Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ja1_SH.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 1.A N GLN 3.A OE1 no hydrogen 3.030 N/A ASP 4.A N MET 2.A O no hydrogen 2.808 N/A ILE 6.A N ASP 4.A OD2 no hydrogen 3.160 N/A ALA 7.A N ASP 4.A OD2 no hydrogen 2.835 N/A LEU 10.A N ILE 6.A O no hydrogen 2.822 N/A THR 11.A N ALA 7.A O no hydrogen 2.805 N/A THR 11.A OG1 ALA 7.A O no hydrogen 2.631 N/A ARG 12.A N ASP 8.A O no hydrogen 2.817 N/A ARG 12.A NE ASP 8.A OD1 no hydrogen 2.930 N/A ARG 12.A NE ASP 8.A OD2 no hydrogen 3.029 N/A ARG 12.A NH2 ASP 8.A OD1 no hydrogen 3.333 N/A ILE 13.A N MET 9.A O no hydrogen 3.268 N/A ARG 14.A N LEU 10.A O no hydrogen 2.884 N/A ARG 14.A NH2 THR 11.A OG1 no hydrogen 3.048 N/A ASN 15.A N THR 11.A O no hydrogen 2.875 N/A ASN 15.A ND2 THR 11.A O no hydrogen 3.280 N/A GLY 16.A N ARG 12.A O no hydrogen 2.863 N/A GLN 17.A N ILE 13.A O no hydrogen 2.872 N/A ALA 18.A N ARG 14.A O no hydrogen 3.044 N/A ALA 19.A N ASN 15.A O no hydrogen 2.997 N/A ASN 20.A N GLN 17.A O no hydrogen 3.406 N/A ASN 20.A ND2 ASN 20.A O no hydrogen 2.733 N/A LYS 21.A N GLY 16.A O no hydrogen 2.793 N/A ALA 22.A N ASN 20.A O no hydrogen 2.816 N/A VAL 24.A N LEU 60.A O no hydrogen 2.857 N/A THR 25.A OG1 LEU 58.A O no hydrogen 2.961 N/A MET 26.A N LEU 58.A O no hydrogen 3.018 N/A SER 28.A N PRO 56.A O no hydrogen 2.963 N/A SER 28.A OG SER 29.A O no hydrogen 3.092 N/A LYS 32.A N SER 29.A OG no hydrogen 2.979 N/A LYS 32.A NZ PRO 27.A O no hydrogen 3.092 N/A LYS 32.A NZ SER 28.A O no hydrogen 2.746 N/A VAL 33.A N SER 29.A O no hydrogen 3.300 N/A ALA 34.A N LYS 30.A O no hydrogen 2.759 N/A ILE 35.A N LEU 31.A O no hydrogen 2.841 N/A ALA 36.A N LYS 32.A O no hydrogen 2.948 N/A ASN 37.A N VAL 33.A O no hydrogen 2.778 N/A VAL 38.A N ALA 34.A O no hydrogen 3.230 N/A LEU 39.A N ILE 35.A O no hydrogen 2.771 N/A LYS 40.A N ALA 36.A O no hydrogen 2.806 N/A LYS 40.A NZ ASP 47.A OD1 no hydrogen 2.653 N/A GLU 41.A N ASN 37.A O no hydrogen 3.170 N/A GLU 42.A N VAL 38.A O no hydrogen 2.952 N/A GLY 43.A N LYS 40.A O no hydrogen 3.213 N/A PHE 44.A N LEU 39.A O no hydrogen 3.480 N/A GLU 46.A N THR 61.A O no hydrogen 3.160 N/A LYS 49.A N GLU 59.A O no hydrogen 2.755 N/A GLY 52.A N GLU 51.A OE2 no hydrogen 2.794 N/A GLU 57.A N GLU 51.A O no hydrogen 2.761 N/A LEU 58.A N MET 26.A O no hydrogen 2.994 N/A GLU 59.A N LYS 49.A O no hydrogen 2.850 N/A LEU 60.A N VAL 24.A O no hydrogen 3.194 N/A THR 61.A N ASP 47.A O no hydrogen 2.818 N/A THR 61.A OG1 ASP 47.A O no hydrogen 3.106 N/A LYS 63.A NZ GLY 43.A O no hydrogen 2.853 N/A LYS 63.A NZ PHE 44.A O no hydrogen 2.612 N/A PHE 65.A N GLN 66.A OE1 no hydrogen 3.072 N/A GLN 66.A N GLN 66.A OE1 no hydrogen 2.670 N/A GLN 66.A NE2 ALA 69.A O no hydrogen 2.604 N/A LYS 68.A N GLN 66.A OE1 no hydrogen 2.861 N/A LYS 68.A NZ GLY 67.A O no hydrogen 3.241 N/A VAL 70.A N GLN 17.A OE1 no hydrogen 2.760 N/A VAL 71.A N GLN 17.A OE1 no hydrogen 2.688 N/A GLU 72.A N ALA 129.A OXT no hydrogen 2.831 N/A GLN 75.A N TYR 127.A O no hydrogen 3.000 N/A GLN 75.A NE2 SER 73.A O no hydrogen 3.594 N/A ARG 76.A NE SER 78.A O no hydrogen 2.702 N/A ARG 76.A NH1 ASP 4.A OD2 no hydrogen 2.577 N/A ARG 76.A NH2 ASP 4.A OD2 no hydrogen 3.400 N/A VAL 77.A N ILE 125.A O no hydrogen 3.120 N/A SER 78.A N ILE 124.A O no hydrogen 3.193 N/A ARG 79.A N SER 78.A OG no hydrogen 2.660 N/A ARG 79.A NH1 PRO 80.A O no hydrogen 2.591 N/A ARG 79.A NH2 ASP 4.A OD1 no hydrogen 2.583 N/A ARG 79.A NH2 PRO 80.A O no hydrogen 2.788 N/A ARG 83.A NH1 GLU 123.A OE2 no hydrogen 3.044 N/A ILE 84.A N SER 78.A OG no hydrogen 2.984 N/A GLU 90.A N ARG 87.A O no hydrogen 2.793 N/A LEU 91.A N ARG 87.A O no hydrogen 3.135 N/A GLY 97.A N LYS 93.A O no hydrogen 3.030 N/A LEU 98.A N MET 95.A O no hydrogen 3.160 N/A GLY 99.A N VAL 94.A O no hydrogen 2.817 N/A VAL 102.A N CYS 126.A O no hydrogen 3.076 N/A VAL 103.A N MET 110.A O no hydrogen 2.880 N/A SER 104.A N GLU 123.A O no hydrogen 2.764 N/A THR 105.A N GLY 108.A O no hydrogen 2.700 N/A THR 105.A OG1 GLY 108.A O no hydrogen 2.863 N/A LYS 107.A NZ LYS 107.A O no hydrogen 2.861 N/A GLY 108.A N THR 105.A O no hydrogen 2.890 N/A MET 110.A N VAL 103.A O no hydrogen 3.123 N/A THR 111.A OG1 GLU 42.A OE2 no hydrogen 2.518 N/A ASP 112.A N ALA 101.A O no hydrogen 2.977 N/A ALA 115.A N THR 111.A O no hydrogen 2.863 N/A ARG 116.A N ASP 112.A O no hydrogen 2.751 N/A ARG 116.A NE ASP 112.A OD2 no hydrogen 3.193 N/A ARG 116.A NH1 LEU 91.A O no hydrogen 3.379 N/A ARG 116.A NH2 LEU 91.A O no hydrogen 2.700 N/A ARG 116.A NH2 ASP 112.A OD2 no hydrogen 2.748 N/A GLN 117.A N ARG 113.A O no hydrogen 3.076 N/A ALA 118.A N ALA 114.A O no hydrogen 2.923 N/A GLY 119.A N ARG 116.A O no hydrogen 3.251 N/A GLY 122.A N LYS 86.A O no hydrogen 3.180 N/A GLU 123.A N SER 104.A O no hydrogen 2.991 N/A ILE 125.A N VAL 102.A O no hydrogen 2.951 N/A VAL 128.A N ILE 100.A O no hydrogen 2.999 N/A