53.A NZ GLN 50.A OE1 no hydrogen 2.639 N/A TYR 54.A N CYS 51.A O no hydrogen 3.072 N/A SER 56.A N ASP 72.A O no hydrogen 3.226 N/A ASP 57.A N ASP 75.A OD2 no hydrogen 2.884 N/A GLY 58.A N ASP 75.A OD1 no hydrogen 2.951 N/A HIS 59.A N ASP 57.A OD1 no hydrogen 3.252 N/A HIS 59.A ND1 ASP 61.A OD1 no hydrogen 2.898 N/A ASP 61.A N ASP 72.A OD2 no hydrogen 2.868 N/A CYS 64.A N ASP 61.A O no hydrogen 3.047 N/A CYS 64.A SG LEU 49.A O no hydrogen 3.773 N/A ASN 65.A N SER 62.A O no hydrogen 3.162 N/A CYS 69.A N SER 66.A OG no hydrogen 3.125 N/A CYS 69.A SG SER 66.A OG no hydrogen 3.628 N/A LEU 70.A N ALA 67.A O no hydrogen 3.107 N/A PHE 71.A N SER 66.A O no hydrogen 2.775 N/A ASP 72.A N CYS 69.A O no hydrogen 3.409 N/A GLY 73.A N LEU 70.A O no hydrogen 3.049 N/A PHE 74.A N PHE 71.A O no hydrogen 2.854 N/A ASP 75.A N ASP 72.A O no hydrogen 3.185 N/A GLN 77.A N PHE 74.A O no hydrogen 3.250 N/A CYS 83.A N GLN 82.A OE1 no hydrogen 3.093 N/A LEU 86.A N ASN 84.A OD1 no hydrogen 3.268 N/A TYR 87.A N ASN 84.A O no hydrogen 2.902 N/A ASP 88.A N PRO 85.A O no hydrogen 3.439 N/A TYR 90.A OH ASP 101.A OD1 no hydrogen 2.725 N/A CYS 91.A N TYR 87.A O no hydrogen 3.131 N/A CYS 91.A SG TYR 87.A O no hydrogen 3.172 N/A LYS 92.A N ASP 88.A O no hydrogen 2.747 N/A ASP 93.A N GLN 89.A O no hydrogen 2.927 N/A HIS 94.A N CYS 91.A O no hydrogen 3.281 N/A HIS 94.A ND1 TYR 90.A O no hydrogen 2.608 N/A SER 96.A N ASP 112.A O no hydrogen 3.127 N/A ASP 97.A N ASP 115.A OD2 no hydrogen 2.894 N/A GLY 98.A N ASP 115.A OD1 no hydrogen 3.229 N/A HIS 99.A N ASP 97.A OD1 no hydrogen 3.140 N/A CYS 100.A SG GLN 102.A OE1 no hydrogen 3.567 N/A ASP 101.A N ASP 112.A OD2 no hydrogen 2.747 N/A CYS 104.A N ASP 101.A O no hydrogen 2.814 N/A ASN 105.A N GLN 102.A O no hydrogen 3.024 N/A SER 106.A N CYS 104.A O no hydrogen 2.837 N/A GLU 108.A N GLU 108.A OE2 no hydrogen 2.754 N/A CYS 109.A N SER 106.A OG no hydrogen 3.208 N/A CYS 109.A SG SER 106.A OG no hydrogen 3.350 N/A GLU 110.A N ALA 107.A O no hydrogen 3.127 N/A TRP 111.A N SER 106.A O no hydrogen 2.675 N/A ASP 112.A N CYS 109.A O no hydrogen 3.301 N/A GLY 113.A N GLU 110.A O no hydrogen 3.062 N/A LEU 114.A N TRP 111.A O no hydrogen 2.955 N/A ASP 115.A N ASP 112.A O no hydrogen 3.355 N/A CYS 116.A SG ASP 112.A OD2 no hydrogen 3.826 N/A ALA 117.A N LEU 114.A O no hydrogen 3.299 N/A ALA 125.A N ILE 187.A O no hydrogen 2.738 N/A ALA 126.A N GLN 198.A O no hydrogen 3.078 N/A THR 128.A N GLU 228.A O no hydrogen 2.833 N/A THR 128.A OG1 GLU 186.A OE2 no hydrogen 3.302 N/A LEU 129.A N LEU 185.A O no hydrogen 2.950 N/A VAL 130.A N GLN 226.A O no hydrogen 2.886 N/A VAL 131.A N VAL 183.A O no hydrogen 2.901 N/A VAL 132.A N ALA 224.A O no hydrogen 2.835 N/A VAL 133.A N SER 181.A O no hydrogen 2.955 N/A LEU 134.A N LYS 221.A O no hydrogen 2.610 N/A MET 135.A N VAL 133.A O no hydrogen 2.870 N/A LEU 140.A N PRO 136.A O no hydrogen 3.088 N/A ARG 141.A N PRO 137.A O no hydrogen 2.916 N/A ARG 141.A NH1 GLU 138.A OE2 no hydrogen 3.178 N/A ASN 142.A N GLU 138.A O no hydrogen 2.875 N/A SER 143.A N GLN 139.A O no hydrogen 2.984 N/A SER 143.A OG GLN 139.A O no hydrogen 3.110 N/A SER 144.A OG ARG 141.A O no hydrogen 3.358 N/A PHE 147.A N SER 143.A O no hydrogen 3.039 N/A LEU 148.A N SER 144.A O no hydrogen 3.168 N/A ARG 149.A N PHE 145.A O no hydrogen 2.973 N/A ARG 149.A NH1 ASP 88.A OD1 no hydrogen 3.406 N/A ARG 149.A NH2 ASP 88.A OD1 no hydrogen 3.454 N/A GLU 150.A N HIS 146.A O no hydrogen 2.976 N/A LEU 151.A N PHE 147.A O no hydrogen 2.984 N/A SER 152.A N LEU 148.A O no hydrogen 2.761 N/A SER 152.A OG LEU 148.A O no hydrogen 2.718 N/A SER 152.A OG THR 157.A O no hydrogen 3.401 N/A ARG 153.A N ARG 149.A O no hydrogen 2.890 N/A ARG 153.A NH1 ASN 217.A OD1 no hydrogen 3.512 N/A ARG 153.A NH2 GLU 150.A OE1 no hydrogen 3.074 N/A ARG 153.A NH2 ASN 217.A O no hydrogen 2.986 N/A ARG 153.A NH2 ASN 217.A OD1 no hydrogen 3.476 N/A VAL 154.A N GLU 150.A O no hydrogen 3.391 N/A LEU 155.A N LEU 151.A O no hydrogen 3.131 N/A THR 157.A N SER 152.A O no hydrogen 3.368 N/A THR 157.A OG1 ASP 188.A O no hydrogen 3.132 N/A THR 157.A OG1 ASN 189.A OD1 no hydrogen 3.078 N/A VAL 159.A N SER 152.A OG no hydrogen 3.080 N/A VAL 160.A N GLU 186.A O no hydrogen 2.932 N/A LYS 162.A N TYR 184.A O no hydrogen 2.808 N/A ARG 163.A NH1 GLY 167.A O no hydrogen 2.961 N/A ASP 164.A N GLN 168.A O no hydrogen 2.656 N/A GLY 167.A N ASP 164.A O no hydrogen 2.982 N/A MET 170.A N LYS 162.A O no hydrogen 2.873 N/A ILE 171.A N GLN 169.A O no hydrogen 2.801 N/A PHE 172.A N ILE 182.A O no hydrogen 2.799 N/A TYR 174.A N GLY 180.A O no hydrogen 2.883 N/A ASP 177.A N TYR 174.A O no hydrogen 2.880 N/A GLY 180.A N ASP 177.A O no hydrogen 3.117 N/A SER 181.A N VAL 133.A O no hydrogen 2.970 N/A SER 181.A OG MET 135.A O no hydrogen 2.677 N/A ILE 182.A N PHE 172.A O no hydrogen 2.765 N/A VAL 183.A N VAL 131.A O no hydrogen 2.889 N/A TYR 184.A N MET 170.A O no hydrogen 3.176 N/A LEU 185.A N LEU 129.A O no hydrogen 2.744 N/A GLU 186.A N VAL 160.A O no hydrogen 2.690 N/A ASP 188.A N ASN 158.A O no hydrogen 3.053 N/A ASN 189.A N ARG 123.A O no hydrogen 2.564 N/A ASN 189.A ND2 PHE 197.A O no hydrogen 3.330 N/A ARG 190.A N ASP 188.A OD1 no hydrogen 2.848 N/A ARG 190.A NE ASP 188.A OD1 no hydrogen 3.536 N/A ARG 190.A NE ASP 188.A OD2 no hydrogen 3.277 N/A ARG 190.A NH1 ALA 117.A O no hydrogen 3.147 N/A ARG 190.A NH1 GLU 118.A O no hydrogen 2.986 N/A ARG 190.A NH2 ASP 188.A OD2 no hydrogen 3.355 N/A VAL 193.A N ASN 189.A O no hydrogen 3.467 N/A ALA 200.A N ALA 126.A O no hydrogen 2.972 N/A THR 201.A OG1 SER 227.A OG no hydrogen 2.855 N/A ASP 202.A N SER 199.A OG no hydrogen 3.404 N/A VAL 203.A N SER 199.A O no hydrogen 3.302 N/A ALA 204.A N ALA 200.A O no hydrogen 2.951 N/A ALA 205.A N THR 201.A O no hydrogen 3.057 N/A PHE 206.A N ASP 202.A O no hydrogen 3.090 N/A LEU 207.A N VAL 203.A O no hydrogen 3.191 N/A GLY 208.A N ALA 204.A O no hydrogen 3.002 N/A ALA 209.A N ALA 205.A O no hydrogen 2.889 N/A LEU 210.A N PHE 206.A O no hydrogen 3.050 N/A ALA 211.A N LEU 207.A O no hydrogen 2.912 N/A SER 212.A N GLY 208.A O no hydrogen 2.878 N/A SER 212.A OG GLY 208.A O no hydrogen 3.555 N/A SER 212.A OG ALA 209.A O no hydrogen 2.805 N/A LEU 213.A N LEU 210.A O no hydrogen 3.265 N/A GLY 214.A N ALA 211.A O no hydrogen 2.966 N/A SER 215.A N LEU 210.A O no hydrogen 2.702 N/A SER 215.A OG LEU 213.A O no hydrogen 3.480 N/A ILE 218.A N LEU 216.A O no hydrogen 2.966 N/A TYR 220.A OH HIS 146.A ND1 no hydrogen 3.097 N/A GLU 223.A N VAL 132.A O no hydrogen 2.911 N/A ALA 224.A N VAL 132.A O no hydrogen 3.377 N/A VAL 225.A N LEU 36.A O no hydrogen 3.212 N/A GLN 226.A N VAL 130.A O no hydrogen 2.753 N/A SER 227.A OG THR 201.A OG1 no hydrogen 2.855 N/A GLU 228.A N THR 128.A O no hydrogen 2.894 N/A