Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4rol_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): SER 3.A N ASP 6.A OD2 no hydrogen 2.940 N/A SER 3.A OG ASP 6.A OD2 no hydrogen 3.062 N/A ASP 6.A N SER 3.A OG no hydrogen 3.144 N/A LYS 7.A N SER 3.A O no hydrogen 3.026 N/A THR 8.A N PRO 4.A O no hydrogen 3.027 N/A THR 8.A OG1 PRO 4.A O no hydrogen 3.291 N/A ASN 9.A N ALA 5.A O no hydrogen 2.897 N/A ASN 9.A ND2 SER 124.A OG no hydrogen 2.955 N/A VAL 10.A N ASP 6.A O no hydrogen 2.828 N/A LYS 11.A N LYS 7.A O no hydrogen 2.921 N/A LYS 11.A NZ VAL 70.A O no hydrogen 2.916 N/A ALA 12.A N THR 8.A O no hydrogen 3.027 N/A ALA 13.A N ASN 9.A O no hydrogen 2.996 N/A TRP 14.A N VAL 10.A O no hydrogen 2.880 N/A TRP 14.A NE1 THR 67.A OG1 no hydrogen 2.872 N/A VAL 17.A N TRP 14.A O no hydrogen 2.864 N/A GLY 18.A N TRP 14.A O no hydrogen 2.934 N/A HIS 20.A N VAL 17.A O no hydrogen 2.950 N/A HIS 20.A ND1 LYS 16.A O no hydrogen 3.116 N/A TYR 24.A N HIS 20.A O no hydrogen 3.139 N/A GLY 25.A N ALA 21.A O no hydrogen 2.740 N/A ALA 26.A N GLY 22.A O no hydrogen 2.901 N/A GLU 27.A N GLU 23.A O no hydrogen 3.048 N/A ALA 28.A N TYR 24.A O no hydrogen 2.904 N/A LEU 29.A N GLY 25.A O no hydrogen 3.034 N/A GLU 30.A N ALA 26.A O no hydrogen 2.967 N/A ARG 31.A N GLU 27.A O no hydrogen 2.839 N/A ARG 31.A NE GLU 27.A OE1 no hydrogen 2.970 N/A ARG 31.A NH2 GLU 27.A OE1 no hydrogen 2.874 N/A MET 32.A N ALA 28.A O no hydrogen 2.946 N/A PHE 33.A N LEU 29.A O no hydrogen 2.811 N/A LEU 34.A N GLU 30.A O no hydrogen 2.991 N/A SER 35.A N ARG 31.A O no hydrogen 2.862 N/A SER 35.A OG ARG 31.A O no hydrogen 3.194 N/A PHE 36.A N MET 32.A O no hydrogen 2.806 N/A THR 39.A N PHE 36.A O no hydrogen 2.889 N/A THR 39.A OG1 MET 32.A O no hydrogen 3.374 N/A THR 39.A OG1 PHE 36.A O no hydrogen 2.711 N/A LYS 40.A N PRO 37.A O no hydrogen 2.919 N/A THR 41.A N THR 38.A O no hydrogen 3.102 N/A THR 41.A OG1 THR 38.A O no hydrogen 2.756 N/A TYR 42.A N THR 39.A O no hydrogen 3.231 N/A PHE 43.A N LYS 40.A O no hydrogen 3.040 N/A HIS 45.A N HIS 45.A ND1 no hydrogen 2.862 N/A PHE 46.A N PHE 43.A O no hydrogen 3.106 N/A ASP 47.A N GLN 54.A OE1 no hydrogen 2.847 N/A SER 49.A N ASP 47.A OD1 no hydrogen 3.133 N/A SER 49.A OG ASP 47.A OD1 no hydrogen 2.634 N/A HIS 50.A ND1 GLU 30.A OE1 no hydrogen 2.757 N/A SER 52.A N SER 49.A O no hydrogen 3.010 N/A SER 52.A OG ASP 47.A O no hydrogen 2.763 N/A GLN 54.A NE2 HIS 45.A O no hydrogen 3.215 N/A VAL 55.A N SER 52.A OG no hydrogen 3.140 N/A LYS 56.A N SER 52.A O no hydrogen 3.027 N/A GLY 57.A N ALA 53.A O no hydrogen 2.801 N/A HIS 58.A N GLN 54.A O no hydrogen 3.009 N/A GLY 59.A N VAL 55.A O no hydrogen 2.811 N/A LYS 60.A N LYS 56.A O no hydrogen 3.012 N/A LYS 60.A NZ ASP 64.A OD2 no hydrogen 2.781 N/A LYS 61.A N GLY 57.A O no hydrogen 3.046 N/A VAL 62.A N HIS 58.A O no hydrogen 2.894 N/A ALA 63.A N GLY 59.A O no hydrogen 2.978 N/A ASP 64.A N LYS 60.A O no hydrogen 2.718 N/A ALA 65.A N LYS 61.A O no hydrogen 3.012 N/A LEU 66.A N VAL 62.A O no hydrogen 3.095 N/A THR 67.A N ALA 63.A O no hydrogen 2.918 N/A THR 67.A OG1 ALA 63.A O no hydrogen 2.963 N/A ASN 68.A N ASP 64.A O no hydrogen 3.072 N/A ALA 69.A N ALA 65.A O no hydrogen 3.056 N/A VAL 70.A N LEU 66.A O no hydrogen 2.879 N/A ALA 71.A N THR 67.A O no hydrogen 3.011 N/A HIS 72.A N ASN 68.A O no hydrogen 2.881 N/A VAL 73.A N VAL 70.A O no hydrogen 3.345 N/A ASP 75.A N HIS 72.A O no hydrogen 2.921 N/A ASN 78.A ND2 ASP 75.A OD2 no hydrogen 2.543 N/A ALA 79.A N ASP 75.A O no hydrogen 3.094 N/A LEU 80.A N MET 76.A O no hydrogen 2.939 N/A SER 81.A N ASN 78.A O no hydrogen 3.134 N/A SER 84.A N LEU 80.A O no hydrogen 2.749 N/A SER 84.A OG VAL 135.A O no hydrogen 2.831 N/A ASP 85.A N SER 81.A O no hydrogen 3.052 N/A LEU 86.A N ALA 82.A O no hydrogen 3.118 N/A HIS 87.A N LEU 83.A O no hydrogen 3.076 N/A HIS 87.A ND1 LEU 83.A O no hydrogen 2.917 N/A ALA 88.A N SER 84.A O no hydrogen 2.943 N/A HIS 89.A N ASP 85.A O no hydrogen 2.942 N/A LYS 90.A N LEU 86.A O no hydrogen 3.035 N/A LEU 91.A N LEU 86.A O no hydrogen 3.005 N/A ARG 92.A N HIS 87.A O no hydrogen 2.724 N/A ARG 92.A NE LYS 90.A O no hydrogen 3.090 N/A ASP 94.A N TYR 42.A OH no hydrogen 3.037 N/A VAL 96.A N ASP 94.A OD2 no hydrogen 2.997 N/A ASN 97.A N ASP 94.A O no hydrogen 3.057 N/A ASN 97.A ND2 ASP 94.A O no hydrogen 3.069 N/A PHE 98.A N PRO 95.A O no hydrogen 3.162 N/A LYS 99.A N VAL 96.A O no hydrogen 3.265 N/A LEU 101.A N ASN 97.A O no hydrogen 3.089 N/A SER 102.A N PHE 98.A O no hydrogen 2.972 N/A SER 102.A OG PHE 98.A O no hydrogen 2.747 N/A HIS 103.A N LYS 99.A O no hydrogen 3.026 N/A CYS 104.A N LEU 100.A O no hydrogen 3.047 N/A CYS 104.A SG LEU 100.A O no hydrogen 3.473 N/A LEU 105.A N LEU 101.A O no hydrogen 2.838 N/A LEU 106.A N SER 102.A O no hydrogen 2.994 N/A VAL 107.A N HIS 103.A O no hydrogen 2.966 N/A THR 108.A N CYS 104.A O no hydrogen 3.019 N/A THR 108.A OG1 CYS 104.A O no hydrogen 2.752 N/A LEU 109.A N LEU 105.A O no hydrogen 2.906 N/A ALA 110.A N LEU 106.A O no hydrogen 2.778 N/A ALA 111.A N VAL 107.A O no hydrogen 2.893 N/A HIS 112.A N THR 108.A O no hydrogen 3.068 N/A HIS 112.A N LEU 109.A O no hydrogen 3.301 N/A HIS 112.A NE2 GLU 27.A OE2 no hydrogen 2.614 N/A LEU 113.A N LEU 109.A O no hydrogen 2.752 N/A GLU 116.A N GLU 116.A OE1 no hydrogen 2.596 N/A PHE 117.A N LEU 113.A O no hydrogen 2.969 N/A THR 118.A N GLU 116.A O no hydrogen 2.811 N/A VAL 121.A N THR 118.A OG1 no hydrogen 3.239 N/A HIS 122.A N THR 118.A O no hydrogen 2.786 N/A ALA 123.A N PRO 119.A O no hydrogen 2.946 N/A SER 124.A N ALA 120.A O no hydrogen 3.071 N/A SER 124.A OG ASP 6.A OD1 no hydrogen 2.634 N/A SER 124.A OG ALA 120.A O no hydrogen 3.306 N/A LEU 125.A N VAL 121.A O no hydrogen 2.804 N/A ASP 126.A N HIS 122.A O no hydrogen 3.040 N/A LYS 127.A N ALA 123.A O no hydrogen 3.076 N/A LYS 127.A NZ VAL 1.A O no hydrogen 2.654 N/A LYS 127.A NZ ASP 6.A OD2 no hydrogen 2.701 N/A PHE 128.A N SER 124.A O no hydrogen 2.828 N/A LEU 129.A N LEU 125.A O no hydrogen 2.949 N/A ALA 130.A N ASP 126.A O no hydrogen 2.967 N/A SER 131.A N LYS 127.A O no hydrogen 2.923 N/A SER 131.A OG.A LYS 127.A O no hydrogen 2.935 N/A VAL 132.A N PHE 128.A O no hydrogen 2.916 N/A SER 133.A N LEU 129.A O no hydrogen 2.942 N/A SER 133.A OG LEU 129.A O no hydrogen 2.913 N/A THR 134.A N ALA 130.A O no hydrogen 2.871 N/A THR 134.A OG1 ALA 130.A O no hydrogen 2.994 N/A VAL 135.A N SER 131.A O no hydrogen 2.995 N/A LEU 136.A N VAL 132.A O no hydrogen 2.877 N/A THR 137.A N SER 133.A O no hydrogen 3.020 N/A THR 137.A N THR 134.A O no hydrogen 3.208 N/A THR 137.A OG1 SER 133.A O no hydrogen 3.065 N/A THR 137.A OG1 THR 134.A O no hydrogen 3.362 N/A SER 138.A N VAL 135.A O no hydrogen 3.214 N/A SER 138.A OG VAL 135.A O no hydrogen 2.760 N/A LYS 139.A NZ SER 81.A O no hydrogen 3.192 N/A LYS 139.A NZ SER 81.A OG no hydrogen 2.986 N/A LYS 139.A NZ ASP 85.A OD1 no hydrogen 2.921 N/A TYR 140.A N THR 137.A O no hydrogen 3.257 N/A TYR 140.A OH VAL 93.A O no hydrogen 2.589 N/A