Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4jr1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 4.A N ALA 1.A O no hydrogen 3.479 N/A TYR 5.A N GLU 219.A O no hydrogen 2.966 N/A TYR 5.A OH ASP 151.A OD1 no hydrogen 2.808 N/A ASN 8.A N ASN 6.A OD1 no hydrogen 3.103 N/A PHE 9.A N MET 7.A O no hydrogen 2.979 N/A LYS 11.A N ASN 78.A O no hydrogen 3.215 N/A LYS 14.A NZ GLU 74.A OE1 no hydrogen 2.772 N/A LYS 14.A NZ GLU 74.A OE2 no hydrogen 2.560 N/A CYS 15.A N ASP 52.A O no hydrogen 3.070 N/A ILE 16.A N ALA 83.A O no hydrogen 2.949 N/A ILE 17.A N ILE 54.A O no hydrogen 2.725 N/A ILE 18.A N ILE 85.A O no hydrogen 2.805 N/A ASN 19.A N TYR 56.A O no hydrogen 2.672 N/A ASN 19.A ND2 ASP 36.A OD1 no hydrogen 3.068 N/A ASN 19.A ND2 ASN 57.A OD1 no hydrogen 3.409 N/A ASN 20.A N LEU 87.A O no hydrogen 2.788 N/A ASN 20.A ND2 TYR 96.A O no hydrogen 3.055 N/A LYS 21.A N ASP 58.A OD1 no hydrogen 2.837 N/A LYS 21.A NZ ASP 36.A OD2 no hydrogen 2.972 N/A ASN 22.A N ASP 58.A OD1 no hydrogen 2.823 N/A ASN 22.A ND2 ASP 58.A OD2 no hydrogen 3.018 N/A ASP 24.A N LYS 98.A O no hydrogen 2.785 N/A THR 27.A N ASP 24.A O no hydrogen 3.089 N/A THR 27.A OG1 ASP 24.A O no hydrogen 2.560 N/A GLY 28.A N LYS 25.A O no hydrogen 3.210 N/A MET 29.A N THR 27.A OG1 no hydrogen 3.226 N/A ARG 32.A N LYS 21.A O no hydrogen 3.091 N/A ARG 32.A NH1 ASN 20.A O no hydrogen 2.973 N/A ARG 32.A NH1 THR 35.A OG1 no hydrogen 2.848 N/A THR 35.A N ARG 32.A O no hydrogen 3.391 N/A THR 35.A OG1 ASN 19.A OD1 no hydrogen 2.585 N/A LYS 37.A NZ GLY 169.A O no hydrogen 3.194 N/A ASP 38.A N GLY 34.A O no hydrogen 3.345 N/A ALA 39.A N THR 35.A O no hydrogen 2.944 N/A GLU 40.A N ASP 36.A O no hydrogen 3.064 N/A ALA 41.A N LYS 37.A O no hydrogen 3.026 N/A LEU 42.A N ASP 38.A O no hydrogen 2.769 N/A PHE 43.A N ALA 39.A O no hydrogen 2.878 N/A LYS 44.A N GLU 40.A O no hydrogen 3.191 N/A CYS 45.A N ALA 41.A O no hydrogen 3.057 N/A CYS 45.A SG ALA 41.A O no hydrogen 3.250 N/A CYS 45.A SG LEU 42.A O no hydrogen 3.691 N/A PHE 46.A N LEU 42.A O no hydrogen 3.126 N/A ARG 47.A N PHE 43.A O no hydrogen 3.151 N/A ARG 47.A NH2 VAL 53.A O no hydrogen 3.111 N/A SER 48.A N LYS 44.A O no hydrogen 3.165 N/A SER 48.A OG LYS 44.A O no hydrogen 2.966 N/A GLY 50.A N ARG 47.A O no hydrogen 3.166 N/A PHE 51.A N PHE 46.A O no hydrogen 3.130 N/A ASP 52.A N GLY 13.A O no hydrogen 2.981 N/A ILE 54.A N CYS 15.A O no hydrogen 2.795 N/A TYR 56.A N ILE 17.A O no hydrogen 2.760 N/A ASP 58.A N ASN 19.A O no hydrogen 2.940 N/A CYS 59.A N ASN 20.A OD1 no hydrogen 2.877 N/A CYS 59.A SG ASN 57.A O no hydrogen 3.962 N/A CYS 61.A N ASP 99.A OD1 no hydrogen 3.005 N/A CYS 61.A SG ASP 99.A OD1 no hydrogen 3.712 N/A LYS 63.A N SER 60.A OG no hydrogen 3.236 N/A MET 64.A N SER 60.A O no hydrogen 2.910 N/A GLN 65.A N CYS 61.A O no hydrogen 3.070 N/A GLN 65.A NE2 THR 102.A OG1 no hydrogen 2.760 N/A ASP 66.A N ALA 62.A O no hydrogen 2.935 N/A LEU 67.A N LYS 63.A O no hydrogen 3.074 N/A LEU 68.A N MET 64.A O no hydrogen 3.379 N/A LYS 69.A N GLN 65.A O no hydrogen 3.017 N/A LYS 69.A NZ GLU 73.A OE2 no hydrogen 2.775 N/A LYS 70.A N ASP 66.A O no hydrogen 2.806 N/A LYS 70.A NZ ASP 66.A OD1 no hydrogen 2.633 N/A ALA 71.A N LEU 67.A O no hydrogen 3.003 N/A SER 72.A N LEU 68.A O no hydrogen 3.008 N/A SER 72.A OG LEU 68.A O no hydrogen 3.416 N/A SER 72.A OG LYS 69.A O no hydrogen 2.628 N/A GLU 73.A N LYS 70.A O no hydrogen 3.099 N/A GLU 74.A N ALA 71.A O no hydrogen 3.269 N/A HIS 76.A N THR 118.A OG1 no hydrogen 3.145 N/A HIS 76.A NE2 ALA 71.A O no hydrogen 2.652 N/A THR 77.A N ASP 75.A OD1 no hydrogen 3.169 N/A THR 77.A OG1 ASP 75.A OD1 no hydrogen 2.441 N/A ALA 79.A N HIS 76.A O no hydrogen 3.138 N/A ALA 80.A N LYS 11.A O no hydrogen 3.056 N/A CYS 81.A N LEU 12.A O no hydrogen 2.844 N/A CYS 81.A SG LEU 12.A O no hydrogen 3.528 N/A PHE 82.A N PRO 123.A O no hydrogen 3.074 N/A ALA 83.A N LYS 14.A O no hydrogen 3.021 N/A CYS 84.A N LEU 125.A O no hydrogen 2.780 N/A CYS 84.A SG ILE 16.A O no hydrogen 3.765 N/A ILE 85.A N ILE 16.A O no hydrogen 2.755 N/A LEU 86.A N PHE 127.A O no hydrogen 2.728 N/A LEU 87.A N ILE 18.A O no hydrogen 2.894 N/A SER 88.A N GLN 129.A O no hydrogen 3.274 N/A SER 88.A OG HIS 89.A O no hydrogen 3.345 N/A SER 88.A OG TYR 96.A O no hydrogen 2.528 N/A HIS 89.A NE2 GLY 30.A O no hydrogen 2.919 N/A GLU 91.A N VAL 94.A O no hydrogen 3.278 N/A VAL 94.A N GLU 91.A O no hydrogen 3.334 N/A ILE 95.A N THR 102.A O no hydrogen 2.975 N/A TYR 96.A N HIS 89.A O no hydrogen 2.875 N/A TYR 96.A OH GLU 91.A OE2 no hydrogen 2.664 N/A GLY 97.A N GLY 100.A O no hydrogen 2.539 N/A LYS 98.A N CYS 59.A O no hydrogen 2.784 N/A THR 102.A N ILE 95.A O no hydrogen 2.963 N/A ILE 104.A N ASN 93.A O no hydrogen 3.036 N/A ASP 106.A N PRO 103.A O no hydrogen 3.068 N/A LEU 107.A N ILE 104.A O no hydrogen 3.033 N/A THR 108.A N ILE 104.A O no hydrogen 3.148 N/A THR 108.A OG1 LYS 105.A O no hydrogen 3.361 N/A HIS 110.A NE2 GLN 65.A OE1 no hydrogen 2.936 N/A PHE 111.A N THR 108.A O no hydrogen 3.127 N/A ARG 112.A N ALA 109.A O no hydrogen 3.240 N/A ARG 112.A NE ASP 114.A OD1 no hydrogen 3.433 N/A GLY 113.A N VAL 148.A O no hydrogen 3.051 N/A ARG 115.A N ARG 112.A O no hydrogen 2.984 N/A CYS 116.A N ARG 112.A O no hydrogen 2.862 N/A CYS 116.A SG SER 72.A O no hydrogen 3.283 N/A THR 118.A OG1 GLU 74.A O no hydrogen 3.409 N/A LEU 119.A N CYS 116.A O no hydrogen 3.310 N/A LEU 120.A N LYS 117.A O no hydrogen 3.268 N/A LYS 122.A N LEU 119.A O no hydrogen 3.048 N/A LYS 122.A NZ HIS 76.A O no hydrogen 2.598 N/A LYS 122.A NZ THR 77.A O no hydrogen 3.123 N/A LYS 122.A NZ ALA 79.A O no hydrogen 2.695 N/A LYS 122.A NZ THR 118.A O no hydrogen 3.114 N/A LYS 124.A N ASP 151.A O no hydrogen 2.827 N/A LYS 124.A NZ LEU 119.A O no hydrogen 2.955 N/A LYS 124.A NZ LYS 122.A O no hydrogen 2.667 N/A LEU 125.A N PHE 82.A O no hydrogen 2.840 N/A PHE 126.A N LEU 153.A O no hydrogen 2.818 N/A PHE 127.A N CYS 84.A O no hydrogen 2.792 N/A ILE 128.A N ALA 155.A O no hydrogen 2.905 N/A GLN 129.A N LEU 86.A O no hydrogen 2.803 N/A ALA 130.A N SER 157.A OG no hydrogen 3.243 N/A ARG 132.A NH1 THR 158.A O no hydrogen 3.275 N/A ASN 136.A N ASP 114.A OD2 no hydrogen 2.961 N/A THR 138.A OG1 ILE 146.A O no hydrogen 3.338 N/A ASN 141.A N ASP 139.A OD1 no hydrogen 2.613 N/A ARG 143.A N ASN 141.A OD1 no hydrogen 3.015 N/A TYR 144.A N ASN 141.A O no hydrogen 3.042 N/A LYS 145.A N ASN 141.A O no hydrogen 2.942 N/A LYS 145.A NZ ASP 137.A OD2 no hydrogen 3.345 N/A ILE 146.A N THR 138.A OG1 no hydrogen 2.999 N/A ALA 150.A N PRO 147.A O no hydrogen 3.296 N/A ASP 151.A N MET 215.A O no hydrogen 2.934 N/A LEU 153.A N LYS 124.A O no hydrogen 3.026 N/A PHE 154.A N VAL 213.A O no hydrogen 2.705 N/A ALA 155.A N PHE 126.A O no hydrogen 2.766 N/A TYR 156.A N CYS 211.A O no hydrogen 3.032 N/A SER 157.A N ILE 128.A O no hydrogen 3.010 N/A SER 157.A OG ILE 128.A O no hydrogen 3.540 N/A SER 157.A OG SER 164.A OG no hydrogen 2.650 N/A THR 158.A OG1 VAL 159.A O no hydrogen 3.361 N/A THR 158.A OG1 TYR 163.A O no hydrogen 3.499 N/A GLY 161.A N GLY 133.A O no hydrogen 2.856 N/A TYR 162.A N VAL 159.A O no hydrogen 3.103 N/A SER 164.A OG GLN 129.A OE1 no hydrogen 2.468 N/A SER 164.A OG SER 157.A OG no hydrogen 2.650 N/A TRP 165.A N GLN 208.A OE1 no hydrogen 2.908 N/A ARG 166.A NH1 ASN 33.A O no hydrogen 2.899 N/A SER 167.A N GLY 171.A O no hydrogen 2.775 N/A ARG 170.A N SER 167.A O no hydrogen 2.999 N/A GLY 171.A N SER 167.A O no hydrogen 2.560 N/A SER 172.A N ASP 38.A OD1 no hydrogen 3.171 N/A SER 172.A N ASP 38.A OD2 no hydrogen 3.104 N/A SER 172.A OG ASP 38.A OD2 no hydrogen 3.085 N/A GLN 176.A N SER 172.A O no hydrogen 3.312 N/A ALA 177.A N TRP 173.A O no hydrogen 2.938 N/A LEU 178.A N PHE 174.A O no hydrogen 2.877 N/A CYS 179.A N VAL 175.A O no hydrogen 2.875 N/A CYS 179.A SG ALA 41.A O no hydrogen 3.275 N/A SER 180.A N GLN 176.A O no hydrogen 3.125 N/A ILE 181.A N ALA 177.A O no hydrogen 3.274 N/A LEU 182.A N LEU 178.A O no hydrogen 3.038 N/A GLU 183.A N CYS 179.A O no hydrogen 2.891 N/A GLU 184.A N SER 180.A O no hydrogen 3.354 N/A HIS 185.A N ILE 181.A O no hydrogen 2.683 N/A HIS 185.A ND1 ASP 188.A OD1 no hydrogen 3.004 N/A GLY 186.A N LEU 182.A O no hydrogen 2.959 N/A LYS 187.A NZ SER 48.A O no hydrogen 2.531 N/A ASP 188.A N HIS 185.A O no hydrogen 3.424 N/A LEU 189.A N HIS 185.A O no hydrogen 3.101 N/A GLU 190.A N GLN 193.A OE1 no hydrogen 2.954 N/A ILE 191.A N LEU 220.A O no hydrogen 2.967 N/A MET 192.A N GLU 190.A OE1 no hydrogen 2.690 N/A ILE 194.A N GLU 190.A O no hydrogen 3.063 N/A LEU 195.A N ILE 191.A O no hydrogen 3.005 N/A THR 196.A N MET 192.A O no hydrogen 2.935 N/A THR 196.A OG1 MET 192.A O no hydrogen 2.472 N/A ARG 197.A N GLN 193.A O no hydrogen 3.243 N/A VAL 198.A N ILE 194.A O no hydrogen 3.031 N/A ASN 199.A N LEU 195.A O no hydrogen 2.925 N/A ASP 200.A N THR 196.A O no hydrogen 3.164 N/A ARG 201.A N ARG 197.A O no hydrogen 2.844 N/A ARG 201.A NH1 SER 180.A OG no hydrogen 2.803 N/A VAL 202.A N VAL 198.A O no hydrogen 3.112 N/A ALA 203.A N ASN 199.A O no hydrogen 3.080 N/A ARG 204.A N ASP 200.A O no hydrogen 2.772 N/A ARG 204.A NE ASP 200.A OD2 no hydrogen 3.083 N/A HIS 205.A N VAL 202.A O no hydrogen 3.376 N/A PHE 206.A N ALA 203.A O no hydrogen 3.345 N/A LYS 207.A NZ TYR 162.A OH no hydrogen 3.439 N/A GLN 208.A NE2 SER 157.A O no hydrogen 2.921 N/A CYS 211.A N TYR 156.A O no hydrogen 3.185 N/A CYS 211.A SG THR 158.A O no hydrogen 4.030 N/A VAL 213.A N PHE 154.A O no hydrogen 2.778 N/A MET 215.A N PHE 152.A O no hydrogen 2.642 N/A LEU 216.A N SER 214.A OG no hydrogen 3.293 N/A THR 217.A N TYR 5.A OH no hydrogen 2.922 N/A THR 217.A OG1 ASP 151.A OD1 no hydrogen 2.759 N/A GLU 219.A N TYR 3.A O no hydrogen 2.816 N/A LEU 220.A N GLU 190.A OE2 no hydrogen 2.585 N/A SER 223.A N TYR 221.A O no hydrogen 3.013 N/A