Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3blr_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 1.A N ASN 1.A OD1 no hydrogen 2.561 N/A TYR 5.A N LYS 2.A O no hydrogen 3.480 N/A PHE 6.A N LEU 181.A O no hydrogen 2.741 N/A THR 7.A N GLN 10.A OE1 no hydrogen 3.066 N/A THR 7.A OG1 GLN 10.A OE1 no hydrogen 3.158 N/A GLN 10.A N THR 7.A OG1 no hydrogen 3.223 N/A LEU 11.A N THR 7.A O no hydrogen 3.014 N/A GLU 12.A N ARG 8.A O no hydrogen 3.081 N/A ASN 13.A N GLU 9.A O no hydrogen 3.056 N/A SER 14.A N GLU 12.A O no hydrogen 2.897 N/A SER 14.A OG GLU 26.A OE1 no hydrogen 2.959 N/A SER 14.A OG GLU 26.A OE2 no hydrogen 2.946 N/A ARG 17.A N SER 14.A OG no hydrogen 3.119 N/A ARG 17.A NH1 GLU 26.A OE1 no hydrogen 2.743 N/A ARG 17.A NH2 VAL 21.A O no hydrogen 2.955 N/A ARG 17.A NH2 GLU 26.A OE1 no hydrogen 2.866 N/A ARG 18.A N SER 14.A O no hydrogen 3.280 N/A PHE 19.A N SER 16.A O no hydrogen 3.173 N/A GLY 20.A N ARG 17.A O no hydrogen 2.910 N/A GLU 26.A N ASP 22.A O no hydrogen 2.979 N/A LEU 27.A N PRO 23.A O no hydrogen 3.288 N/A SER 28.A N ASP 24.A O no hydrogen 3.262 N/A TYR 29.A N LYS 25.A O no hydrogen 2.923 N/A ARG 30.A N GLU 26.A O no hydrogen 3.210 N/A ARG 30.A NH1 HIS 59.A ND1 no hydrogen 3.063 N/A ARG 30.A NH1 HIS 59.A O no hydrogen 3.247 N/A ARG 30.A NH2 GLU 26.A OE2 no hydrogen 3.219 N/A GLN 31.A N LEU 27.A O no hydrogen 3.085 N/A GLN 31.A NE2 LEU 176.A O no hydrogen 3.035 N/A GLN 32.A N SER 28.A O no hydrogen 2.856 N/A ALA 33.A N TYR 29.A O no hydrogen 3.059 N/A ALA 34.A N ARG 30.A O no hydrogen 2.955 N/A ASN 35.A N GLN 31.A O no hydrogen 3.004 N/A LEU 36.A N GLN 32.A O no hydrogen 2.976 N/A LEU 37.A N ALA 33.A O no hydrogen 2.900 N/A GLN 38.A N ALA 34.A O no hydrogen 2.834 N/A GLN 38.A NE2 GLN 42.A OE1 no hydrogen 2.899 N/A GLN 38.A NE2 GLN 48.A OE1 no hydrogen 2.816 N/A ASP 39.A N ASN 35.A O no hydrogen 2.870 N/A MET 40.A N LEU 36.A O no hydrogen 2.976 N/A GLY 41.A N LEU 37.A O no hydrogen 2.810 N/A GLN 42.A N GLN 38.A O no hydrogen 3.066 N/A ARG 43.A N ASP 39.A O no hydrogen 3.252 N/A ARG 43.A NE ASP 39.A OD1 no hydrogen 3.087 N/A ARG 43.A NH2 ASP 39.A OD1 no hydrogen 3.525 N/A ARG 43.A NH2 ASP 39.A OD2 no hydrogen 3.215 N/A LEU 44.A N MET 40.A O no hydrogen 2.883 N/A ASN 45.A N GLN 42.A O no hydrogen 3.250 N/A VAL 46.A N GLY 41.A O no hydrogen 3.103 N/A SER 47.A N GLN 89.A OE1 no hydrogen 2.969 N/A SER 47.A OG THR 50.A OG1 no hydrogen 3.375 N/A SER 47.A OG GLN 89.A OE1 no hydrogen 3.546 N/A GLN 48.A NE2 GLN 38.A OE1 no hydrogen 2.974 N/A GLN 48.A NE2 GLN 48.A O no hydrogen 3.439 N/A GLN 48.A NE2 ASN 52.A OD1 no hydrogen 2.866 N/A THR 50.A N SER 47.A OG no hydrogen 3.227 N/A THR 50.A OG1 SER 47.A OG no hydrogen 3.375 N/A THR 50.A OG1 GLN 89.A OE1 no hydrogen 2.475 N/A ILE 51.A N SER 47.A O no hydrogen 3.118 N/A ASN 52.A N GLN 48.A O no hydrogen 2.852 N/A THR 53.A N LEU 49.A O no hydrogen 2.938 N/A THR 53.A OG1 LEU 49.A O no hydrogen 3.173 N/A THR 53.A OG1 GLU 87.A OE2 no hydrogen 2.974 N/A THR 53.A OG1 HIS 144.A NE2 no hydrogen 2.941 N/A ALA 54.A N THR 50.A O no hydrogen 3.010 N/A ILE 55.A N ILE 51.A O no hydrogen 2.841 N/A VAL 56.A N ASN 52.A O no hydrogen 3.033 N/A TYR 57.A N THR 53.A O no hydrogen 2.954 N/A TYR 57.A OH LEU 140.A O no hydrogen 2.573 N/A MET 58.A N ALA 54.A O no hydrogen 2.936 N/A HIS 59.A N ILE 55.A O no hydrogen 2.797 N/A HIS 59.A NE2 LEU 174.A O no hydrogen 2.952 N/A ARG 60.A N VAL 56.A O no hydrogen 2.925 N/A PHE 61.A N TYR 57.A O no hydrogen 2.795 N/A TYR 62.A N MET 58.A O no hydrogen 3.106 N/A TYR 62.A OH PHE 70.A O no hydrogen 2.543 N/A MET 63.A N ARG 60.A O no hydrogen 2.970 N/A ILE 64.A N PHE 61.A O no hydrogen 3.258 N/A GLN 65.A N PHE 61.A O no hydrogen 2.795 N/A GLN 65.A NE2 THR 135.A OG1 no hydrogen 3.283 N/A SER 66.A OG THR 68.A OG1 no hydrogen 3.088 N/A PHE 67.A N SER 16.A OG no hydrogen 2.818 N/A THR 68.A N SER 66.A OG no hydrogen 2.897 N/A THR 68.A OG1 SER 66.A OG no hydrogen 3.088 N/A ARG 69.A N SER 66.A O no hydrogen 3.167 N/A PHE 70.A N SER 66.A O no hydrogen 2.926 N/A SER 74.A N PRO 71.A O no hydrogen 2.841 N/A VAL 75.A N PRO 71.A O no hydrogen 3.091 N/A ALA 76.A N GLY 72.A O no hydrogen 2.872 N/A ALA 79.A N VAL 75.A O no hydrogen 2.808 N/A LEU 80.A N ALA 76.A O no hydrogen 2.810 N/A PHE 81.A N PRO 77.A O no hydrogen 2.953 N/A LEU 82.A N ALA 78.A O no hydrogen 3.078 N/A ALA 83.A N ALA 79.A O no hydrogen 2.872 N/A ALA 84.A N LEU 80.A O no hydrogen 2.959 N/A LYS 85.A NZ GLU 129.A OE2 no hydrogen 2.928 N/A VAL 86.A N LEU 82.A O no hydrogen 2.893 N/A GLU 87.A N ALA 83.A O no hydrogen 2.750 N/A GLY 88.A N LYS 85.A O no hydrogen 3.480 N/A GLN 89.A N ALA 84.A O no hydrogen 2.848 N/A LYS 91.A NZ LEU 44.A O no hydrogen 3.107 N/A VAL 96.A N LYS 92.A O no hydrogen 2.949 N/A ILE 97.A N LEU 93.A O no hydrogen 3.115 N/A LYS 98.A N GLU 94.A O no hydrogen 2.898 N/A VAL 99.A N HIS 95.A O no hydrogen 3.129 N/A ALA 100.A N VAL 96.A O no hydrogen 2.874 N/A HIS 101.A N ILE 97.A O no hydrogen 2.974 N/A THR 102.A N LYS 98.A O no hydrogen 3.132 N/A CYS 103.A N VAL 99.A O no hydrogen 3.169 N/A CYS 103.A SG ASP 39.A OD2 no hydrogen 3.338 N/A CYS 103.A SG VAL 99.A O no hydrogen 3.317 N/A LEU 104.A N ALA 100.A O no hydrogen 3.084 N/A LEU 104.A N HIS 101.A O no hydrogen 3.163 N/A HIS 105.A N HIS 101.A O no hydrogen 2.730 N/A GLU 108.A N HIS 105.A O no hydrogen 3.049 N/A ARG 114.A N ASP 112.A OD1 no hydrogen 3.123 N/A SER 115.A N ASP 112.A O no hydrogen 2.942 N/A SER 115.A OG ASP 112.A O no hydrogen 2.693 N/A TYR 118.A N SER 115.A OG no hydrogen 3.296 N/A LEU 119.A N SER 115.A O no hydrogen 3.108 N/A GLN 120.A NE2 ASP 124.A OD1 no hydrogen 2.848 N/A GLN 121.A N ALA 117.A O no hydrogen 3.271 N/A VAL 122.A N TYR 118.A O no hydrogen 3.067 N/A GLN 123.A N LEU 119.A O no hydrogen 3.258 N/A ASP 124.A N GLN 120.A O no hydrogen 2.843 N/A LEU 125.A N VAL 122.A O no hydrogen 3.125 N/A VAL 126.A N VAL 122.A O no hydrogen 3.170 N/A ILE 127.A N GLN 123.A O no hydrogen 2.938 N/A LEU 128.A N ASP 124.A O no hydrogen 3.060 N/A GLU 129.A N LEU 125.A O no hydrogen 3.051 N/A SER 130.A N VAL 126.A O no hydrogen 3.234 N/A ILE 131.A N ILE 127.A O no hydrogen 3.003 N/A ILE 132.A N LEU 128.A O no hydrogen 2.749 N/A LEU 133.A N GLU 129.A O no hydrogen 2.958 N/A GLN 134.A N SER 130.A O no hydrogen 3.083 N/A THR 135.A N ILE 131.A O no hydrogen 2.896 N/A THR 135.A OG1 ILE 131.A O no hydrogen 2.764 N/A LEU 136.A N ILE 132.A O no hydrogen 2.891 N/A GLY 137.A N GLN 134.A O no hydrogen 2.978 N/A PHE 138.A N LEU 133.A O no hydrogen 2.899 N/A GLU 139.A N LEU 136.A O no hydrogen 3.150 N/A HIS 144.A NE2 THR 53.A OG1 no hydrogen 2.941 N/A HIS 146.A NE2 THR 171.A OG1 no hydrogen 2.959 N/A THR 147.A N HIS 144.A O no hydrogen 3.115 N/A HIS 148.A N PRO 145.A O no hydrogen 3.145 N/A HIS 148.A NE2 ASP 143.A OD2 no hydrogen 2.928 N/A VAL 149.A N HIS 146.A O no hydrogen 2.725 N/A CYS 152.A N VAL 149.A O no hydrogen 3.125 N/A CYS 152.A SG HIS 148.A O no hydrogen 3.607 N/A CYS 152.A SG VAL 149.A O no hydrogen 3.886 N/A THR 153.A N VAL 150.A O no hydrogen 3.457 N/A THR 153.A OG1 VAL 149.A O no hydrogen 2.931 N/A THR 153.A OG1 VAL 150.A O no hydrogen 3.306 N/A GLN 154.A N VAL 150.A O no hydrogen 3.452 N/A ARG 157.A N GLN 154.A O no hydrogen 3.333 N/A ALA 158.A N THR 153.A O no hydrogen 3.167 N/A ALA 163.A N SER 159.A O no hydrogen 3.224 N/A GLN 164.A N LYS 160.A O no hydrogen 2.991 N/A THR 165.A N ASP 161.A O no hydrogen 3.036 N/A THR 165.A OG1 ASP 161.A O no hydrogen 3.167 N/A SER 166.A N LEU 162.A O no hydrogen 3.076 N/A SER 166.A OG LEU 162.A O no hydrogen 3.059 N/A TYR 167.A N ALA 163.A O no hydrogen 3.118 N/A PHE 168.A N GLN 164.A O no hydrogen 3.195 N/A MET 169.A N THR 165.A O no hydrogen 2.894 N/A ALA 170.A N SER 166.A O no hydrogen 2.943 N/A THR 171.A N TYR 167.A O no hydrogen 2.831 N/A THR 171.A OG1 HIS 146.A NE2 no hydrogen 2.959 N/A THR 171.A OG1 TYR 167.A O no hydrogen 3.415 N/A ASN 172.A N PHE 168.A O no hydrogen 2.956 N/A ASN 172.A ND2 PHE 168.A O no hydrogen 2.805 N/A SER 173.A N MET 169.A O no hydrogen 2.902 N/A SER 173.A N ALA 170.A O no hydrogen 3.210 N/A SER 173.A OG ALA 170.A O no hydrogen 2.584 N/A HIS 175.A N THR 171.A O no hydrogen 3.434 N/A HIS 175.A ND1 THR 171.A O no hydrogen 2.966 N/A LEU 176.A N ASN 172.A O no hydrogen 2.917 N/A THR 177.A N SER 173.A O no hydrogen 2.906 N/A THR 177.A OG1 SER 173.A O no hydrogen 2.618 N/A PHE 179.A N THR 177.A OG1 no hydrogen 3.137 N/A LEU 181.A N THR 178.A O no hydrogen 2.880 N/A GLN 182.A N PHE 179.A O no hydrogen 2.907 N/A GLN 182.A NE2 THR 178.A OG1 no hydrogen 3.135 N/A TYR 183.A N PHE 179.A O no hydrogen 2.751 N/A VAL 188.A N THR 184.A O no hydrogen 3.059 N/A ALA 189.A N PRO 185.A O no hydrogen 2.923 N/A CYS 190.A N PRO 186.A O no hydrogen 3.201 N/A CYS 190.A SG PRO 186.A O no hydrogen 3.590 N/A VAL 191.A N VAL 187.A O no hydrogen 3.047 N/A CYS 192.A N VAL 188.A O no hydrogen 3.025 N/A CYS 192.A SG VAL 188.A O no hydrogen 3.349 N/A ILE 193.A N ALA 189.A O no hydrogen 2.983 N/A HIS 194.A N CYS 190.A O no hydrogen 2.708 N/A HIS 194.A NE2 ASP 227.A OD1 no hydrogen 2.958 N/A LEU 195.A N VAL 191.A O no hydrogen 3.053 N/A ALA 196.A N CYS 192.A O no hydrogen 2.963 N/A CYS 197.A N ILE 193.A O no hydrogen 2.828 N/A CYS 197.A SG ILE 193.A O no hydrogen 3.516 N/A LYS 198.A N HIS 194.A O no hydrogen 3.122 N/A TRP 199.A N LEU 195.A O no hydrogen 2.858 N/A TRP 199.A NE1 ILE 247.A O no hydrogen 2.974 N/A SER 200.A N ALA 196.A O no hydrogen 2.980 N/A SER 200.A OG ALA 196.A O no hydrogen 2.974 N/A ASN 201.A N LYS 198.A O no hydrogen 3.409 N/A TRP 202.A N CYS 197.A O no hydrogen 3.200 N/A SER 207.A N LYS 211.A O no hydrogen 3.205 N/A SER 207.A OG TYR 216.A OH no hydrogen 2.754 N/A THR 208.A OG1 ASP 209.A OD1 no hydrogen 3.062 N/A GLU 215.A N HIS 212.A O no hydrogen 3.026 N/A TYR 216.A OH SER 207.A OG no hydrogen 2.754 N/A ASP 218.A N TRP 214.A O no hydrogen 3.245 N/A THR 220.A OG1 ASP 218.A OD2 no hydrogen 3.052 N/A VAL 221.A N ASP 218.A O no hydrogen 3.159 N/A THR 222.A OG1 GLU 224.A OE1 no hydrogen 3.311 N/A LEU 225.A N THR 222.A O no hydrogen 2.895 N/A LEU 226.A N THR 222.A O no hydrogen 3.066 N/A ASP 227.A N LEU 223.A O no hydrogen 3.042 N/A LEU 229.A N LEU 225.A O no hydrogen 2.796 N/A THR 230.A N LEU 226.A O no hydrogen 2.961 N/A THR 230.A OG1 LEU 226.A O no hydrogen 2.805 N/A THR 230.A OG1 ASP 227.A O no hydrogen 3.383 N/A HIS 231.A N ASP 227.A O no hydrogen 3.185 N/A GLU 232.A N GLU 228.A O no hydrogen 3.142 N/A LEU 233.A N LEU 229.A O no hydrogen 2.921 N/A LEU 234.A N THR 230.A O no hydrogen 2.987 N/A GLN 235.A N HIS 231.A O no hydrogen 2.999 N/A ILE 236.A N GLU 232.A O no hydrogen 3.325 N/A LEU 237.A N LEU 233.A O no hydrogen 3.132 N/A GLU 238.A N LEU 234.A O no hydrogen 3.066 N/A LYS 239.A N ILE 236.A O no hydrogen 3.136 N/A THR 240.A N LEU 237.A O no hydrogen 3.228 N/A THR 240.A OG1 ILE 236.A O no hydrogen 2.800 N/A ARG 243.A N THR 240.A O no hydrogen 3.334 N/A ARG 243.A NE ASN 172.A OD1 no hydrogen 2.832 N/A ARG 246.A N ARG 243.A O no hydrogen 3.057 N/A ILE 247.A N LEU 244.A O no hydrogen 2.967 N/A TRP 248.A N LYS 245.A O no hydrogen 3.164 N/A ARG 251.A NH1 ASN 249.A OD1 no hydrogen 2.830 N/A