Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4um1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 5.A N ASP 2.A OD1 no hydrogen 3.043 N/A ILE 6.A N ASP 2.A O no hydrogen 3.150 N/A LEU 7.A N ARG 3.A O no hydrogen 2.999 N/A TYR 8.A N ALA 4.A O no hydrogen 3.044 N/A ASN 9.A N ASP 5.A O no hydrogen 2.943 N/A ILE 10.A N ILE 6.A O no hydrogen 2.910 N/A ARG 11.A N LEU 7.A O no hydrogen 2.943 N/A GLN 12.A N TYR 8.A O no hydrogen 3.143 N/A GLN 12.A N ASN 9.A O no hydrogen 3.261 N/A THR 13.A N ILE 10.A O no hydrogen 3.433 N/A THR 13.A OG1 ASN 9.A O no hydrogen 2.716 N/A SER 14.A OG SER 80.A O no hydrogen 2.464 N/A ASP 17.A N ASP 17.A OD1 no hydrogen 2.388 N/A VAL 18.A N ARG 15.A O no hydrogen 3.288 N/A THR 21.A N ILE 19.A O no hydrogen 2.873 N/A VAL 27.A N GLU 149.A O no hydrogen 2.793 N/A VAL 29.A N SER 151.A O no hydrogen 2.900 N/A SER 30.A N THR 57.A O no hydrogen 2.876 N/A VAL 31.A N ASP 153.A O no hydrogen 3.102 N/A SER 32.A N GLN 55.A O no hydrogen 2.936 N/A LYS 34.A N TRP 53.A O no hydrogen 2.960 N/A LYS 34.A NZ SER 32.A OG no hydrogen 3.329 N/A ILE 36.A N VAL 51.A O no hydrogen 2.779 N/A ASN 37.A N VAL 51.A O no hydrogen 3.108 N/A LEU 39.A N ASP 49.A O no hydrogen 2.896 N/A ASN 42.A N GLU 47.A O no hydrogen 3.036 N/A THR 45.A N ASN 42.A OD1 no hydrogen 2.916 N/A GLU 47.A N ASN 42.A O no hydrogen 3.284 N/A VAL 48.A N PHE 121.A O no hydrogen 3.083 N/A VAL 50.A N GLN 119.A O no hydrogen 2.938 N/A VAL 51.A N ASN 37.A O no hydrogen 3.092 N/A PHE 52.A N ILE 117.A O no hydrogen 2.984 N/A TRP 53.A N LYS 34.A O no hydrogen 2.823 N/A GLN 54.A N PRO 115.A O no hydrogen 3.033 N/A GLN 55.A N SER 32.A O no hydrogen 2.847 N/A THR 56.A N TYR 113.A O no hydrogen 2.959 N/A THR 56.A OG1 GLN 54.A O no hydrogen 3.027 N/A THR 56.A OG1 TYR 113.A O no hydrogen 3.515 N/A THR 57.A N SER 30.A O no hydrogen 2.946 N/A TRP 58.A N VAL 111.A O no hydrogen 3.121 N/A ASP 60.A N GLY 109.A O no hydrogen 2.755 N/A THR 62.A N ASP 60.A OD1 no hydrogen 3.241 N/A THR 62.A OG1 ASP 60.A OD1 no hydrogen 3.157 N/A LEU 63.A N ASP 60.A O no hydrogen 3.018 N/A ALA 64.A N ARG 61.A O no hydrogen 3.108 N/A TRP 65.A N SER 107.A O no hydrogen 3.058 N/A TRP 65.A NE1 PRO 71.A O no hydrogen 2.899 N/A SER 68.A N ASN 66.A OD1 no hydrogen 3.041 N/A ASP 72.A N ASP 72.A OD1 no hydrogen 2.439 N/A VAL 74.A N VAL 105.A O no hydrogen 2.993 N/A VAL 76.A N ALA 103.A O no hydrogen 2.889 N/A ILE 78.A N GLN 101.A O no hydrogen 3.184 N/A SER 80.A N PRO 77.A O no hydrogen 2.908 N/A LEU 81.A N ILE 78.A O no hydrogen 3.128 N/A ALA 87.A N GLY 141.A O no hydrogen 3.017 N/A TYR 89.A N LYS 139.A O no hydrogen 2.861 N/A ASN 90.A ND2 SER 122.A O no hydrogen 3.014 N/A ASN 90.A ND2 ARG 137.A O no hydrogen 3.027 N/A ALA 91.A N ALA 88.A O no hydrogen 3.204 N/A ILE 92.A N ARG 120.A O no hydrogen 2.909 N/A GLU 96.A N ARG 118.A O no hydrogen 3.153 N/A LEU 98.A N SER 116.A O no hydrogen 2.799 N/A LEU 102.A N PRO 100.A O no hydrogen 3.064 N/A ALA 103.A N VAL 76.A O no hydrogen 2.804 N/A HIS 104.A N GLN 112.A O no hydrogen 2.886 N/A HIS 104.A NE2 GLN 73.A OE1 no hydrogen 2.949 N/A VAL 105.A N VAL 74.A O no hydrogen 2.958 N/A VAL 106.A N GLU 110.A O no hydrogen 3.018 N/A SER 107.A N ASP 72.A O no hydrogen 2.875 N/A GLY 109.A N VAL 106.A O no hydrogen 2.849 N/A GLU 110.A N ASP 108.A OD1 no hydrogen 2.864 N/A VAL 111.A N TRP 58.A O no hydrogen 2.873 N/A GLN 112.A N HIS 104.A O no hydrogen 2.916 N/A GLN 112.A NE2 THR 114.A OG1 no hydrogen 3.097 N/A TYR 113.A N THR 56.A O no hydrogen 2.872 N/A SER 116.A N THR 99.A OG1 no hydrogen 3.065 N/A ILE 117.A N PHE 52.A O no hydrogen 2.815 N/A ARG 118.A N GLU 96.A O no hydrogen 3.081 N/A ARG 118.A NE ASP 49.A OD2 no hydrogen 3.052 N/A ARG 118.A NH2 ASP 49.A OD2 no hydrogen 2.578 N/A GLN 119.A N VAL 50.A O no hydrogen 2.927 N/A GLN 119.A NE2 SER 93.A O no hydrogen 2.919 N/A ARG 120.A N SER 93.A OG no hydrogen 3.059 N/A ARG 120.A NE GLU 47.A OE1 no hydrogen 3.110 N/A ARG 120.A NH1 GLU 40.A O no hydrogen 3.441 N/A PHE 121.A N VAL 48.A O no hydrogen 2.899 N/A SER 122.A N ASN 90.A O no hydrogen 3.012 N/A CYS 123.A N ASN 46.A O no hydrogen 3.220 N/A VAL 125.A N ASN 46.A OD1 no hydrogen 3.077 N/A SER 126.A OG ASP 124.A OD1 no hydrogen 2.897 N/A GLY 127.A N GLU 43.A OE2 no hydrogen 3.167 N/A GLY 133.A N THR 130.A O no hydrogen 3.307 N/A ALA 134.A N PHE 197.A O no hydrogen 2.899 N/A CYS 136.A N LEU 195.A O no hydrogen 3.064 N/A ILE 138.A N VAL 193.A O no hydrogen 2.944 N/A LYS 139.A N ASN 90.A OD1 no hydrogen 3.214 N/A LYS 139.A NZ TYR 181.A OH no hydrogen 2.652 N/A ILE 140.A N VAL 191.A O no hydrogen 2.829 N/A GLY 141.A N ALA 87.A O no hydrogen 3.222 N/A SER 142.A OG ASP 85.A OD1 no hydrogen 2.713 N/A SER 142.A OG HIS 145.A O no hydrogen 3.451 N/A TRP 143.A N ASP 85.A O no hydrogen 3.076 N/A THR 144.A N ASP 85.A OD2 no hydrogen 2.859 N/A THR 144.A OG1 ASP 85.A OD2 no hydrogen 2.713 N/A HIS 145.A N SER 142.A OG no hydrogen 3.079 N/A HIS 145.A ND1 GLU 149.A OE1 no hydrogen 3.151 N/A SER 147.A N ALA 187.A O no hydrogen 2.734 N/A SER 147.A OG ALA 187.A O no hydrogen 3.383 N/A ARG 148.A N HIS 146.A ND1 no hydrogen 3.210 N/A GLU 149.A N HIS 146.A O no hydrogen 2.997 N/A ILE 150.A N HIS 146.A O no hydrogen 3.051 N/A SER 151.A N VAL 27.A O no hydrogen 3.105 N/A ASP 153.A N VAL 29.A O no hydrogen 3.061 N/A SER 158.A OG SER 158.A O no hydrogen 2.365 N/A PHE 161.A N SER 158.A O no hydrogen 3.115 N/A SER 162.A N ILE 36.A O no hydrogen 2.879 N/A TYR 164.A N SER 162.A OG no hydrogen 3.293 N/A SER 165.A N SER 162.A O no hydrogen 3.475 N/A SER 165.A OG ASN 37.A OD1 no hydrogen 3.327 N/A SER 165.A OG ILE 38.A O no hydrogen 3.175 N/A PHE 167.A N SER 165.A OG no hydrogen 3.192 N/A GLU 168.A N ARG 198.A O no hydrogen 2.958 N/A LEU 170.A N ASN 196.A O no hydrogen 2.716 N/A ASP 171.A N ASN 196.A O no hydrogen 3.225 N/A THR 173.A N SER 194.A O no hydrogen 3.038 N/A LYS 175.A N GLU 192.A O no hydrogen 2.981 N/A LYS 176.A NZ ASP 153.A OD1 no hydrogen 3.298 N/A LYS 176.A NZ GLU 189.A OE1 no hydrogen 2.958 N/A LYS 176.A NZ GLU 189.A OE2 no hydrogen 3.317 N/A ASN 177.A N ASP 190.A O no hydrogen 2.830 N/A ASN 177.A ND2 ASP 190.A OD1 no hydrogen 2.960 N/A VAL 179.A N TYR 188.A O no hydrogen 3.124 N/A CYS 184.A SG TYR 188.A OH no hydrogen 3.772 N/A TYR 188.A N VAL 179.A O no hydrogen 2.764 N/A ASP 190.A N ASN 177.A O no hydrogen 2.970 N/A VAL 191.A N ILE 140.A O no hydrogen 2.745 N/A GLU 192.A N LYS 175.A O no hydrogen 2.857 N/A VAL 193.A N ILE 138.A O no hydrogen 2.859 N/A SER 194.A N THR 173.A O no hydrogen 2.773 N/A LEU 195.A N CYS 136.A O no hydrogen 2.771 N/A ASN 196.A N ASP 171.A O no hydrogen 2.799 N/A ASN 196.A ND2 SER 132.A O no hydrogen 3.444 N/A ASN 196.A ND2 ALA 134.A O no hydrogen 2.770 N/A PHE 197.A N ALA 134.A O no hydrogen 3.015 N/A ARG 198.A N GLU 168.A O no hydrogen 3.112 N/A ARG 198.A NE GLU 168.A OE2 no hydrogen 2.995 N/A ARG 198.A NH2 GLU 168.A OE2 no hydrogen 3.220 N/A LYS 199.A N VAL 128.A O no hydrogen 2.907 N/A LYS 200.A N ARG 166.A O no hydrogen 3.079 N/A LYS 200.A NZ GLN 163.A O no hydrogen 2.835 N/A LYS 200.A NZ SER 165.A O no hydrogen 3.545 N/A