Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2grj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 1.A ND1 SER 100.A OG no hydrogen 2.809 N/A HIS 3.A ND1 THR 99.A O no hydrogen 3.080 N/A ILE 5.A N ILE 103.A O no hydrogen 2.853 N/A GLY 6.A N HIS 120.A O no hydrogen 2.869 N/A VAL 7.A N ILE 105.A O no hydrogen 2.848 N/A THR 8.A N ILE 122.A O no hydrogen 2.925 N/A THR 8.A OG1 ALA 107.A O no hydrogen 2.918 N/A THR 8.A OG1 ALA 108.A O no hydrogen 2.816 N/A GLY 9.A N THR 8.A OG1 no hydrogen 2.673 N/A LYS 10.A NZ GLN 145.A O no hydrogen 3.448 N/A ILE 11.A N GLN 145.A OE1 no hydrogen 2.765 N/A THR 13.A N LYS 10.A O no hydrogen 3.403 N/A THR 13.A OG1 LYS 10.A O no hydrogen 2.761 N/A THR 13.A OG1 VAL 124.A O no hydrogen 3.398 N/A LYS 15.A NZ GLY 9.A O no hydrogen 2.812 N/A LYS 15.A NZ LYS 10.A O no hydrogen 2.736 N/A SER 16.A OG GLU 106.A OE2 no hydrogen 2.982 N/A VAL 18.A N GLY 14.A O no hydrogen 2.856 N/A CYS 19.A N LYS 15.A O no hydrogen 2.790 N/A CYS 19.A SG LYS 15.A O no hydrogen 3.258 N/A GLU 20.A N SER 16.A O no hydrogen 2.875 N/A ILE 21.A N THR 17.A O no hydrogen 3.118 N/A LEU 22.A N VAL 18.A O no hydrogen 2.923 N/A LYS 23.A N CYS 19.A O no hydrogen 2.820 N/A ASN 24.A N GLU 20.A O no hydrogen 2.875 N/A ASN 24.A ND2 GLU 20.A OE1 no hydrogen 3.294 N/A LYS 25.A N ILE 21.A O no hydrogen 2.738 N/A TYR 26.A N LEU 22.A O no hydrogen 2.936 N/A GLY 27.A N LYS 23.A O no hydrogen 3.166 N/A ALA 28.A N LEU 22.A O no hydrogen 3.022 N/A HIS 29.A N LEU 102.A O no hydrogen 2.799 N/A VAL 31.A N VAL 104.A O no hydrogen 2.735 N/A VAL 33.A N GLU 106.A O no hydrogen 3.044 N/A ARG 35.A N ASN 32.A OD1 no hydrogen 3.346 N/A ILE 36.A N ASN 32.A O no hydrogen 3.241 N/A GLY 37.A N VAL 33.A O no hydrogen 3.088 N/A HIS 38.A N ASP 34.A O no hydrogen 3.034 N/A GLU 39.A N ARG 35.A O no hydrogen 3.121 N/A VAL 40.A N ILE 36.A O no hydrogen 2.981 N/A LEU 41.A N GLY 37.A O no hydrogen 2.902 N/A VAL 44.A N VAL 40.A O no hydrogen 3.238 N/A VAL 44.A N LEU 41.A O no hydrogen 3.132 N/A LEU 48.A N VAL 44.A O no hydrogen 3.001 N/A VAL 49.A N LYS 45.A O no hydrogen 3.050 N/A GLU 50.A N GLU 46.A O no hydrogen 2.985 N/A LEU 51.A N LYS 47.A O no hydrogen 2.885 N/A PHE 52.A N LEU 48.A O no hydrogen 2.728 N/A GLY 53.A N VAL 49.A O no hydrogen 2.860 N/A LEU 57.A N GLY 54.A O no hydrogen 2.853 N/A GLU 58.A N LYS 61.A O no hydrogen 2.940 N/A ASN 63.A N VAL 56.A O no hydrogen 3.113 N/A LYS 66.A N ASN 63.A OD1 no hydrogen 2.959 N/A LEU 67.A N ASN 63.A O no hydrogen 3.030 N/A ALA 68.A N ARG 64.A O no hydrogen 2.796 N/A GLY 69.A N LYS 65.A O no hydrogen 2.964 N/A ILE 70.A N LYS 66.A O no hydrogen 3.352 N/A ILE 70.A N LEU 67.A O no hydrogen 2.998 N/A VAL 71.A N LEU 67.A O no hydrogen 2.848 N/A PHE 72.A N ALA 68.A O no hydrogen 2.993 N/A GLU 73.A N ILE 70.A O no hydrogen 3.306 N/A SER 74.A N VAL 71.A O no hydrogen 3.509 N/A ARG 75.A NH2 LYS 143.A O no hydrogen 3.285 N/A ARG 75.A NH2 GLU 146.A OE1 no hydrogen 3.380 N/A ASN 77.A ND2 ILE 70.A O no hydrogen 3.186 N/A LEU 78.A N SER 74.A O no hydrogen 3.140 N/A LYS 79.A N ARG 75.A O no hydrogen 2.870 N/A LYS 80.A N GLU 76.A O no hydrogen 3.172 N/A LEU 81.A N ASN 77.A O no hydrogen 3.132 N/A GLU 82.A N LEU 78.A O no hydrogen 2.961 N/A LEU 83.A N LYS 79.A O no hydrogen 2.924 N/A LEU 84.A N LYS 80.A O no hydrogen 3.357 N/A VAL 85.A N LEU 81.A O no hydrogen 2.944 N/A HIS 86.A N GLU 82.A O no hydrogen 2.926 N/A LYS 90.A N PRO 87.A O no hydrogen 3.117 N/A ARG 91.A N LEU 88.A O no hydrogen 3.212 N/A GLN 93.A N LYS 89.A O no hydrogen 2.978 N/A GLN 93.A NE2 GLN 93.A O no hydrogen 3.398 N/A GLN 93.A NE2 ASN 97.A OD1 no hydrogen 3.254 N/A GLU 94.A N LYS 90.A O no hydrogen 3.094 N/A ILE 95.A N ARG 91.A O no hydrogen 3.133 N/A ILE 96.A N VAL 92.A O no hydrogen 2.985 N/A ASN 97.A N GLN 93.A O no hydrogen 2.945 N/A LYS 98.A N GLU 94.A O no hydrogen 3.218 N/A LYS 98.A N ILE 95.A O no hydrogen 3.100 N/A THR 99.A N ILE 96.A O no hydrogen 3.266 N/A THR 99.A OG1 ILE 95.A O no hydrogen 2.864 N/A SER 100.A OG HIS 1.A ND1 no hydrogen 2.809 N/A GLY 101.A N HIS 2.A O no hydrogen 3.089 N/A VAL 104.A N HIS 29.A O no hydrogen 2.920 N/A ILE 105.A N ILE 5.A O no hydrogen 2.913 N/A GLU 106.A N VAL 31.A O no hydrogen 2.970 N/A ALA 107.A N VAL 7.A O no hydrogen 3.045 N/A LEU 110.A N ALA 107.A O no hydrogen 3.164 N/A ARG 112.A NE ASP 147.A OD2 no hydrogen 3.130 N/A ARG 112.A NH1 GLU 82.A OE2 no hydrogen 2.597 N/A ARG 112.A NH2 PHE 144.A O no hydrogen 2.882 N/A ARG 112.A NH2 ASP 147.A OD1 no hydrogen 2.887 N/A ASP 115.A N LEU 110.A O no hydrogen 3.262 N/A GLN 116.A N GLY 113.A O no hydrogen 3.397 N/A LEU 117.A N LEU 114.A O no hydrogen 2.823 N/A CYS 118.A N ASP 115.A O no hydrogen 3.029 N/A CYS 118.A SG LEU 114.A O no hydrogen 3.552 N/A ASP 119.A N VAL 4.A O no hydrogen 2.729 N/A HIS 120.A N VAL 4.A O no hydrogen 3.361 N/A ILE 122.A N GLY 6.A O no hydrogen 2.777 N/A THR 123.A N ILE 153.A O no hydrogen 2.852 N/A THR 123.A OG1 GLN 151.A O no hydrogen 2.577 N/A VAL 124.A N THR 8.A O no hydrogen 2.878 N/A VAL 125.A N VAL 155.A O no hydrogen 3.116 N/A SER 127.A N ASN 158.A OD1 no hydrogen 3.056 N/A SER 127.A OG THR 130.A OG1 no hydrogen 2.510 N/A SER 127.A OG ASN 158.A OD1 no hydrogen 3.247 N/A THR 130.A N SER 127.A OG no hydrogen 3.018 N/A THR 130.A OG1 SER 127.A OG no hydrogen 2.510 N/A THR 130.A OG1 ASN 158.A OD1 no hydrogen 2.805 N/A ILE 131.A N SER 127.A O no hydrogen 2.867 N/A LEU 132.A N ARG 128.A O no hydrogen 2.862 N/A LYS 133.A N GLU 129.A O no hydrogen 3.053 N/A ARG 134.A N THR 130.A O no hydrogen 3.270 N/A ARG 134.A N ILE 131.A O no hydrogen 3.046 N/A ARG 134.A NH1 GLY 12.A O no hydrogen 2.952 N/A ARG 134.A NH1 THR 13.A O no hydrogen 2.767 N/A ARG 134.A NH2 ASN 157.A O no hydrogen 2.880 N/A ASN 135.A N ILE 131.A O no hydrogen 3.031 N/A GLU 137.A N ASN 135.A OD1 no hydrogen 2.821 N/A ARG 140.A NH1 ALA 68.A O no hydrogen 3.225 N/A ARG 141.A N GLU 137.A O no hydrogen 2.982 N/A LEU 142.A N ALA 138.A O no hydrogen 2.849 N/A PHE 144.A N ARG 141.A O no hydrogen 2.929 N/A GLN 145.A N LEU 142.A O no hydrogen 2.797 N/A ILE 148.A N GLN 145.A O no hydrogen 2.935 N/A GLN 151.A N THR 123.A OG1 no hydrogen 2.786 N/A GLN 151.A NE2 ASP 115.A OD2 no hydrogen 2.839 N/A ILE 153.A N VAL 121.A O no hydrogen 2.841 N/A VAL 155.A N THR 123.A O no hydrogen 2.935 N/A ASN 157.A N VAL 125.A O no hydrogen 2.843 N/A ASN 157.A ND2 THR 13.A O no hydrogen 2.706 N/A SER 159.A OG ASP 163.A OD2 no hydrogen 2.725 N/A THR 160.A N SER 159.A OG no hydrogen 2.704 N/A ASP 163.A N THR 160.A OG1 no hydrogen 3.090 N/A LEU 164.A N THR 160.A O no hydrogen 3.070 N/A GLU 165.A N LEU 161.A O no hydrogen 2.788 N/A LYS 166.A N GLU 162.A O no hydrogen 2.941 N/A LYS 167.A N ASP 163.A O no hydrogen 3.111 N/A LYS 167.A NZ ALA 156.A O no hydrogen 3.270 N/A VAL 168.A N LEU 164.A O no hydrogen 2.936 N/A GLU 169.A N GLU 165.A O no hydrogen 3.070 N/A GLU 170.A N LYS 166.A O no hydrogen 2.974 N/A VAL 171.A N LYS 167.A O no hydrogen 3.028 N/A LEU 173.A N GLU 170.A O no hydrogen 3.283 N/A LEU 173.A N VAL 171.A O no hydrogen 2.912 N/A VAL 174.A N VAL 171.A O no hydrogen 3.108 N/A