Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3reg_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A NZ GLU 49.A OE1 no hydrogen 3.550 N/A LEU 4.A N ILE 52.A O no hydrogen 3.069 N/A LYS 5.A N ASP 76.A OD2 no hydrogen 2.736 N/A LYS 5.A NZ SER 71.A O no hydrogen 2.952 N/A LYS 5.A NZ ALA 73.A O no hydrogen 2.867 N/A ILE 6.A N HIS 54.A O no hydrogen 2.861 N/A VAL 7.A N VAL 77.A O no hydrogen 2.966 N/A VAL 8.A N TRP 56.A O no hydrogen 3.034 N/A VAL 9.A N LEU 79.A O no hydrogen 3.083 N/A LYS 16.A NZ GLY 10.A O no hydrogen 2.982 N/A LYS 16.A NZ ASP 11.A O no hydrogen 3.031 N/A THR 17.A OG1 THR 35.A OG1 no hydrogen 2.804 N/A THR 17.A OG1 ASP 57.A OD1 no hydrogen 3.569 N/A THR 17.A OG1 ASP 57.A OD2 no hydrogen 2.503 N/A LEU 19.A N GLY 15.A O no hydrogen 2.899 N/A LEU 20.A N LYS 16.A O no hydrogen 3.254 N/A LEU 21.A N THR 17.A O no hydrogen 3.027 N/A ALA 22.A N CYS 18.A O no hydrogen 2.764 N/A PHE 23.A N LEU 19.A O no hydrogen 2.974 N/A SER 24.A N LEU 20.A O no hydrogen 2.972 N/A SER 24.A OG LEU 20.A O no hydrogen 2.793 N/A LYS 25.A N LEU 21.A O no hydrogen 2.806 N/A GLY 26.A N LEU 21.A O no hydrogen 3.272 N/A GLY 26.A N ALA 22.A O no hydrogen 3.065 N/A THR 35.A OG1 THR 17.A OG1 no hydrogen 2.804 N/A THR 35.A OG1 ASP 57.A OD2 no hydrogen 3.351 N/A GLU 38.A N ASP 57.A O no hydrogen 3.241 N/A PHE 40.A N LEU 55.A O no hydrogen 2.735 N/A SER 41.A OG HIS 54.A ND1 no hydrogen 3.361 N/A HIS 42.A N LEU 53.A O no hydrogen 2.801 N/A MET 44.A N PHE 51.A O no hydrogen 2.890 N/A TYR 46.A N GLU 49.A O no hydrogen 2.959 N/A TYR 46.A OH ASP 164.A OD1 no hydrogen 2.918 N/A TYR 46.A OH ASP 164.A OD2 no hydrogen 2.854 N/A LYS 47.A NZ TYR 46.A OH no hydrogen 2.828 N/A GLU 49.A N TYR 46.A O no hydrogen 3.061 N/A PHE 51.A N MET 44.A O no hydrogen 2.833 N/A ILE 52.A N LYS 2.A O no hydrogen 3.004 N/A LEU 53.A N HIS 42.A O no hydrogen 2.693 N/A HIS 54.A N LEU 4.A O no hydrogen 2.867 N/A LEU 55.A N PHE 40.A O no hydrogen 2.644 N/A TRP 56.A N ILE 6.A O no hydrogen 2.840 N/A ASP 57.A N GLU 38.A O no hydrogen 2.630 N/A THR 58.A OG1 VAL 8.A O no hydrogen 2.694 N/A GLU 63.A N GLU 63.A OE1 no hydrogen 2.774 N/A TYR 64.A N GLN 61.A O no hydrogen 3.112 N/A ASP 65.A N GLU 62.A O no hydrogen 2.961 N/A LEU 67.A N TYR 64.A O no hydrogen 3.034 N/A ARG 68.A N TYR 64.A O no hydrogen 3.212 N/A ARG 68.A NE GLU 100.A OE2 no hydrogen 2.760 N/A ARG 68.A NH1 ALA 59.A O no hydrogen 2.928 N/A ARG 68.A NH1 ASP 65.A OD1 no hydrogen 3.222 N/A ARG 68.A NH2 ASP 65.A OD1 no hydrogen 2.481 N/A ARG 68.A NH2 GLU 100.A OE1 no hydrogen 3.171 N/A ARG 68.A NH2 GLU 100.A OE2 no hydrogen 3.180 N/A LEU 70.A N LEU 67.A O no hydrogen 3.002 N/A SER 71.A N ARG 68.A O no hydrogen 2.826 N/A TYR 72.A N PRO 69.A O no hydrogen 3.146 N/A TYR 72.A OH GLU 100.A OE2 no hydrogen 2.614 N/A SER 75.A N TYR 72.A O no hydrogen 3.147 N/A SER 75.A OG TYR 72.A O no hydrogen 2.862 N/A ASP 76.A N LYS 5.A O no hydrogen 2.894 N/A VAL 77.A N LYS 5.A O no hydrogen 3.125 N/A VAL 78.A N LYS 109.A O no hydrogen 2.804 N/A LEU 79.A N VAL 7.A O no hydrogen 2.776 N/A LEU 80.A N VAL 111.A O no hydrogen 2.842 N/A CYS 81.A N VAL 9.A O no hydrogen 2.942 N/A CYS 81.A SG LEU 79.A O no hydrogen 3.619 N/A PHE 82.A N VAL 113.A O no hydrogen 3.213 N/A ALA 83.A N SER 89.A OG no hydrogen 2.983 N/A VAL 84.A N LEU 115.A O no hydrogen 2.947 N/A ASN 86.A N ALA 83.A O no hydrogen 2.921 N/A ARG 87.A NE ASP 125.A O no hydrogen 2.992 N/A ARG 87.A NH1 GLU 131.A OE1 no hydrogen 2.810 N/A ARG 87.A NH2 ASP 125.A O no hydrogen 2.943 N/A ARG 87.A NH2 GLU 131.A OE1 no hydrogen 3.286 N/A ARG 87.A NH2 GLU 131.A OE2 no hydrogen 2.890 N/A SER 89.A N ASN 86.A OD1 no hydrogen 3.037 N/A SER 89.A OG ASN 86.A O no hydrogen 2.657 N/A PHE 90.A N ASN 86.A O no hydrogen 3.299 N/A ASP 91.A N ARG 87.A O no hydrogen 2.851 N/A ASN 92.A N THR 88.A O no hydrogen 2.852 N/A ASN 92.A ND2 ASP 11.A OD1 no hydrogen 3.299 N/A ASN 92.A ND2 ASP 11.A OD2 no hydrogen 2.794 N/A ILE 93.A N PHE 90.A O no hydrogen 3.078 N/A SER 94.A N ASP 91.A O no hydrogen 3.110 N/A THR 95.A N ASP 91.A O no hydrogen 3.419 N/A THR 95.A OG1 ASP 91.A O no hydrogen 3.465 N/A LYS 96.A N ASN 92.A O no hydrogen 2.845 N/A LYS 96.A NZ ASP 65.A OD1 no hydrogen 2.872 N/A LYS 96.A NZ ASP 65.A OD2 no hydrogen 3.266 N/A TRP 97.A N ASN 92.A O no hydrogen 3.055 N/A TRP 97.A NE1 ASP 11.A OD1 no hydrogen 2.782 N/A GLU 98.A N ILE 93.A O no hydrogen 2.828 N/A GLU 100.A N LYS 96.A O no hydrogen 3.031 N/A ILE 101.A N TRP 97.A O no hydrogen 2.967 N/A LYS 102.A N GLU 98.A O no hydrogen 2.898 N/A HIS 103.A N PRO 99.A O no hydrogen 2.980 N/A TYR 104.A N GLU 100.A O no hydrogen 3.268 N/A ILE 105.A N ILE 101.A O no hydrogen 2.848 N/A ALA 108.A N ILE 105.A O no hydrogen 3.012 N/A LYS 109.A N ASP 76.A O no hydrogen 3.047 N/A LYS 109.A NZ CYS 165.A O no hydrogen 2.634 N/A VAL 111.A N VAL 78.A O no hydrogen 2.939 N/A LEU 112.A N ALA 143.A O no hydrogen 2.933 N/A VAL 113.A N LEU 80.A O no hydrogen 2.988 N/A GLY 114.A N ILE 145.A O no hydrogen 2.912 N/A LEU 115.A N PHE 82.A O no hydrogen 2.752 N/A LYS 116.A NZ ALA 13.A O no hydrogen 3.007 N/A VAL 117.A N ALA 147.A O no hydrogen 3.039 N/A LEU 119.A N LYS 116.A O no hydrogen 2.872 N/A ARG 120.A N VAL 117.A O no hydrogen 3.238 N/A ARG 120.A NH1 VAL 127.A O no hydrogen 2.899 N/A ARG 120.A NH1 GLU 146.A OE2 no hydrogen 2.651 N/A ARG 120.A NH2 GLU 146.A OE1 no hydrogen 2.696 N/A ARG 120.A NH2 GLU 146.A OE2 no hydrogen 3.513 N/A LYS 121.A N ASP 126.A OD2 no hydrogen 3.098 N/A LYS 121.A NZ LEU 119.A O no hydrogen 2.919 N/A SER 124.A OG LYS 121.A O no hydrogen 3.170 N/A SER 124.A OG ASP 126.A OD2 no hydrogen 3.211 N/A VAL 127.A N VAL 84.A O no hydrogen 2.813 N/A THR 128.A N GLU 131.A OE2 no hydrogen 3.001 N/A LYS 129.A NZ ASP 133.A OD1 no hydrogen 3.142 N/A GLN 130.A NE2 ASP 134.A OD2 no hydrogen 2.904 N/A GLU 131.A N THR 128.A OG1 no hydrogen 3.192 N/A GLY 132.A N THR 128.A O no hydrogen 3.142 N/A ASP 133.A N LYS 129.A O no hydrogen 2.962 N/A ASP 134.A N GLN 130.A O no hydrogen 2.795 N/A LEU 135.A N GLU 131.A O no hydrogen 2.942 N/A CYS 136.A N GLY 132.A O no hydrogen 2.877 N/A CYS 136.A SG CYS 141.A O no hydrogen 3.524 N/A GLN 137.A N ASP 133.A O no hydrogen 3.071 N/A LYS 138.A N ASP 134.A O no hydrogen 2.956 N/A LYS 138.A NZ SER 94.A OG no hydrogen 3.023 N/A LEU 139.A N LEU 135.A O no hydrogen 2.875 N/A GLY 140.A N GLN 137.A O no hydrogen 3.351 N/A CYS 141.A N CYS 136.A O no hydrogen 2.971 N/A CYS 141.A SG THR 110.A OG1 no hydrogen 3.354 N/A VAL 142.A N THR 110.A O no hydrogen 2.841 N/A TYR 144.A OH GLU 146.A OE2 no hydrogen 2.637 N/A ILE 145.A N LEU 112.A O no hydrogen 2.921 N/A ALA 147.A N GLY 114.A O no hydrogen 2.982 N/A SER 148.A N ILE 153.A O no hydrogen 2.890 N/A SER 148.A OG ASP 118.A OD1 no hydrogen 2.617 N/A ALA 151.A N SER 148.A OG no hydrogen 2.937 N/A LYS 152.A NZ GLY 26.A O no hydrogen 2.818 N/A ILE 153.A N SER 148.A O no hydrogen 2.990 N/A VAL 158.A N GLY 154.A O no hydrogen 3.193 N/A GLU 160.A N ASN 156.A O no hydrogen 2.784 N/A LYS 161.A N GLU 157.A O no hydrogen 3.007 N/A LYS 161.A NZ GLU 157.A OE2 no hydrogen 3.295 N/A SER 162.A N VAL 158.A O no hydrogen 2.967 N/A SER 162.A OG VAL 158.A O no hydrogen 2.945 N/A VAL 163.A N PHE 159.A O no hydrogen 2.909 N/A ASP 164.A N GLU 160.A O no hydrogen 2.826 N/A CYS 165.A N LYS 161.A O no hydrogen 2.947 N/A CYS 165.A SG LYS 161.A O no hydrogen 3.840 N/A CYS 165.A SG SER 162.A O no hydrogen 3.366 N/A ILE 166.A N VAL 163.A O no hydrogen 3.036 N/A PHE 167.A N VAL 163.A O no hydrogen 2.806 N/A SER 168.A N ASP 164.A O no hydrogen 2.770 N/A SER 168.A OG ASP 164.A O no hydrogen 2.807 N/A SER 168.A OG LYS 170.A O no hydrogen 2.459 N/A LYS 170.A N SER 168.A OG no hydrogen 3.233 N/A