Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4um3_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 2.A N ASP 5.A OD2 no hydrogen 3.446 N/A ASP 5.A N ASP 2.A OD1 no hydrogen 3.080 N/A ILE 6.A N ASP 2.A O no hydrogen 3.052 N/A LEU 7.A N ARG 3.A O no hydrogen 2.852 N/A TYR 8.A N ALA 4.A O no hydrogen 2.917 N/A ASN 9.A N ASP 5.A O no hydrogen 2.838 N/A ILE 10.A N ILE 6.A O no hydrogen 3.037 N/A ARG 11.A N LEU 7.A O no hydrogen 2.980 N/A GLN 12.A N TYR 8.A O no hydrogen 3.019 N/A THR 13.A N ASN 9.A O no hydrogen 2.832 N/A THR 13.A OG1 ASN 9.A O no hydrogen 2.453 N/A SER 14.A N ILE 10.A O no hydrogen 2.893 N/A SER 14.A OG ILE 10.A O no hydrogen 3.143 N/A SER 14.A OG SER 79.A O no hydrogen 2.365 N/A ASP 17.A N ASP 17.A OD1 no hydrogen 2.562 N/A VAL 18.A N ARG 15.A O no hydrogen 2.769 N/A THR 21.A N ILE 19.A O no hydrogen 2.756 N/A THR 21.A OG1 ARG 24.A O no hydrogen 3.054 N/A VAL 26.A N GLU 148.A O no hydrogen 2.905 N/A VAL 28.A N SER 150.A O no hydrogen 2.742 N/A SER 29.A N THR 56.A O no hydrogen 2.779 N/A VAL 30.A N ASP 152.A O no hydrogen 2.941 N/A SER 31.A N GLN 54.A O no hydrogen 3.037 N/A LYS 33.A N TRP 52.A O no hydrogen 2.900 N/A ILE 35.A N VAL 50.A O no hydrogen 2.855 N/A ASN 36.A N VAL 50.A O no hydrogen 3.122 N/A LEU 38.A N ASP 48.A O no hydrogen 2.768 N/A ASN 41.A N GLU 46.A O no hydrogen 2.951 N/A THR 44.A N ASN 41.A OD1 no hydrogen 2.987 N/A ASN 45.A N ASN 41.A O no hydrogen 2.794 N/A GLU 46.A N ASN 41.A O no hydrogen 3.316 N/A VAL 47.A N PHE 120.A O no hydrogen 2.955 N/A VAL 49.A N GLN 118.A O no hydrogen 2.929 N/A VAL 50.A N ASN 36.A O no hydrogen 2.852 N/A PHE 51.A N ILE 116.A O no hydrogen 2.823 N/A TRP 52.A N LYS 33.A O no hydrogen 2.792 N/A GLN 53.A N PRO 114.A O no hydrogen 2.959 N/A GLN 54.A N SER 31.A O no hydrogen 3.076 N/A THR 55.A N TYR 112.A O no hydrogen 2.779 N/A THR 55.A OG1 GLN 53.A O no hydrogen 3.068 N/A THR 56.A N SER 29.A O no hydrogen 2.969 N/A TRP 57.A N VAL 110.A O no hydrogen 2.874 N/A SER 58.A OG GLU 109.A OE2.B no hydrogen 3.024 N/A ASP 59.A N GLY 108.A O no hydrogen 2.762 N/A LEU 62.A N ASP 59.A O no hydrogen 3.105 N/A ALA 63.A N ARG 60.A O no hydrogen 2.996 N/A TRP 64.A N SER 106.A O no hydrogen 2.892 N/A TRP 64.A NE1 PRO 70.A O no hydrogen 2.999 N/A SER 67.A N ASN 65.A OD1 no hydrogen 3.231 N/A SER 67.A OG ASN 65.A OD1 no hydrogen 3.125 N/A SER 69.A N SER 66.A O no hydrogen 3.491 N/A SER 69.A OG LEU 1.A O no hydrogen 3.337 N/A SER 69.A OG ASN 65.A O no hydrogen 3.199 N/A VAL 73.A N VAL 104.A O no hydrogen 2.936 N/A VAL 75.A N ALA 102.A O no hydrogen 2.835 N/A ILE 77.A N GLN 100.A O no hydrogen 3.164 N/A SER 79.A N PRO 76.A O no hydrogen 2.837 N/A LEU 80.A N ILE 77.A O no hydrogen 3.140 N/A ALA 86.A N GLY 140.A O no hydrogen 2.838 N/A TYR 88.A N LYS 138.A O no hydrogen 2.768 N/A TYR 88.A OH SER 141.A O no hydrogen 3.349 N/A ASN 89.A ND2 SER 121.A O no hydrogen 3.124 N/A ASN 89.A ND2 ARG 136.A O no hydrogen 2.914 N/A ALA 90.A N ALA 87.A O no hydrogen 3.187 N/A ILE 91.A N ARG 119.A O no hydrogen 2.751 N/A SER 92.A OG LYS 93.A O no hydrogen 3.379 N/A GLU 95.A N ARG 117.A O no hydrogen 2.999 N/A LEU 97.A N SER 115.A O no hydrogen 2.834 N/A LEU 101.A N PRO 99.A O no hydrogen 2.964 N/A ALA 102.A N VAL 75.A O no hydrogen 2.733 N/A HIS 103.A N GLN 111.A O no hydrogen 2.716 N/A VAL 104.A N VAL 73.A O no hydrogen 2.897 N/A VAL 105.A N GLU 109.A O no hydrogen 2.845 N/A SER 106.A N ASP 71.A O no hydrogen 2.840 N/A GLY 108.A N VAL 105.A O no hydrogen 2.646 N/A GLU 109.A N ASP 107.A OD1 no hydrogen 3.151 N/A VAL 110.A N TRP 57.A O no hydrogen 2.670 N/A GLN 111.A N HIS 103.A O no hydrogen 2.902 N/A GLN 111.A NE2 THR 56.A OG1 no hydrogen 3.077 N/A TYR 112.A N THR 55.A O no hydrogen 2.811 N/A SER 115.A N THR 98.A OG1 no hydrogen 2.921 N/A ILE 116.A N PHE 51.A O no hydrogen 2.728 N/A ARG 117.A N GLU 95.A O no hydrogen 2.954 N/A ARG 117.A NE ASP 48.A OD1 no hydrogen 2.676 N/A ARG 117.A NH2 ASP 48.A OD2 no hydrogen 3.375 N/A GLN 118.A N VAL 49.A O no hydrogen 2.921 N/A GLN 118.A NE2 SER 92.A O no hydrogen 3.012 N/A ARG 119.A N SER 92.A OG no hydrogen 3.056 N/A ARG 119.A NE GLU 46.A OE1 no hydrogen 3.321 N/A ARG 119.A NH1 ASP 48.A OD2 no hydrogen 3.284 N/A PHE 120.A N VAL 47.A O no hydrogen 2.788 N/A SER 121.A N ASN 89.A O no hydrogen 2.869 N/A CYS 122.A N ASN 45.A O no hydrogen 3.082 N/A VAL 124.A N ASN 45.A OD1 no hydrogen 2.816 N/A SER 125.A N ASP 123.A OD1 no hydrogen 3.338 N/A SER 125.A OG ASP 123.A OD1 no hydrogen 2.846 N/A SER 125.A OG ASP 123.A OD2 no hydrogen 3.458 N/A GLY 126.A N GLU 42.A OE2 no hydrogen 2.993 N/A VAL 127.A N VAL 124.A O no hydrogen 3.225 N/A THR 129.A N GLY 126.A O no hydrogen 2.926 N/A THR 129.A OG1 GLY 126.A O no hydrogen 2.897 N/A THR 129.A OG1 SER 131.A OG no hydrogen 3.232 N/A SER 131.A OG THR 129.A OG1 no hydrogen 3.232 N/A GLY 132.A N THR 129.A OG1 no hydrogen 3.251 N/A ALA 133.A N PHE 195.A O no hydrogen 2.714 N/A CYS 135.A N LEU 193.A O no hydrogen 2.764 N/A ILE 137.A N VAL 191.A O no hydrogen 2.722 N/A LYS 138.A N ASN 89.A OD1 no hydrogen 3.122 N/A LYS 138.A NZ TYR 179.A OH no hydrogen 2.918 N/A ILE 139.A N VAL 189.A O no hydrogen 2.833 N/A GLY 140.A N ALA 86.A O no hydrogen 3.169 N/A SER 141.A OG ASP 84.A OD1 no hydrogen 3.054 N/A SER 141.A OG ASP 84.A OD2 no hydrogen 3.561 N/A SER 141.A OG HIS 144.A O no hydrogen 3.035 N/A TRP 142.A N ASP 84.A O no hydrogen 2.884 N/A THR 143.A N ASP 84.A OD2 no hydrogen 2.698 N/A THR 143.A OG1 ASP 84.A OD2 no hydrogen 2.867 N/A HIS 144.A N SER 141.A OG no hydrogen 2.649 N/A HIS 144.A ND1 GLU 148.A OE1 no hydrogen 2.986 N/A SER 146.A N ALA 185.A O no hydrogen 2.641 N/A SER 146.A OG ALA 185.A O no hydrogen 3.197 N/A ARG 147.A N HIS 145.A ND1 no hydrogen 3.245 N/A GLU 148.A N HIS 145.A O no hydrogen 2.901 N/A ILE 149.A N HIS 145.A O no hydrogen 2.791 N/A SER 150.A N VAL 26.A O no hydrogen 3.072 N/A VAL 151.A N GLU 187.A OE1 no hydrogen 2.976 N/A ASP 152.A N VAL 28.A O no hydrogen 2.929 N/A PHE 159.A N SER 156.A O no hydrogen 3.207 N/A SER 160.A N ILE 35.A O no hydrogen 2.739 N/A TYR 162.A N SER 160.A OG no hydrogen 3.365 N/A SER 163.A N SER 160.A O no hydrogen 3.363 N/A SER 163.A OG ASN 36.A OD1 no hydrogen 3.184 N/A SER 163.A OG ILE 37.A O no hydrogen 3.078 N/A SER 163.A OG PHE 165.A O no hydrogen 3.283 N/A PHE 165.A N SER 163.A OG no hydrogen 2.857 N/A GLU 166.A N ARG 196.A O no hydrogen 3.054 N/A LEU 168.A N ASN 194.A O no hydrogen 2.797 N/A ASP 169.A N ASN 194.A O no hydrogen 3.214 N/A THR 171.A N SER 192.A O no hydrogen 3.031 N/A LYS 173.A N GLU 190.A O no hydrogen 2.984 N/A LYS 174.A NZ VAL 151.A O no hydrogen 3.535 N/A LYS 174.A NZ ASP 152.A OD1 no hydrogen 3.100 N/A LYS 174.A NZ GLU 187.A OE1 no hydrogen 3.027 N/A ASN 175.A N ASP 188.A O no hydrogen 2.911 N/A ASN 175.A ND2 ASP 188.A OD1 no hydrogen 3.228 N/A VAL 177.A N TYR 186.A O no hydrogen 2.841 N/A CYS 182.A N TYR 179.A O no hydrogen 3.355 N/A CYS 182.A SG TYR 186.A OH no hydrogen 3.896 N/A TYR 186.A N VAL 177.A O no hydrogen 2.858 N/A ASP 188.A N ASN 175.A O no hydrogen 3.017 N/A VAL 189.A N ILE 139.A O no hydrogen 2.600 N/A GLU 190.A N LYS 173.A O no hydrogen 2.686 N/A VAL 191.A N ILE 137.A O no hydrogen 2.848 N/A SER 192.A N THR 171.A O no hydrogen 2.681 N/A LEU 193.A N CYS 135.A O no hydrogen 2.715 N/A ASN 194.A N ASP 169.A O no hydrogen 2.856 N/A ASN 194.A ND2 SER 131.A O no hydrogen 3.090 N/A ASN 194.A ND2 ALA 133.A O no hydrogen 2.819 N/A PHE 195.A N ALA 133.A O no hydrogen 2.877 N/A ARG 196.A N GLU 166.A O no hydrogen 3.102 N/A ARG 196.A NE GLU 166.A OE2 no hydrogen 3.003 N/A ARG 196.A NH1 GLU 130.A O no hydrogen 2.525 N/A ARG 196.A NH2 GLU 166.A OE2 no hydrogen 3.264 N/A LYS 197.A N VAL 127.A O no hydrogen 2.862 N/A LYS 198.A N ARG 164.A O no hydrogen 2.830 N/A LYS 198.A NZ SER 163.A O no hydrogen 2.594 N/A SER 201.A OG ARG 200.A O no hydrogen 2.287 N/A