Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3uck_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 5.A OG ASP 3.A OD1 no hydrogen 3.258 N/A SER 5.A OG ASP 3.A OD2 no hydrogen 2.992 N/A LEU 8.A N LEU 4.A O no hydrogen 2.952 N/A GLU 9.A N SER 5.A O no hydrogen 2.981 N/A ALA 10.A N PRO 6.A O no hydrogen 3.121 N/A ASN 11.A N LEU 7.A O no hydrogen 3.019 N/A ARG 12.A N LEU 8.A O no hydrogen 2.823 N/A LYS 13.A N GLU 9.A O no hydrogen 2.869 N/A TRP 14.A N ALA 10.A O no hydrogen 2.997 N/A ALA 15.A N ASN 11.A O no hydrogen 2.869 N/A ASP 16.A N ARG 12.A O no hydrogen 2.841 N/A GLU 17.A N LYS 13.A O no hydrogen 3.170 N/A CYS 18.A N TRP 14.A O no hydrogen 3.194 N/A CYS 18.A SG TRP 14.A O no hydrogen 3.361 N/A ALA 19.A N ALA 15.A O no hydrogen 3.120 N/A ALA 20.A N ASP 16.A O no hydrogen 2.967 N/A LYS 21.A N GLU 17.A O no hydrogen 3.089 N/A ASP 22.A N CYS 18.A O no hydrogen 2.974 N/A THR 24.A N ASP 22.A OD2 no hydrogen 2.888 N/A THR 24.A OG1 ASP 22.A OD2 no hydrogen 3.056 N/A TYR 25.A N ASP 22.A O no hydrogen 3.367 N/A SER 27.A OG SER 23.A O no hydrogen 3.433 N/A LYS 28.A N THR 24.A O no hydrogen 2.928 N/A VAL 29.A N PHE 26.A O no hydrogen 2.833 N/A ALA 30.A N SER 27.A O no hydrogen 3.308 N/A GLU 36.A N GLU 59.A O no hydrogen 3.209 N/A TYR 37.A N GLU 59.A O no hydrogen 3.423 N/A LEU 38.A N HIS 92.A O no hydrogen 2.796 N/A TYR 39.A N PHE 61.A O no hydrogen 2.877 N/A ILE 40.A N LEU 94.A O no hydrogen 2.744 N/A GLY 41.A N GLN 63.A O no hydrogen 3.145 N/A CYS 42.A SG ASN 65.A O no hydrogen 3.668 N/A CYS 42.A SG HIS 98.A NE2 no hydrogen 3.451 N/A ALA 43.A N ASN 65.A O no hydrogen 2.757 N/A ARG 46.A N ASP 44.A OD1 no hydrogen 2.737 N/A ARG 46.A NE ASP 44.A OD1 no hydrogen 2.942 N/A ARG 46.A NE ASP 44.A OD2 no hydrogen 3.387 N/A ARG 46.A NH1 ASN 100.A OD1 no hydrogen 2.997 N/A ARG 46.A NH2 ASP 44.A OD2 no hydrogen 2.894 N/A ARG 46.A NH2 ASN 100.A O no hydrogen 3.396 N/A ARG 46.A NH2 ASN 100.A OD1 no hydrogen 3.355 N/A VAL 47.A N ASP 44.A O no hydrogen 2.998 N/A LEU 52.A N SER 48.A O no hydrogen 2.834 N/A PHE 53.A N PRO 49.A O no hydrogen 2.878 N/A ASN 54.A N GLN 51.A O no hydrogen 2.944 N/A MET 55.A N ALA 50.A O no hydrogen 2.717 N/A ALA 56.A N GLU 59.A OE1 no hydrogen 2.895 N/A GLU 59.A N ALA 56.A O no hydrogen 3.331 N/A PHE 61.A N TYR 37.A O no hydrogen 3.085 N/A GLN 63.A N TYR 39.A O no hydrogen 2.910 N/A GLN 63.A NE2 ASN 76.A OD1 no hydrogen 3.017 N/A ARG 64.A NE CYS 42.A O no hydrogen 2.916 N/A ARG 64.A NH2 CYS 42.A O no hydrogen 3.559 N/A ASN 65.A N GLY 41.A O no hydrogen 3.124 N/A ASN 65.A ND2 GLN 63.A OE1 no hydrogen 2.851 N/A ASN 65.A ND2 LEU 69.A O no hydrogen 3.144 N/A ASN 68.A N ASN 65.A O no hydrogen 3.161 N/A ASN 68.A ND2 ASN 68.A O no hydrogen 2.702 N/A LEU 69.A N ASN 65.A OD1 no hydrogen 2.791 N/A VAL 70.A N GLN 156.A OE1 no hydrogen 2.798 N/A LYS 73.A N SER 71.A OG no hydrogen 2.851 N/A ASP 74.A N SER 71.A O no hydrogen 3.040 N/A ASN 76.A N ASP 74.A OD2 no hydrogen 2.935 N/A CYS 77.A N ASP 74.A OD1 no hydrogen 3.232 N/A CYS 77.A SG LEU 69.A O no hydrogen 3.944 N/A MET 78.A N ASP 74.A O no hydrogen 2.951 N/A SER 79.A N LEU 75.A O no hydrogen 3.015 N/A CYS 80.A N ASN 76.A O no hydrogen 3.472 N/A CYS 80.A SG ASN 76.A O no hydrogen 3.710 N/A LEU 81.A N CYS 77.A O no hydrogen 2.960 N/A GLU 82.A N MET 78.A O no hydrogen 2.780 N/A TYR 83.A N SER 79.A O no hydrogen 3.016 N/A THR 84.A N CYS 80.A O no hydrogen 3.373 N/A THR 84.A OG1 CYS 80.A O no hydrogen 2.922 N/A THR 84.A OG1 LEU 81.A O no hydrogen 3.135 N/A VAL 85.A N LEU 81.A O no hydrogen 3.054 N/A ASP 86.A N GLU 82.A O no hydrogen 2.779 N/A HIS 87.A N TYR 83.A O no hydrogen 3.131 N/A LEU 88.A N TYR 83.A O no hydrogen 2.920 N/A ILE 90.A N THR 84.A O no hydrogen 2.796 N/A LYS 91.A N GLU 36.A O no hydrogen 2.728 N/A LYS 91.A NZ GLU 36.A OE1 no hydrogen 3.541 N/A HIS 92.A N GLU 36.A O no hydrogen 3.133 N/A HIS 92.A ND1 SER 177.A OG no hydrogen 2.942 N/A ILE 93.A N SER 177.A O no hydrogen 2.727 N/A LEU 94.A N LEU 38.A O no hydrogen 2.737 N/A VAL 95.A N HIS 179.A O no hydrogen 2.849 N/A CYS 96.A N ILE 40.A O no hydrogen 2.814 N/A CYS 96.A SG TYR 39.A OH no hydrogen 3.914 N/A CYS 96.A SG GLY 97.A O no hydrogen 3.388 N/A GLY 97.A N ILE 181.A O no hydrogen 3.046 N/A HIS 98.A ND1 TYR 99.A O no hydrogen 2.808 N/A TYR 99.A N TYR 183.A O no hydrogen 2.992 N/A TYR 99.A OH GLU 150.A OE1 no hydrogen 2.422 N/A LYS 105.A N CYS 101.A O no hydrogen 3.025 N/A ALA 106.A N GLY 102.A O no hydrogen 2.709 N/A GLY 107.A N ALA 103.A O no hydrogen 2.852 N/A LEU 108.A N CYS 104.A O no hydrogen 3.100 N/A VAL 109.A N LYS 105.A O no hydrogen 3.048 N/A TRP 110.A N ALA 106.A O no hydrogen 3.060 N/A LYS 113.A N HIS 111.A ND1 no hydrogen 3.259 N/A THR 114.A N HIS 111.A O no hydrogen 2.724 N/A THR 114.A OG1 HIS 111.A O no hydrogen 2.538 N/A ASN 119.A ND2 PRO 112.A O no hydrogen 3.179 N/A TRP 121.A N VAL 117.A O no hydrogen 2.724 N/A TRP 121.A NE1 VAL 66.A O no hydrogen 2.707 N/A ILE 122.A N THR 118.A O no hydrogen 2.958 N/A SER 123.A N LEU 120.A O no hydrogen 3.060 N/A SER 123.A OG ASN 119.A O no hydrogen 3.561 N/A SER 123.A OG LEU 120.A O no hydrogen 2.622 N/A VAL 125.A N ILE 122.A O no hydrogen 2.644 N/A ARG 126.A N ILE 122.A O no hydrogen 3.229 N/A ARG 126.A NH1 ASN 119.A OD1 no hydrogen 2.736 N/A ARG 126.A NH2 ASN 119.A O no hydrogen 2.919 N/A ARG 126.A NH2 ASN 119.A OD1 no hydrogen 3.377 N/A GLU 127.A N SER 123.A O no hydrogen 3.092 N/A VAL 128.A N ASP 124.A O no hydrogen 3.148 N/A ARG 129.A N VAL 125.A O no hydrogen 2.719 N/A ARG 129.A NE ASP 130.A OD2 no hydrogen 2.929 N/A ARG 129.A NH1 LEU 108.A O no hydrogen 3.463 N/A ARG 129.A NH2 ASP 130.A OD2 no hydrogen 3.167 N/A ASP 130.A N ARG 126.A O no hydrogen 2.745 N/A LYS 131.A N VAL 128.A O no hydrogen 3.022 N/A ASN 132.A N ARG 129.A O no hydrogen 3.059 N/A ASN 132.A ND2 VAL 128.A O no hydrogen 2.993 N/A LYS 135.A N ASN 132.A O no hydrogen 2.792 N/A HIS 137.A N ALA 133.A O no hydrogen 3.126 N/A ASP 143.A N SER 140.A OG no hydrogen 3.360 N/A ALA 144.A N SER 140.A O no hydrogen 2.949 N/A TRP 145.A N ALA 141.A O no hydrogen 3.155 N/A TRP 145.A NE1 CYS 101.A O no hydrogen 3.008 N/A ASP 146.A N ASP 142.A O no hydrogen 3.184 N/A LYS 147.A N ASP 143.A O no hydrogen 2.721 N/A MET 148.A N ALA 144.A O no hydrogen 2.749 N/A VAL 149.A N TRP 145.A O no hydrogen 3.027 N/A GLU 150.A N ASP 146.A O no hydrogen 3.185 N/A LEU 151.A N LYS 147.A O no hydrogen 2.859 N/A ASN 152.A N MET 148.A O no hydrogen 3.015 N/A ASN 152.A ND2 GLY 67.A O no hydrogen 2.935 N/A VAL 153.A N VAL 149.A O no hydrogen 3.104 N/A GLU 154.A N GLU 150.A O no hydrogen 3.040 N/A ALA 155.A N LEU 151.A O no hydrogen 2.852 N/A GLN 156.A N ASN 152.A O no hydrogen 2.845 N/A GLN 156.A NE2 ASN 152.A O no hydrogen 3.694 N/A GLN 156.A NE2 ASN 152.A OD1 no hydrogen 2.861 N/A VAL 157.A N VAL 153.A O no hydrogen 2.909 N/A PHE 158.A N GLU 154.A O no hydrogen 3.053 N/A ASN 159.A ND2 GLN 156.A OE1 no hydrogen 3.184 N/A VAL 160.A N GLN 156.A O no hydrogen 2.789 N/A CYS 161.A N VAL 157.A O no hydrogen 2.975 N/A CYS 161.A SG VAL 157.A O no hydrogen 3.358 N/A ALA 162.A N PHE 158.A O no hydrogen 2.859 N/A ALA 162.A N ASN 159.A O no hydrogen 3.240 N/A SER 163.A N VAL 160.A O no hydrogen 3.056 N/A SER 163.A OG VAL 160.A O no hydrogen 2.489 N/A VAL 166.A N SER 163.A OG no hydrogen 3.176 N/A GLN 167.A N SER 163.A O no hydrogen 2.992 N/A GLN 167.A NE2 CYS 161.A O no hydrogen 2.720 N/A ALA 168.A N PRO 164.A O no hydrogen 2.824 N/A ALA 169.A N ILE 165.A O no hydrogen 2.929 N/A TRP 170.A N VAL 166.A O no hydrogen 2.828 N/A TRP 170.A NE1 LEU 176.A O no hydrogen 3.021 N/A ALA 171.A N GLN 167.A O no hydrogen 3.119 N/A ARG 172.A N ALA 169.A O no hydrogen 3.404 N/A ARG 172.A NE GLN 174.A OE1 no hydrogen 2.887 N/A ARG 172.A NH2 ASP 86.A OD1 no hydrogen 2.975 N/A ARG 172.A NH2 GLN 174.A OE1 no hydrogen 2.865 N/A GLY 173.A N TRP 170.A O no hydrogen 3.171 N/A GLN 174.A NE2 VAL 85.A O no hydrogen 2.925 N/A SER 177.A N LYS 91.A O no hydrogen 2.762 N/A SER 177.A OG HIS 92.A ND1 no hydrogen 2.942 N/A SER 177.A OG HIS 179.A NE2 no hydrogen 2.582 N/A VAL 178.A N ILE 197.A O no hydrogen 2.772 N/A HIS 179.A N ILE 93.A O no hydrogen 2.945 N/A HIS 179.A NE2 SER 177.A OG no hydrogen 2.582 N/A ILE 181.A N VAL 95.A O no hydrogen 2.831 N/A VAL 182.A N LYS 191.A O no hydrogen 3.002 N/A TYR 183.A N GLY 97.A O no hydrogen 2.888 N/A THR 184.A N LEU 189.A O no hydrogen 2.893 N/A THR 187.A N THR 184.A O no hydrogen 2.927 N/A GLY 188.A N THR 184.A O no hydrogen 3.039 N/A LEU 189.A N THR 187.A OG1 no hydrogen 3.369 N/A LYS 191.A N VAL 182.A O no hydrogen 3.135 N/A LYS 191.A NZ TYR 99.A OH no hydrogen 3.367 N/A LEU 193.A N GLY 180.A O no hydrogen 2.941 N/A ILE 194.A N GLY 180.A O no hydrogen 3.138 N/A LYS 195.A NZ GLU 192.A OE2 no hydrogen 3.161 N/A ILE 197.A N VAL 178.A O no hydrogen 2.912 N/A THR 198.A N ASP 202.A OD1 no hydrogen 2.968 N/A THR 198.A OG1 ASP 202.A OD1 no hydrogen 2.853 N/A ALA 203.A N GLY 199.A O no hydrogen 3.179 N/A GLY 204.A N MET 200.A O no hydrogen 2.818 N/A ALA 205.A N GLU 201.A O no hydrogen 3.343 N/A ALA 205.A N ASP 202.A O no hydrogen 2.858 N/A LEU 206.A N ALA 203.A O no hydrogen 3.012 N/A LEU 207.A N ALA 203.A O no hydrogen 2.764 N/A ARG 208.A N GLU 154.A OE2 no hydrogen 3.139 N/A ARG 208.A NE GLU 154.A OE1 no hydrogen 3.360 N/A GLN 213.A N ASP 210.A OD2 no hydrogen 2.822 N/A HIS 214.A N ASP 210.A O no hydrogen 3.069 N/A CYS 215.A N LEU 211.A O no hydrogen 2.708 N/A CYS 215.A SG GLN 167.A OE1 no hydrogen 3.388 N/A CYS 215.A SG LEU 211.A O no hydrogen 3.313 N/A PHE 216.A N LYS 212.A O no hydrogen 2.718 N/A SER 220.A N PHE 217.A O no hydrogen 2.468 N/A SER 220.A OG SER 220.A O no hydrogen 2.324 N/A LEU 221.A N SER 218.A O no hydrogen 3.279 N/A