Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3bze_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 2.A ND1 ASP 28.A OD2 no hydrogen 2.909 N/A SER 3.A N ASP 28.A OD1 no hydrogen 2.853 N/A SER 3.A OG ASP 28.A OD1 no hydrogen 3.499 N/A LEU 4.A N CYS 100.A O no hydrogen 2.993 N/A LYS 5.A N TYR 26.A O no hydrogen 3.030 N/A LYS 5.A NZ SER 3.A OG no hydrogen 3.393 N/A TYR 6.A N HIS 98.A O no hydrogen 2.967 N/A PHE 7.A N VAL 24.A O no hydrogen 2.884 N/A HIS 8.A N TRP 96.A O no hydrogen 2.810 N/A HIS 8.A ND1 SER 23.A OG no hydrogen 3.106 N/A HIS 8.A NE2 HIS 98.A NE2 no hydrogen 2.816 N/A THR 9.A N ILE 22.A O no hydrogen 2.827 N/A SER 10.A N LEU 94.A O no hydrogen 3.019 N/A VAL 11.A N ARG 20.A O no hydrogen 2.831 N/A SER 12.A N HIS 92.A O no hydrogen 3.087 N/A SER 12.A OG HIS 92.A O no hydrogen 3.528 N/A ARG 13.A NH1 ASP 38.A OD1 no hydrogen 2.724 N/A ARG 13.A NH2 ASP 38.A OD1 no hydrogen 2.754 N/A GLY 17.A N GLY 15.A O no hydrogen 2.691 N/A ARG 20.A N VAL 11.A O no hydrogen 2.859 N/A PHE 21.A N ASN 37.A OD1 no hydrogen 2.975 N/A ILE 22.A N THR 9.A O no hydrogen 2.832 N/A SER 23.A N PHE 35.A O no hydrogen 2.903 N/A SER 23.A OG HIS 8.A ND1 no hydrogen 3.106 N/A VAL 24.A N PHE 7.A O no hydrogen 3.022 N/A GLY 25.A N VAL 33.A O no hydrogen 3.133 N/A TYR 26.A N LYS 5.A O no hydrogen 2.763 N/A VAL 27.A N THR 30.A O no hydrogen 2.871 N/A ASP 28.A N SER 3.A O no hydrogen 3.009 N/A THR 30.A N VAL 27.A O no hydrogen 2.979 N/A THR 30.A OG1 TYR 208.A OH no hydrogen 2.730 N/A GLN 31.A NE2 VAL 33.A O no hydrogen 3.049 N/A PHE 32.A N GLY 25.A O no hydrogen 2.967 N/A ARG 34.A N VAL 45.A O no hydrogen 3.368 N/A PHE 35.A N SER 23.A O no hydrogen 2.826 N/A ASN 37.A N PHE 21.A O no hydrogen 3.196 N/A ASN 37.A ND2 GLU 18.A OE1 no hydrogen 3.226 N/A ASN 37.A ND2 PRO 19.A O no hydrogen 3.197 N/A ASP 38.A N ASP 36.A OD1 no hydrogen 2.564 N/A ALA 39.A N ASP 36.A O no hydrogen 3.171 N/A MET 44.A N THR 63.A OG1 no hydrogen 3.061 N/A VAL 45.A N ARG 34.A O no hydrogen 2.951 N/A ARG 47.A N PHE 32.A O no hydrogen 2.950 N/A MET 51.A N ALA 48.A O no hydrogen 3.135 N/A GLU 52.A N PRO 49.A O no hydrogen 3.267 N/A TYR 58.A N GLY 55.A O no hydrogen 3.106 N/A TYR 58.A OH TYR 170.A OH no hydrogen 2.401 N/A TRP 59.A N GLY 55.A O no hydrogen 3.353 N/A ASP 60.A N SER 56.A O no hydrogen 2.721 N/A ARG 61.A N GLU 57.A O no hydrogen 3.361 N/A GLU 62.A N TYR 58.A O no hydrogen 3.112 N/A THR 63.A N TRP 59.A O no hydrogen 2.909 N/A THR 63.A OG1 TRP 59.A O no hydrogen 2.608 N/A ARG 64.A N ASP 60.A O no hydrogen 2.826 N/A SER 65.A N ARG 61.A O no hydrogen 2.840 N/A ALA 66.A N GLU 62.A O no hydrogen 2.825 N/A ARG 67.A N THR 63.A O no hydrogen 2.912 N/A ASP 68.A N ARG 64.A O no hydrogen 2.920 N/A THR 69.A N SER 65.A O no hydrogen 3.002 N/A THR 69.A OG1 SER 65.A O no hydrogen 2.877 N/A ALA 70.A N ALA 66.A O no hydrogen 2.950 N/A GLN 71.A N ARG 67.A O no hydrogen 3.085 N/A ILE 72.A N ASP 68.A O no hydrogen 3.027 N/A PHE 73.A N THR 69.A O no hydrogen 2.834 N/A ARG 74.A N ALA 70.A O no hydrogen 2.953 N/A ARG 74.A N GLN 71.A O no hydrogen 3.130 N/A VAL 75.A N GLN 71.A O no hydrogen 3.186 N/A ASN 76.A N ILE 72.A O no hydrogen 2.721 N/A LEU 77.A N PHE 73.A O no hydrogen 2.969 N/A LEU 77.A N ARG 74.A O no hydrogen 3.154 N/A ARG 78.A N ARG 74.A O no hydrogen 3.405 N/A ARG 78.A N VAL 75.A O no hydrogen 3.113 N/A THR 79.A N VAL 75.A O no hydrogen 3.043 N/A THR 79.A OG1 VAL 75.A O no hydrogen 3.168 N/A LEU 80.A N ASN 76.A O no hydrogen 2.731 N/A ARG 81.A N LEU 77.A O no hydrogen 2.975 N/A GLY 82.A N ARG 78.A O no hydrogen 3.082 N/A TYR 83.A N THR 79.A O no hydrogen 3.137 N/A TYR 84.A N LEU 80.A O no hydrogen 3.217 N/A ASN 85.A N GLY 82.A O no hydrogen 3.446 N/A GLN 86.A N ARG 81.A O no hydrogen 3.124 N/A GLN 86.A NE2 TYR 117.A OH no hydrogen 2.343 N/A ALA 89.A N SER 87.A OG no hydrogen 3.058 N/A SER 91.A OG SER 12.A O no hydrogen 2.976 N/A HIS 92.A N SER 12.A OG no hydrogen 2.814 N/A HIS 92.A ND1 ASP 118.A OD2 no hydrogen 2.965 N/A THR 93.A N ASP 118.A OD1 no hydrogen 3.013 N/A LEU 94.A N SER 10.A O no hydrogen 2.999 N/A GLN 95.A N ALA 116.A O no hydrogen 2.751 N/A TRP 96.A N HIS 8.A O no hydrogen 2.995 N/A MET 97.A N GLN 114.A O no hydrogen 3.070 N/A HIS 98.A N TYR 6.A O no hydrogen 3.354 N/A GLY 99.A N TYR 112.A O no hydrogen 3.074 N/A CYS 100.A N LEU 4.A O no hydrogen 3.232 N/A GLU 101.A N ARG 110.A O no hydrogen 2.818 N/A LEU 102.A N HIS 2.A O no hydrogen 2.642 N/A GLY 103.A N ARG 107.A O no hydrogen 2.854 N/A ARG 106.A N GLY 103.A O no hydrogen 2.501 N/A LEU 109.A N GLU 101.A O no hydrogen 2.716 N/A ARG 110.A N GLU 101.A O no hydrogen 3.336 N/A ARG 110.A NH1 GLU 101.A OE2 no hydrogen 3.539 N/A TYR 112.A N GLY 99.A O no hydrogen 2.932 N/A GLN 114.A N MET 97.A O no hydrogen 3.126 N/A PHE 115.A N LEU 123.A O no hydrogen 2.761 N/A ALA 116.A N GLN 95.A O no hydrogen 2.836 N/A TYR 117.A N LYS 120.A O no hydrogen 2.924 N/A ASP 118.A N THR 93.A O no hydrogen 2.596 N/A LYS 120.A N TYR 117.A O no hydrogen 2.876 N/A LYS 120.A NZ ASP 136.A OD2 no hydrogen 2.913 N/A TYR 122.A N PHE 115.A O no hydrogen 2.926 N/A TYR 122.A OH SER 142.A OG no hydrogen 2.864 N/A THR 124.A N THR 133.A O no hydrogen 3.055 N/A LEU 125.A N GLU 113.A O no hydrogen 2.947 N/A ASN 126.A N SER 131.A O no hydrogen 2.966 N/A ASN 126.A ND2 SER 131.A O no hydrogen 2.968 N/A ASN 126.A ND2 SER 131.A OG no hydrogen 2.786 N/A LEU 129.A N ASN 126.A O no hydrogen 2.678 N/A ARG 130.A N ASP 128.A OD2 no hydrogen 2.844 N/A TRP 132.A N ASN 147.A OD1 no hydrogen 2.587 N/A THR 133.A N THR 124.A O no hydrogen 2.805 N/A THR 133.A OG1 ASN 126.A OD1 no hydrogen 2.767 N/A ALA 134.A N GLU 143.A OE1 no hydrogen 2.779 N/A VAL 135.A N TYR 122.A O no hydrogen 3.023 N/A ASP 136.A N TYR 122.A O no hydrogen 3.362 N/A ALA 138.A N ASP 136.A OD1 no hydrogen 2.853 N/A ALA 139.A N ASP 136.A O no hydrogen 2.514 N/A GLN 140.A N THR 137.A O no hydrogen 3.496 N/A SER 142.A N ALA 139.A O no hydrogen 2.965 N/A SER 142.A OG TYR 122.A OH no hydrogen 2.864 N/A GLU 143.A N ALA 139.A O no hydrogen 3.008 N/A GLN 144.A N GLN 140.A O no hydrogen 3.215 N/A LYS 145.A N ILE 141.A O no hydrogen 3.167 N/A SER 146.A N SER 142.A O no hydrogen 2.905 N/A SER 146.A OG SER 142.A O no hydrogen 2.992 N/A ASN 147.A N GLU 143.A O no hydrogen 2.813 N/A ASN 147.A ND2 TRP 132.A O no hydrogen 3.187 N/A ASP 148.A N GLN 144.A O no hydrogen 2.843 N/A ALA 149.A N LYS 145.A O no hydrogen 3.197 N/A SER 150.A N ASN 147.A O no hydrogen 2.900 N/A SER 150.A OG GLU 153.A OE1 no hydrogen 3.290 N/A GLU 151.A N SER 146.A O no hydrogen 3.040 N/A ARG 156.A N ALA 152.A O no hydrogen 2.660 N/A ARG 156.A NE GLU 160.A OE1 no hydrogen 3.248 N/A ALA 157.A N GLU 153.A O no hydrogen 2.891 N/A TYR 158.A N HIS 154.A O no hydrogen 3.239 N/A LEU 159.A N GLN 155.A O no hydrogen 2.888 N/A GLU 160.A N ARG 156.A O no hydrogen 2.877 N/A ASP 161.A N ALA 157.A O no hydrogen 2.785 N/A CYS 163.A N TYR 158.A O no hydrogen 2.710 N/A CYS 163.A SG LEU 4.A O no hydrogen 3.778 N/A GLU 165.A N ASP 161.A O no hydrogen 2.851 N/A TRP 166.A N THR 162.A O no hydrogen 2.972 N/A LEU 167.A N CYS 163.A O no hydrogen 2.845 N/A HIS 168.A N VAL 164.A O no hydrogen 3.164 N/A HIS 168.A NE2 ARG 106.A O no hydrogen 2.932 N/A LYS 169.A N GLU 165.A O no hydrogen 3.279 N/A LYS 169.A NZ GLU 165.A OE2 no hydrogen 2.810 N/A TYR 170.A N TRP 166.A O no hydrogen 2.714 N/A TYR 170.A OH TYR 58.A OH no hydrogen 2.401 N/A LEU 171.A N LEU 167.A O no hydrogen 3.091 N/A GLU 172.A N HIS 168.A O no hydrogen 3.163 N/A LYS 173.A N LYS 169.A O no hydrogen 3.039 N/A LYS 173.A NZ GLU 54.A OE1 no hydrogen 2.882 N/A GLY 174.A N TYR 170.A O no hydrogen 2.918 N/A THR 177.A N GLY 174.A O no hydrogen 3.127 N/A THR 177.A N GLU 176.A OE1 no hydrogen 3.192 N/A THR 177.A OG1 GLY 174.A O no hydrogen 2.841 N/A LEU 179.A N LYS 175.A O no hydrogen 3.122 N/A HIS 180.A N THR 177.A O no hydrogen 2.666 N/A HIS 180.A NE2 GLU 182.A OE1 no hydrogen 3.075 N/A GLU 182.A N TYR 208.A O no hydrogen 3.004 N/A LYS 185.A N LEU 205.A O no hydrogen 2.928 N/A LYS 185.A NZ GLU 182.A OE2 no hydrogen 2.928 N/A THR 189.A N ARG 201.A O no hydrogen 2.567 N/A THR 189.A OG1 HIS 191.A NE2 no hydrogen 3.427 N/A THR 189.A OG1 ARG 201.A O no hydrogen 2.959 N/A HIS 191.A N THR 199.A O no hydrogen 2.914 N/A ILE 193.A N GLU 197.A O no hydrogen 3.215 N/A SER 194.A N GLU 197.A O no hydrogen 3.331 N/A HIS 196.A N SER 194.A OG no hydrogen 3.196 N/A GLU 197.A N SER 194.A OG no hydrogen 3.158 N/A ALA 198.A N VAL 248.A O no hydrogen 2.966 N/A THR 199.A N HIS 191.A O no hydrogen 2.681 N/A THR 199.A OG1 VAL 246.A O no hydrogen 3.453 N/A LEU 200.A N VAL 246.A O no hydrogen 2.710 N/A ARG 201.A N THR 189.A O no hydrogen 2.927 N/A CYS 202.A N ALA 244.A O no hydrogen 2.982 N/A TRP 203.A N HIS 187.A O no hydrogen 2.572 N/A TRP 203.A NE1 THR 189.A OG1 no hydrogen 3.062 N/A ALA 204.A N LYS 242.A O no hydrogen 3.023 N/A LEU 205.A N LYS 185.A O no hydrogen 2.981 N/A PHE 207.A N PHE 240.A O no hydrogen 3.133 N/A TYR 208.A N GLU 182.A O no hydrogen 2.844 N/A TYR 208.A OH THR 30.A OG1 no hydrogen 2.730 N/A ALA 210.A N ASP 29.A OD2 no hydrogen 2.882 N/A THR 213.A N GLN 261.A O no hydrogen 2.862 N/A THR 215.A N HIS 259.A O no hydrogen 2.984 N/A THR 215.A OG1 HIS 259.A O no hydrogen 3.333 N/A TRP 216.A NE1 ALA 244.A O no hydrogen 2.812 N/A GLN 217.A N THR 257.A O no hydrogen 2.924 N/A GLY 222.A N GLY 220.A O no hydrogen 3.143 N/A GLU 228.A N ALA 245.A O no hydrogen 2.795 N/A ARG 233.A N GLN 241.A O no hydrogen 2.952 N/A ARG 233.A NE GLN 241.A OE1 no hydrogen 3.063 N/A ARG 233.A NH2 GLN 241.A OE1 no hydrogen 3.250 N/A ALA 235.A N THR 239.A O no hydrogen 2.864 N/A THR 239.A N ASP 237.A OD1 no hydrogen 2.923 N/A THR 239.A OG1 ASP 237.A OD1 no hydrogen 2.531 N/A PHE 240.A N PHE 207.A O no hydrogen 2.845 N/A GLN 241.A N ARG 233.A O no hydrogen 2.772 N/A LYS 242.A N ALA 204.A O no hydrogen 3.049 N/A LYS 242.A NZ VAL 230.A O no hydrogen 2.874 N/A LYS 242.A NZ THR 232.A OG1 no hydrogen 2.976 N/A ALA 244.A N CYS 202.A O no hydrogen 3.260 N/A ALA 245.A N GLU 228.A O no hydrogen 2.894 N/A VAL 246.A N LEU 200.A O no hydrogen 2.932 N/A VAL 248.A N ALA 198.A O no hydrogen 2.729 N/A SER 250.A N HIS 196.A O no hydrogen 2.611 N/A SER 250.A OG ASP 195.A O no hydrogen 3.435 N/A GLU 252.A N PRO 249.A O no hydrogen 2.823 N/A GLU 253.A N GLU 253.A OE1 no hydrogen 2.584 N/A ARG 255.A N GLU 252.A O no hydrogen 3.174 N/A TYR 256.A N GLU 253.A O no hydrogen 2.921 N/A THR 257.A N GLN 217.A O no hydrogen 2.849 N/A THR 257.A OG1 GLN 217.A O no hydrogen 3.028 N/A CYS 258.A N LEU 271.A O no hydrogen 2.745 N/A HIS 259.A N THR 215.A O no hydrogen 2.853 N/A VAL 260.A N VAL 269.A O no hydrogen 2.917 N/A GLN 261.A N THR 213.A O no hydrogen 3.151 N/A HIS 262.A ND1 GLU 211.A O no hydrogen 2.710 N/A VAL 269.A N VAL 260.A O no hydrogen 3.195 N/A LEU 271.A N CYS 258.A O no hydrogen 2.901 N/A