Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1rj6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 1.A N HIS 1.A ND1 no hydrogen 2.677 N/A THR 4.A N HIS 9.A O no hydrogen 3.133 N/A GLY 10.A N GLY 7.A O no hydrogen 3.283 N/A GLN 11.A N TYR 5.A O no hydrogen 3.058 N/A GLN 11.A NE2 TYR 244.A O no hydrogen 3.389 N/A HIS 13.A N GLY 10.A O no hydrogen 2.872 N/A TRP 14.A NE1 THR 4.A O no hydrogen 3.131 N/A THR 16.A N HIS 13.A O no hydrogen 3.117 N/A SER 17.A OG TRP 14.A O no hydrogen 3.503 N/A TYR 18.A N TRP 14.A O no hydrogen 2.776 N/A CYS 21.A N TYR 18.A O no hydrogen 2.822 N/A GLY 22.A N PRO 19.A O no hydrogen 2.754 N/A GLY 23.A N GLU 20.A O no hydrogen 2.739 N/A ALA 25.A N GLN 204.A OE1 no hydrogen 2.648 N/A GLN 26.A NE2 CYS 202.A O no hydrogen 3.345 N/A GLN 26.A NE2 GLN 204.A OE1 no hydrogen 3.194 N/A SER 27.A OG TYR 193.A OH no hydrogen 3.183 N/A SER 27.A OG SER 196.A O no hydrogen 3.381 N/A ILE 31.A N HIS 105.A O no hydrogen 2.830 N/A THR 33.A N ASN 107.A OD1 no hydrogen 2.699 N/A THR 33.A OG1 ASN 107.A OD1 no hydrogen 2.814 N/A SER 35.A N GLN 32.A O no hydrogen 2.945 N/A ILE 37.A N ILE 255.A O no hydrogen 2.859 N/A ASP 39.A N ALA 257.A O no hydrogen 3.038 N/A ASP 41.A N ASP 39.A OD1 no hydrogen 3.119 N/A LEU 42.A N ASP 39.A O no hydrogen 2.894 N/A GLN 46.A N GLY 78.A O no hydrogen 3.078 N/A HIS 48.A N HIS 76.A O no hydrogen 3.036 N/A TYR 50.A OH HIS 119.A NE2 no hydrogen 2.577 N/A GLN 52.A N GLY 49A.A O no hydrogen 3.375 N/A GLN 52.A NE2 ASP 51.A OD1 no hydrogen 3.514 N/A LEU 58.A N VAL 174.A O no hydrogen 2.944 N/A LEU 60.A N THR 172.A O no hydrogen 2.783 N/A HIS 61.A N GLN 68.A O no hydrogen 2.844 N/A HIS 61.A NE2 ASP 169.A O no hydrogen 3.233 N/A ASN 62.A N GLN 170.A O no hydrogen 3.270 N/A ASN 62.A ND2 ILE 165.A O no hydrogen 2.794 N/A ASN 62.A ND2 SER 230.A O no hydrogen 3.629 N/A ASN 63.A N THR 66.A O no hydrogen 2.940 N/A HIS 65.A NE2 TRP 3.A O no hydrogen 2.901 N/A THR 66.A OG1 VAL 67.A O no hydrogen 3.228 N/A THR 66.A OG1 LEU 91.A O no hydrogen 2.819 N/A GLN 68.A N HIS 61.A O no hydrogen 3.046 N/A LEU 69.A N LEU 89.A O no hydrogen 2.717 N/A SER 70.A N ASP 59.A O no hydrogen 2.841 N/A LEU 71.A N ALA 87.A O no hydrogen 3.052 N/A LEU 75.A N PRO 72.A O no hydrogen 3.315 N/A HIS 76.A NE2 PRO 73.A O no hydrogen 3.021 N/A LEU 77.A N TYR 84.A O no hydrogen 2.815 N/A GLY 78.A N GLN 46.A O no hydrogen 3.065 N/A ARG 82.A NH1 ASP 121.A OD1 no hydrogen 3.385 N/A ARG 82.A NH1 PRO 135.A O no hydrogen 2.899 N/A ARG 82.A NH2 PRO 135.A O no hydrogen 3.360 N/A TYR 84.A N LEU 77.A O no hydrogen 3.487 N/A TYR 84.A OH GLN 136.A O no hydrogen 2.549 N/A THR 85.A N TYR 120.A O no hydrogen 2.917 N/A THR 85.A OG1 SER 122.A OG no hydrogen 2.924 N/A ALA 86.A N LEU 75.A O no hydrogen 3.056 N/A ALA 87.A N VAL 118.A O no hydrogen 2.724 N/A LEU 89.A N LEU 69.A O no hydrogen 3.097 N/A HIS 90.A N HIS 116.A O no hydrogen 3.068 N/A HIS 90.A ND1 GLN 88.A OE1 no hydrogen 2.751 N/A LEU 91.A N THR 66.A OG1 no hydrogen 3.407 N/A HIS 92.A N GLU 114.A O no hydrogen 2.942 N/A HIS 92.A ND1 ASN 243.A O no hydrogen 2.633 N/A TRP 93.A N ASN 243.A OD1 no hydrogen 2.718 N/A TRP 93.A NE1 LEU 240.A O no hydrogen 3.213 N/A GLN 95.A N GLN 242.A OE1 no hydrogen 2.797 N/A GLU 100.A N SER 98.A OG no hydrogen 3.031 N/A GLY 101.A N THR 111.A O no hydrogen 2.732 N/A SER 102.A N THR 111.A O no hydrogen 2.978 N/A SER 102.A OG HIS 104.A O no hydrogen 2.979 N/A SER 102.A OG THR 111.A O no hydrogen 3.435 N/A GLU 103.A N GLU 114.A OE1 no hydrogen 2.605 N/A HIS 104.A N GLU 114.A OE1 no hydrogen 2.659 N/A HIS 104.A ND1 GLU 114.A OE2 no hydrogen 2.659 N/A HIS 104.A NE2 TYR 193.A OH no hydrogen 2.939 N/A HIS 105.A N ILE 29.A O no hydrogen 3.249 N/A ILE 106.A N GLU 109.A O no hydrogen 2.974 N/A ASN 107.A N ILE 31.A O no hydrogen 2.786 N/A ASN 107.A ND2 THR 33.A OG1 no hydrogen 2.696 N/A SER 108.A N ASN 30.A OD1 no hydrogen 2.714 N/A GLU 109.A N ILE 106.A O no hydrogen 3.013 N/A THR 111.A N SER 102.A OG no hydrogen 2.815 N/A THR 111.A OG1 ALA 113.A O no hydrogen 3.038 N/A THR 111.A OG1 ILE 145.A O no hydrogen 3.109 N/A ALA 113.A N ILE 145.A O no hydrogen 3.174 N/A GLU 114.A N HIS 92.A O no hydrogen 3.006 N/A LEU 115.A N ILE 143.A O no hydrogen 2.710 N/A HIS 116.A N HIS 90.A O no hydrogen 2.960 N/A HIS 116.A NE2 GLU 114.A OE2 no hydrogen 2.577 N/A VAL 117.A N LEU 141.A O no hydrogen 2.957 N/A VAL 118.A N GLN 88.A O no hydrogen 2.812 N/A HIS 119.A N ALA 139.A O no hydrogen 2.733 N/A HIS 119.A ND1 VAL 117.A O no hydrogen 3.087 N/A HIS 119.A NE2 TYR 50.A OH no hydrogen 2.577 N/A TYR 120.A N THR 85.A O no hydrogen 2.885 N/A ASP 121.A N GLY 137.A O no hydrogen 2.943 N/A SER 122.A OG THR 85.A OG1 no hydrogen 2.924 N/A SER 124.A N ASP 121.A O no hydrogen 3.154 N/A SER 124.A N ASP 121.A OD2 no hydrogen 2.840 N/A SER 124.A OG ASP 121.A OD1 no hydrogen 2.895 N/A TYR 125.A N ASP 121.A O no hydrogen 2.935 N/A SER 126.A N GLU 130.A OE1 no hydrogen 2.396 N/A SER 126.A OG GLU 130.A OE1 no hydrogen 2.853 N/A SER 127.A OG SER 129.A OG no hydrogen 3.125 N/A SER 129.A OG SER 127.A OG no hydrogen 3.125 N/A GLU 130.A N SER 127.A OG no hydrogen 3.159 N/A ALA 131.A N SER 127.A O no hydrogen 3.293 N/A ALA 132.A N SER 129.A O no hydrogen 2.694 N/A LYS 134.A N ALA 131.A O no hydrogen 3.249 N/A GLY 137.A N LYS 134.A O no hydrogen 2.827 N/A LEU 138.A N SER 205.A O no hydrogen 3.039 N/A ALA 139.A N HIS 119.A O no hydrogen 3.182 N/A VAL 140.A N LEU 207.A O no hydrogen 3.449 N/A LEU 141.A N VAL 117.A O no hydrogen 2.947 N/A GLY 142.A N THR 209.A O no hydrogen 2.786 N/A ILE 143.A N LEU 115.A O no hydrogen 2.879 N/A ILE 145.A N ALA 113.A O no hydrogen 2.702 N/A GLU 146.A N ALA 215.A O no hydrogen 2.804 N/A GLY 148.A N ILE 217.A O no hydrogen 2.535 N/A THR 150.A OG1 GLU 151.A O no hydrogen 3.242 N/A ASN 152.A N GLN 221.A OE1 no hydrogen 2.667 N/A ASN 152.A ND2 GLN 216.A O no hydrogen 2.914 N/A ALA 154.A N ASN 152.A OD1 no hydrogen 2.828 N/A TYR 155.A OH LEU 182.A O no hydrogen 2.596 N/A ASP 156.A N ASN 152.A O no hydrogen 3.262 N/A HIS 157.A N ALA 154.A O no hydrogen 3.029 N/A HIS 157.A ND1 ALA 154.A O no hydrogen 2.950 N/A ILE 158.A N TYR 155.A O no hydrogen 3.052 N/A LEU 159.A N TYR 155.A O no hydrogen 2.969 N/A SER 160.A N ASP 156.A O no hydrogen 2.880 N/A SER 160.A OG ASP 156.A O no hydrogen 3.192 N/A ARG 161.A N ILE 158.A O no hydrogen 3.190 N/A ARG 161.A NE HIS 157.A O no hydrogen 3.082 N/A LEU 162.A N LEU 159.A O no hydrogen 3.122 N/A GLU 164.A N ARG 161.A O no hydrogen 3.335 N/A ILE 165.A N LEU 162.A O no hydrogen 3.254 N/A ARG 166.A N HIS 163.A O no hydrogen 3.399 N/A ARG 166.A NH2 SER 237.A OG no hydrogen 3.334 N/A TYR 167.A N GLN 170.A OE1 no hydrogen 2.919 N/A TYR 167.A OH ASP 235.A OD1 no hydrogen 2.652 N/A LYS 168.A N THR 232.A O no hydrogen 2.790 N/A LYS 168.A NZ GLU 233.A OE1 no hydrogen 3.159 N/A ASP 169.A N ASN 62.A O no hydrogen 2.717 N/A GLN 170.A N TYR 167.A O no hydrogen 3.196 N/A LYS 171.A NZ ASP 59.A OD2 no hydrogen 2.867 N/A THR 172.A OG1 GLU 164.A OE1 no hydrogen 3.120 N/A THR 172.A OG1 SER 173.A O no hydrogen 3.468 N/A VAL 174.A N LEU 58.A O no hydrogen 2.945 N/A ARG 180.A N TYR 50.A O no hydrogen 3.042 N/A ARG 180.A NH2 PRO 184.A O no hydrogen 3.221 N/A ARG 180.A NH2 GLN 185.A O no hydrogen 3.388 N/A GLU 181.A N SER 178.A O no hydrogen 3.325 N/A LEU 182.A N VAL 179.A O no hydrogen 2.656 N/A PHE 183.A N ARG 180.A O no hydrogen 2.988 N/A PHE 190.A N SER 258.A OG no hydrogen 2.920 N/A PHE 191.A N VAL 210.A O no hydrogen 2.830 N/A ARG 192.A N PHE 256.A O no hydrogen 2.883 N/A TYR 193.A N TRP 208.A O no hydrogen 3.081 N/A TYR 193.A OH SER 27.A OG no hydrogen 3.183 N/A TYR 193.A OH HIS 104.A NE2 no hydrogen 2.939 N/A GLY 195.A N VAL 206.A O no hydrogen 2.946 N/A SER 196.A N SER 27.A OG no hydrogen 2.859 N/A SER 196.A OG LEU 197.A O no hydrogen 2.957 N/A LEU 197.A N TYR 203.A O no hydrogen 3.089 N/A THR 198.A OG1 GLU 103.A OE1 no hydrogen 3.133 N/A THR 198.A OG1 GLU 103.A OE2 no hydrogen 2.868 N/A CYS 202.A N THR 199.A O no hydrogen 2.899 N/A GLN 204.A NE2 ASP 24.A OD1 no hydrogen 3.484 N/A SER 205.A OG ALA 132.A O no hydrogen 2.486 N/A LEU 207.A N LEU 138.A O no hydrogen 2.966 N/A TRP 208.A N TYR 193.A O no hydrogen 2.831 N/A TRP 208.A NE1 SER 196.A O no hydrogen 2.945 N/A THR 209.A N VAL 140.A O no hydrogen 3.183 N/A VAL 210.A N PHE 191.A O no hydrogen 2.840 N/A PHE 211.A N GLY 142.A O no hydrogen 3.211 N/A ASN 212.A N GLN 189A.A O no hydrogen 2.917 N/A ASN 212.A ND2 GLN 189A.A OE1 no hydrogen 3.180 N/A ARG 214.A NE ASN 212.A O no hydrogen 3.128 N/A ARG 214.A NH1 GLU 146.A OE1 no hydrogen 2.591 N/A ALA 215.A N LEU 144.A O no hydrogen 2.891 N/A GLN 216.A NE2 GLU 146.A OE2 no hydrogen 3.441 N/A ILE 217.A N GLU 146.A O no hydrogen 2.983 N/A SER 218.A N GLN 221.A OE1 no hydrogen 2.947 N/A SER 218.A OG GLU 151.A OE1 no hydrogen 2.517 N/A SER 218.A OG GLN 221.A OE1 no hydrogen 3.251 N/A GLN 221.A N SER 218.A OG no hydrogen 2.932 N/A GLN 221.A NE2 ASN 152.A O no hydrogen 2.818 N/A GLN 221.A NE2 ASP 156.A OD1 no hydrogen 3.341 N/A LEU 222.A N SER 218.A O no hydrogen 2.996 N/A GLU 223.A N MET 219.A O no hydrogen 2.967 N/A LYS 224.A N GLY 220.A O no hydrogen 2.864 N/A LEU 225.A N GLN 221.A O no hydrogen 3.003 N/A GLN 226.A N LEU 222.A O no hydrogen 3.085 N/A GLN 226.A NE2 GLY 94.A O no hydrogen 3.285 N/A GLN 226.A NE2 SER 98.A O no hydrogen 3.667 N/A GLU 227.A N GLU 223.A O no hydrogen 2.834 N/A SER 230.A N ARG 166.A O no hydrogen 2.778 N/A SER 230.A OG THR 232.A OG1 no hydrogen 3.229 N/A SER 231.A N GLU 238.A O no hydrogen 2.845 N/A SER 231.A OG GLU 238.A O no hydrogen 2.853 N/A THR 232.A N SER 230.A OG no hydrogen 3.277 N/A THR 232.A OG1 SER 230.A OG no hydrogen 3.229 N/A THR 232.A OG1 GLU 234.A O no hydrogen 2.632 N/A GLU 233.A N GLU 233.A OE2 no hydrogen 2.765 N/A GLU 238.A N SER 230.A OG no hydrogen 3.204 N/A LEU 240.A N LEU 229.A O no hydrogen 2.938 N/A ASN 243.A N TRP 93.A O no hydrogen 3.220 N/A ASN 243.A ND2 HIS 65.A O no hydrogen 3.055 N/A ASN 243.A ND2 LEU 91.A O no hydrogen 3.244 N/A ARG 245.A N GLU 103.A OE1 no hydrogen 2.928 N/A ARG 245.A NH1 GLN 26.A OE1 no hydrogen 2.912 N/A ARG 245.A NH1 SER 27.A O no hydrogen 2.586 N/A ARG 245.A NH2 CYS 21.A O no hydrogen 3.093 N/A ARG 245.A NH2 GLN 26.A OE1 no hydrogen 2.854 N/A VAL 246.A N GLN 11.A OE1 no hydrogen 2.814 N/A GLN 248.A N PRO 28.A O no hydrogen 2.705 N/A GLN 248.A NE2 VAL 246.A O no hydrogen 2.614 N/A ASN 251.A ND2 ASP 24.A O no hydrogen 2.840 N/A ARG 253.A N LEU 250.A O no hydrogen 3.045 N/A ARG 253.A NE ASN 194.A O no hydrogen 3.308 N/A ARG 253.A NH1 GLN 26.A O no hydrogen 3.094 N/A ARG 253.A NH2 GLN 26.A O no hydrogen 2.830 N/A ARG 253.A NH2 ASN 194.A O no hydrogen 2.882 N/A PHE 256.A N ARG 192.A O no hydrogen 3.151 N/A ALA 257.A N ILE 37.A O no hydrogen 3.092 N/A SER 258.A N PHE 190.A O no hydrogen 2.994 N/A SER 258.A OG GLU 188.A O no hydrogen 2.639 N/A SER 258.A OG PHE 190.A O no hydrogen 3.328 N/A THR 228A.A OG1 LYS 224.A O no hydrogen 2.681 N/A THR 228A.A OG1 GLU 227.A O no hydrogen 2.889 N/A