Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3rjd_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A N SER 70.A O no hydrogen 3.412 N/A ALA 2.A N GLY 71.A O no hydrogen 3.062 N/A THR 5.A N HIS 22.A O no hydrogen 3.126 N/A GLN 7.A N THR 20.A O no hydrogen 3.043 N/A VAL 11.A N VAL 89.A O no hydrogen 2.974 N/A VAL 13.A N GLU 79.A O no hydrogen 3.005 N/A PHE 14.A N GLU 17.A OE1 no hydrogen 3.144 N/A GLN 15.A N HIS 81.A O no hydrogen 2.925 N/A GLU 16.A N ALA 55.A O no hydrogen 2.924 N/A GLU 17.A N PHE 14.A O no hydrogen 3.321 N/A THR 18.A OG1 THR 53.A O no hydrogen 2.969 N/A VAL 19.A N ILE 52.A O no hydrogen 3.098 N/A LEU 21.A N TYR 50.A O no hydrogen 2.846 N/A HIS 22.A N THR 5.A O no hydrogen 2.838 N/A CYS 23.A N PRO 48.A O no hydrogen 3.014 N/A GLU 24.A N VAL 3.A O no hydrogen 3.277 N/A THR 34.A OG1 SER 32.A O no hydrogen 2.863 N/A GLN 35.A N GLN 66.A O no hydrogen 2.928 N/A PHE 37.A N ARG 64.A O no hydrogen 2.808 N/A LEU 38.A N THR 41.A O no hydrogen 2.842 N/A ASN 39.A N GLU 62.A O no hydrogen 3.082 N/A THR 41.A N LEU 38.A O no hydrogen 3.153 N/A THR 41.A OG1 ASN 39.A O no hydrogen 3.534 N/A THR 43.A N TRP 36.A O no hydrogen 2.758 N/A THR 43.A OG1 TRP 36.A O no hydrogen 2.736 N/A THR 43.A OG1 THR 45.A OG1 no hydrogen 3.275 N/A THR 45.A OG1 THR 43.A OG1 no hydrogen 3.275 N/A TYR 50.A N LEU 21.A O no hydrogen 2.625 N/A ILE 52.A N VAL 19.A O no hydrogen 2.910 N/A SER 54.A OG GLU 16.A O no hydrogen 3.436 N/A ALA 55.A N GLU 17.A O no hydrogen 3.139 N/A SER 56.A N ASP 59.A OD2 no hydrogen 2.963 N/A SER 56.A OG ASP 59.A OD2 no hydrogen 2.975 N/A ASP 59.A N SER 56.A O no hydrogen 2.809 N/A SER 60.A N VAL 57.A O no hydrogen 3.461 N/A SER 60.A OG VAL 57.A O no hydrogen 3.439 N/A GLY 61.A N LEU 78.A O no hydrogen 2.838 N/A GLU 62.A N ASN 39.A OD1 no hydrogen 3.184 N/A TYR 63.A N ILE 76.A O no hydrogen 2.844 N/A TYR 63.A OH ASP 59.A O no hydrogen 2.637 N/A ARG 64.A N PHE 37.A O no hydrogen 3.102 N/A CYS 65.A N SER 73.A OG no hydrogen 2.687 N/A CYS 65.A SG SER 73.A OG no hydrogen 3.294 N/A GLY 68.A N SER 33.A O no hydrogen 3.217 N/A SER 73.A N CYS 65.A O no hydrogen 2.882 N/A SER 73.A OG CYS 65.A O no hydrogen 3.285 N/A ILE 76.A N TYR 63.A O no hydrogen 2.947 N/A LEU 78.A N GLY 61.A O no hydrogen 2.829 N/A GLU 79.A N VAL 11.A O no hydrogen 3.159 N/A ILE 80.A N SER 60.A OG no hydrogen 2.833 N/A HIS 81.A N VAL 13.A O no hydrogen 2.820 N/A HIS 81.A NE2 GLU 79.A OE1 no hydrogen 2.902 N/A LEU 86.A N HIS 105.A O no hydrogen 2.733 N/A GLN 88.A N ARG 103.A O no hydrogen 2.690 N/A GLN 88.A NE2 SER 12.A O no hydrogen 2.898 N/A SER 90.A OG ALA 101.A O no hydrogen 3.301 N/A SER 91.A OG VAL 93.A O no hydrogen 3.385 N/A ARG 92.A NE GLN 77.A O no hydrogen 2.770 N/A ARG 92.A NH2 GLN 77.A O no hydrogen 2.788 N/A PHE 94.A N THR 164.A O no hydrogen 2.888 N/A THR 95.A N GLU 98.A OE2 no hydrogen 2.958 N/A THR 95.A OG1 GLU 98.A OE2 no hydrogen 2.938 N/A GLU 96.A N LYS 166.A O no hydrogen 2.919 N/A GLY 97.A N THR 138.A O no hydrogen 2.777 N/A LEU 100.A N ILE 135.A O no hydrogen 2.843 N/A ALA 101.A N SER 90.A OG no hydrogen 3.257 N/A LEU 102.A N LEU 133.A O no hydrogen 2.662 N/A ARG 103.A N GLN 88.A O no hydrogen 2.975 N/A ARG 103.A NH1 GLN 88.A OE1 no hydrogen 2.910 N/A CYS 104.A N TYR 117.A OH no hydrogen 2.976 N/A HIS 105.A N LEU 86.A O no hydrogen 2.806 N/A HIS 105.A NE2 GLU 17.A OE2 no hydrogen 2.786 N/A TRP 107.A N TRP 84.A O no hydrogen 2.788 N/A ASP 109.A N ALA 106.A O no hydrogen 3.293 N/A LYS 110.A N TRP 107.A O no hydrogen 3.332 N/A TYR 113.A N MET 151.A O no hydrogen 2.991 N/A ASN 114.A N HIS 128.A O no hydrogen 2.851 N/A VAL 115.A N PHE 127.A O no hydrogen 2.778 N/A LEU 116.A N SER 149.A O no hydrogen 2.762 N/A TYR 117.A N LYS 125.A O no hydrogen 2.917 N/A TYR 117.A OH SER 131.A O no hydrogen 2.846 N/A TYR 118.A N HIS 147.A O no hydrogen 2.900 N/A TYR 118.A OH SER 149.A OG no hydrogen 2.628 N/A ARG 119.A N LYS 122.A O no hydrogen 2.986 N/A ARG 119.A NH1 TYR 146.A OH no hydrogen 3.433 N/A ASN 120.A N THR 145.A O no hydrogen 2.796 N/A ASN 120.A ND2 ASN 143.A O no hydrogen 3.512 N/A LYS 122.A N ARG 119.A O no hydrogen 3.344 N/A PHE 124.A N TYR 117.A O no hydrogen 2.848 N/A PHE 127.A N VAL 115.A O no hydrogen 2.785 N/A ASN 130.A ND2 CYS 104.A O no hydrogen 2.903 N/A SER 131.A OG ASN 132.A O no hydrogen 3.450 N/A LEU 133.A N LEU 102.A O no hydrogen 3.016 N/A ILE 135.A N LEU 100.A O no hydrogen 2.764 N/A THR 138.A OG1 GLU 98.A O no hydrogen 2.722 N/A HIS 142.A N ASN 139.A O no hydrogen 2.980 N/A ASN 143.A N ILE 140.A O no hydrogen 3.363 N/A GLY 144.A N VAL 163.A O no hydrogen 3.155 N/A THR 145.A N ASN 120.A OD1 no hydrogen 2.976 N/A TYR 146.A N ILE 161.A O no hydrogen 2.810 N/A TYR 146.A OH HIS 142.A O no hydrogen 2.621 N/A HIS 147.A N TYR 118.A O no hydrogen 3.172 N/A HIS 147.A ND1 SER 158.A O no hydrogen 3.247 N/A CYS 148.A N SER 158.A OG no hydrogen 2.914 N/A CYS 148.A SG SER 158.A OG no hydrogen 3.684 N/A SER 149.A N LEU 116.A O no hydrogen 3.005 N/A SER 149.A OG TYR 118.A OH no hydrogen 2.628 N/A GLY 150.A N TYR 156.A O no hydrogen 3.187 N/A MET 151.A N TYR 113.A O no hydrogen 2.771 N/A GLY 152.A N HIS 154.A O no hydrogen 3.081 N/A ARG 155.A NH2 ASN 114.A O no hydrogen 2.795 N/A TYR 156.A N GLY 150.A O no hydrogen 2.985 N/A SER 158.A N CYS 148.A O no hydrogen 2.861 N/A SER 158.A OG CYS 148.A O no hydrogen 3.344 N/A SER 158.A OG ALA 159.A O no hydrogen 3.253 N/A ILE 161.A N TYR 146.A O no hydrogen 3.087 N/A VAL 163.A N GLY 144.A O no hydrogen 2.982 N/A THR 164.A N ARG 92.A O no hydrogen 2.716 N/A VAL 165.A N ASN 143.A OD1 no hydrogen 2.597 N/A LYS 166.A N PHE 94.A O no hydrogen 2.724 N/A LEU 168.A N GLU 96.A OE1 no hydrogen 2.804 N/A VAL 173.A N GLU 193.A O no hydrogen 2.966 N/A ASN 175.A N SER 191.A O no hydrogen 3.012 N/A ASN 175.A ND2 GLU 193.A OE1 no hydrogen 3.005 N/A SER 177.A N THR 189.A O no hydrogen 2.817 N/A SER 177.A OG THR 189.A O no hydrogen 3.553 N/A SER 180.A OG GLU 252.A O no hydrogen 3.488 N/A SER 180.A OG GLN 254.A OE1 no hydrogen 3.404 N/A LEU 182.A N GLN 254.A O no hydrogen 2.834 N/A GLU 184.A N LEU 256.A O no hydrogen 2.792 N/A GLY 185.A N ALA 225.A O no hydrogen 2.738 N/A ASN 186.A N LEU 183.A O no hydrogen 3.387 N/A ASN 186.A ND2 LEU 183.A O no hydrogen 3.325 N/A VAL 188.A N ILE 222.A O no hydrogen 3.055 N/A THR 189.A N SER 177.A OG no hydrogen 2.775 N/A LEU 190.A N TYR 220.A O no hydrogen 2.626 N/A SER 191.A N ASN 175.A O no hydrogen 2.802 N/A CYS 192.A N SER 218.A O no hydrogen 2.831 N/A GLU 193.A N VAL 173.A O no hydrogen 2.869 N/A THR 194.A OG1 PRO 170.A O no hydrogen 2.792 N/A LEU 197.A N LEU 168.A O no hydrogen 3.052 N/A TYR 201.A N ALA 238.A O no hydrogen 2.656 N/A PHE 202.A N ASN 215.A O no hydrogen 2.676 N/A SER 203.A N GLU 236.A O no hydrogen 3.061 N/A SER 203.A OG TYR 205.A OH no hydrogen 2.817 N/A PHE 204.A N ARG 212.A O no hydrogen 2.907 N/A TYR 205.A N TRP 234.A O no hydrogen 2.950 N/A TYR 205.A OH SER 203.A OG no hydrogen 2.817 N/A TYR 205.A OH GLU 236.A OE1 no hydrogen 2.872 N/A MET 206.A N LYS 209.A O no hydrogen 2.969 N/A GLY 207.A N LEU 232.A O no hydrogen 2.889 N/A LYS 209.A N MET 206.A O no hydrogen 2.895 N/A LEU 211.A N PHE 204.A O no hydrogen 2.883 N/A ARG 212.A N PHE 204.A O no hydrogen 3.156 N/A ARG 212.A NH1 PHE 202.A O no hydrogen 3.324 N/A ASN 215.A N PHE 202.A O no hydrogen 3.117 N/A SER 217.A N ASN 215.A OD1 no hydrogen 3.097 N/A SER 217.A OG GLU 219.A O no hydrogen 3.292 N/A GLU 219.A N SER 217.A OG no hydrogen 3.355 N/A TYR 220.A N LEU 190.A O no hydrogen 2.799 N/A ILE 222.A N VAL 188.A O no hydrogen 2.779 N/A ALA 225.A N ASN 186.A O no hydrogen 3.002 N/A ARG 226.A N ASP 229.A OD2 no hydrogen 2.753 N/A ARG 227.A N GLU 184.A OE2 no hydrogen 3.230 N/A ASP 229.A N ARG 226.A O no hydrogen 2.869 N/A SER 230.A N ARG 227.A O no hydrogen 3.218 N/A SER 230.A OG ARG 227.A O no hydrogen 2.845 N/A SER 230.A OG VAL 255.A O no hydrogen 3.517 N/A GLY 231.A N LEU 253.A O no hydrogen 3.071 N/A TYR 233.A N LEU 251.A O no hydrogen 2.829 N/A TYR 233.A OH ASP 229.A O no hydrogen 2.539 N/A TRP 234.A N TYR 205.A O no hydrogen 3.137 N/A TRP 234.A NE1 GLY 207.A O no hydrogen 3.211 N/A CYS 235.A N SER 248.A OG no hydrogen 2.759 N/A CYS 235.A SG SER 248.A OG no hydrogen 3.592 N/A GLU 236.A N SER 203.A O no hydrogen 2.981 N/A ALA 237.A N LYS 246.A O no hydrogen 2.989 N/A ALA 238.A N TYR 201.A O no hydrogen 2.908 N/A THR 239.A N VAL 244.A O no hydrogen 3.283 N/A GLY 242.A N THR 239.A O no hydrogen 2.760 N/A ASN 243.A ND2 GLY 97.A O no hydrogen 3.463 N/A VAL 244.A N THR 239.A OG1 no hydrogen 3.333 N/A LYS 246.A N ALA 237.A O no hydrogen 2.754 N/A LYS 246.A NZ GLU 96.A OE1 no hydrogen 3.222 N/A LYS 246.A NZ GLU 96.A OE2 no hydrogen 3.450 N/A LYS 246.A NZ PHE 169.A O no hydrogen 2.254 N/A ARG 247.A NE GLU 236.A OE2 no hydrogen 3.463 N/A SER 248.A N CYS 235.A O no hydrogen 2.958 N/A SER 248.A OG CYS 235.A O no hydrogen 3.238 N/A LEU 251.A N TYR 233.A O no hydrogen 2.630 N/A LEU 253.A N GLY 231.A O no hydrogen 3.063 N/A GLN 254.A N SER 180.A OG no hydrogen 2.921 N/A VAL 255.A N SER 230.A OG no hydrogen 3.016 N/A LEU 256.A N LEU 182.A O no hydrogen 2.808 N/A