Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1ton_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N GLY 125.A O no hydrogen 3.298 N/A ILE 1.A N SER 126.A O no hydrogen 3.121 N/A ILE 1.A N ASP 179.A OD1 no hydrogen 3.425 N/A ILE 1.A N ASP 179.A OD2 no hydrogen 2.797 N/A VAL 2.A N ASP 174.A O no hydrogen 2.859 N/A TYR 5.A N CYS 140.A O no hydrogen 2.616 N/A TYR 5.A OH ASN 142.A OD1 no hydrogen 2.947 N/A LYS 6.A NZ ASP 137.A OD2 no hydrogen 2.944 N/A CYS 7.A N LEU 138.A O no hydrogen 2.939 N/A CYS 7.A SG LEU 138.A O no hydrogen 3.510 N/A ASN 10.A N ASN 52.A OD1 no hydrogen 2.775 N/A SER 11.A N GLU 8.A O no hydrogen 3.121 N/A SER 11.A OG GLU 8.A O no hydrogen 2.826 N/A SER 11.A OG GLN 12.A OE1 no hydrogen 2.781 N/A GLN 15.A N GLN 12.A O no hydrogen 2.845 N/A GLN 15.A NE2 VAL 16.A O no hydrogen 3.128 N/A VAL 16.A N GLY 26.A O no hydrogen 3.079 N/A ALA 17.A N LEU 48.A O no hydrogen 2.779 N/A VAL 18.A N CYS 24.A O no hydrogen 2.939 N/A ILE 19.A N GLN 46.A O no hydrogen 2.936 N/A ASN 20.A N TYR 22.A O no hydrogen 3.254 N/A ASN 20.A ND2 CYS 40.A O no hydrogen 3.155 N/A ASN 20.A ND2 ASN 44.A O no hydrogen 2.872 N/A GLU 21.A N GLU 21.A OE1 no hydrogen 2.456 N/A TYR 22.A N ASN 20.A OD1 no hydrogen 3.006 N/A CYS 24.A N VAL 18.A O no hydrogen 2.909 N/A CYS 24.A SG LEU 23.A O no hydrogen 3.311 N/A GLY 25.A N SER 180.A O no hydrogen 2.800 N/A VAL 27.A N ILE 35.A O no hydrogen 2.764 N/A LEU 28.A N TRP 14.A O no hydrogen 2.837 N/A ILE 29.A N TRP 33.A O no hydrogen 3.141 N/A SER 32.A N ASP 30.A OD1 no hydrogen 3.119 N/A TRP 33.A N ASP 30.A O no hydrogen 2.999 N/A VAL 34.A N LEU 91.A O no hydrogen 2.867 N/A ILE 35.A N VAL 27.A O no hydrogen 2.912 N/A THR 36.A N MET 89.A O no hydrogen 2.935 N/A THR 36.A OG1 GLY 25.A O no hydrogen 2.717 N/A HIS 39.A N ASP 87.A OD1 no hydrogen 3.052 N/A HIS 39.A ND1 ASP 87.A OD2 no hydrogen 2.706 N/A HIS 39.A NE2 HIS 82.A NE2 no hydrogen 3.117 N/A CYS 40.A N ALA 37.A O no hydrogen 3.246 N/A CYS 40.A SG ALA 37.A O no hydrogen 3.545 N/A TYR 41.A N ALA 38.A O no hydrogen 2.947 N/A SER 42.A N TYR 45.A OH no hydrogen 3.170 N/A SER 42.A OG GLU 21.A OE1 no hydrogen 2.778 N/A SER 42.A OG GLU 21.A OE2 no hydrogen 3.225 N/A SER 42.A OG ASN 43.A OD1 no hydrogen 3.509 N/A GLN 46.A N ILE 19.A O no hydrogen 2.796 N/A VAL 47.A N ARG 64.A O no hydrogen 2.748 N/A LEU 48.A N ALA 17.A O no hydrogen 2.823 N/A LEU 49.A N GLN 62.A O no hydrogen 2.828 N/A ARG 51.A NH2 ASN 53.A O no hydrogen 2.836 N/A ARG 51.A NH2 LYS 56.A O no hydrogen 2.387 N/A ASN 52.A N GLU 58.A OE1 no hydrogen 3.038 N/A ASN 52.A ND2 ASN 10.A OD1 no hydrogen 3.043 N/A ASN 53.A N GLU 58.A OE2 no hydrogen 2.979 N/A ASN 53.A ND2 ASP 137.A OD1 no hydrogen 2.844 N/A LEU 54.A N HIS 136.A O no hydrogen 2.767 N/A PHE 55.A N ASN 53.A OD1 no hydrogen 2.632 N/A ALA 61.A N GLU 58.A O no hydrogen 3.427 N/A GLN 62.A N LEU 49.A O no hydrogen 2.777 N/A GLN 62.A NE2 ASP 98.A O no hydrogen 2.645 N/A ARG 64.A N VAL 47.A O no hydrogen 2.697 N/A ARG 64.A NE PRO 96.A O no hydrogen 2.732 N/A ARG 64.A NH1 ARG 63.A O no hydrogen 3.127 N/A ARG 64.A NH2 PRO 96.A O no hydrogen 2.824 N/A ARG 64.A NH2 ASP 98.A OD1 no hydrogen 3.326 N/A ARG 67.A N HIS 92.A O no hydrogen 2.709 N/A PHE 70.A N LEU 90.A O no hydrogen 2.780 N/A HIS 72.A N LEU 88.A O no hydrogen 2.748 N/A ASP 74.A N HIS 72.A ND1 no hydrogen 3.102 N/A TYR 75.A N HIS 72.A O no hydrogen 3.169 N/A HIS 82.A ND1 ILE 76.A O no hydrogen 2.689 N/A HIS 82.A NE2 HIS 39.A NE2 no hydrogen 3.117 N/A SER 85.A N ASP 83.A OD1 no hydrogen 2.896 N/A SER 85.A OG ASP 83.A OD1 no hydrogen 2.718 N/A LEU 88.A N ASN 86.A O no hydrogen 2.810 N/A MET 89.A N THR 36.A O no hydrogen 2.841 N/A LEU 90.A N PHE 70.A O no hydrogen 2.673 N/A LEU 91.A N VAL 34.A O no hydrogen 2.837 N/A HIS 92.A N GLN 68.A O no hydrogen 2.871 N/A LEU 93.A N SER 32.A O no hydrogen 2.818 N/A SER 94.A N LEU 65.A O no hydrogen 2.682 N/A SER 94.A OG LEU 65.A O no hydrogen 3.224 N/A ALA 97.A N PRO 31.A O no hydrogen 2.801 N/A ASP 98.A N GLN 62.A OE1 no hydrogen 2.882 N/A THR 100.A N VAL 103.A O no hydrogen 2.852 N/A GLY 102.A N THR 100.A OG1 no hydrogen 2.932 N/A VAL 103.A N THR 100.A O no hydrogen 3.317 N/A VAL 103.A N THR 100.A OG1 no hydrogen 3.080 N/A LYS 104.A N PRO 13.A O no hydrogen 3.358 N/A ILE 106.A N LEU 28.A O no hydrogen 2.894 N/A GLY 116.A N LEU 145.A O no hydrogen 2.520 N/A SER 117.A N LYS 114.A O no hydrogen 2.919 N/A SER 117.A OG LYS 114.A O no hydrogen 3.017 N/A CYS 119.A N ILE 143.A O no hydrogen 2.596 N/A CYS 119.A SG SER 117.A O no hydrogen 3.824 N/A LEU 120.A N ILE 185.A O no hydrogen 2.919 N/A ALA 121.A N VAL 141.A O no hydrogen 2.912 N/A SER 122.A OG GLN 15.A OE1 no hydrogen 2.587 N/A GLY 123.A N GLN 139.A O no hydrogen 2.947 N/A TRP 124.A NE1 ASN 52.A O no hydrogen 2.912 N/A GLY 125.A N ASP 179.A OD1 no hydrogen 2.808 N/A SER 126.A N ALA 177.A O no hydrogen 2.853 N/A SER 126.A OG ASN 128.A O no hydrogen 2.960 N/A SER 126.A OG GLU 131.A O no hydrogen 2.748 N/A ASN 128.A N SER 126.A OG no hydrogen 3.388 N/A SER 130.A N ASN 128.A OD1 no hydrogen 3.040 N/A SER 130.A OG ASN 128.A OD1 no hydrogen 2.990 N/A GLU 131.A N ASN 128.A OD1 no hydrogen 2.987 N/A VAL 133.A N SER 126.A OG no hydrogen 2.835 N/A SER 135.A N TRP 124.A O no hydrogen 2.923 N/A SER 135.A OG ASP 137.A O no hydrogen 2.983 N/A LEU 138.A N ASN 52.A O no hydrogen 2.785 N/A GLN 139.A N GLY 123.A O no hydrogen 2.995 N/A GLN 139.A NE2 ASP 137.A O no hydrogen 3.439 N/A CYS 140.A N TYR 5.A O no hydrogen 2.541 N/A CYS 140.A SG GLN 12.A OE1 no hydrogen 3.537 N/A VAL 141.A N ALA 121.A O no hydrogen 2.891 N/A ILE 143.A N CYS 119.A O no hydrogen 2.585 N/A HIS 144.A N GLY 167.A O no hydrogen 3.361 N/A HIS 144.A ND1 GLU 168.A OE2 no hydrogen 2.344 N/A LEU 145.A N SER 117.A O no hydrogen 2.898 N/A LEU 146.A N CYS 165.A O no hydrogen 2.769 N/A ASN 148.A ND2 THR 160.A OG1 no hydrogen 3.043 N/A ASN 148.A ND2 MET 163.A O no hydrogen 2.809 N/A GLU 149.A N SER 147.A OG no hydrogen 3.228 N/A LYS 150.A N SER 147.A O no hydrogen 2.979 N/A LYS 150.A NZ GLU 149.A OE1 no hydrogen 3.563 N/A CYS 151.A N ASN 148.A O no hydrogen 3.160 N/A CYS 151.A SG ALA 208.A O no hydrogen 3.563 N/A THR 154.A N CYS 151.A O no hydrogen 3.279 N/A THR 154.A OG1 ASN 148.A O no hydrogen 2.663 N/A THR 154.A OG1 CYS 151.A O no hydrogen 2.837 N/A TYR 155.A N ILE 152.A O no hydrogen 3.389 N/A TYR 155.A OH GLU 149.A O no hydrogen 2.663 N/A VAL 159.A N LYS 156.A O no hydrogen 2.760 N/A ASP 161.A N ASN 158.A O no hydrogen 3.300 N/A VAL 162.A N VAL 159.A O no hydrogen 3.019 N/A MET 163.A N THR 160.A O no hydrogen 3.172 N/A LEU 164.A N TYR 210.A O no hydrogen 2.756 N/A CYS 165.A SG SER 147.A O no hydrogen 3.411 N/A ALA 166.A N ALA 208.A O no hydrogen 2.977 N/A GLY 167.A N HIS 144.A O no hydrogen 3.111 N/A GLY 172.A N ALA 202.A O no hydrogen 3.006 N/A LYS 173.A NZ ASN 142.A O no hydrogen 2.899 N/A ASP 174.A N VAL 2.A O no hydrogen 3.206 N/A THR 175.A OG1 TYR 210.A OH no hydrogen 2.923 N/A CYS 176.A N ASP 179.A OD2 no hydrogen 2.688 N/A CYS 176.A SG GLY 197.A O no hydrogen 4.026 N/A ASP 179.A N CYS 176.A O no hydrogen 2.980 N/A SER 180.A OG SER 195.A O no hydrogen 2.684 N/A GLY 181.A N THR 194.A O no hydrogen 2.699 N/A GLY 182.A N ASP 179.A O no hydrogen 3.096 N/A LEU 184.A N GLY 192.A O no hydrogen 3.050 N/A ILE 185.A N LEU 120.A O no hydrogen 2.794 N/A CYS 186.A N VAL 189.A O no hydrogen 2.626 N/A ASP 187.A N THR 118.A O no hydrogen 3.060 N/A VAL 189.A N CYS 186.A O no hydrogen 2.919 N/A GLN 191.A N LEU 184.A O no hydrogen 2.690 N/A GLN 191.A NE2 LYS 111.A O no hydrogen 2.938 N/A GLY 192.A N LEU 184.A O no hydrogen 3.102 N/A ILE 193.A N ALA 211.A O no hydrogen 3.288 N/A THR 194.A N GLY 182.A O no hydrogen 2.852 N/A THR 194.A OG1 GLY 182.A O no hydrogen 3.286 N/A SER 195.A OG ASP 87.A OD2 no hydrogen 2.633 N/A GLY 196.A N SER 195.A OG no hydrogen 2.619 N/A THR 199.A OG1 SER 130.A O no hydrogen 3.356 N/A CYS 201.A N PRO 129.A O no hydrogen 2.867 N/A CYS 201.A SG THR 175.A O no hydrogen 3.871 N/A CYS 201.A SG GLY 197.A O no hydrogen 3.694 N/A CYS 201.A SG ALA 198.A O no hydrogen 3.557 N/A ALA 202.A N ASP 174.A OD2 no hydrogen 2.968 N/A LYS 205.A N MET 169.A O no hydrogen 2.445 N/A THR 206.A N LYS 203.A O no hydrogen 3.148 N/A THR 206.A OG1 PRO 204A.A O no hydrogen 3.154 N/A ALA 208.A N ALA 166.A O no hydrogen 2.880 N/A TYR 210.A N LEU 164.A O no hydrogen 3.022 N/A ALA 211.A N ILE 193.A O no hydrogen 2.984 N/A LYS 212.A N VAL 162.A O no hydrogen 3.006 N/A LYS 212.A NZ GLU 112.A OE1 no hydrogen 3.133 N/A LEU 213.A N GLN 191.A O no hydrogen 3.030 N/A LYS 215.A N LYS 212.A O no hydrogen 2.972 N/A PHE 216.A N LEU 213.A O no hydrogen 2.727 N/A THR 217.A OG1 ILE 214.A O no hydrogen 3.367 N/A ILE 220.A N PHE 216.A O no hydrogen 2.794 N/A LYS 221.A N THR 217.A O no hydrogen 2.571 N/A LYS 222.A N SER 218.A O no hydrogen 3.149 N/A VAL 223.A N TRP 219.A O no hydrogen 3.128 N/A MET 224.A N ILE 220.A O no hydrogen 3.215 N/A LYS 225.A N LYS 221.A O no hydrogen 3.068 N/A GLU 226.A N LYS 222.A O no hydrogen 3.082 N/A ASN 227.A N MET 224.A O no hydrogen 3.400 N/A ASN 227.A ND2 VAL 223.A O no hydrogen 2.590 N/A GLY 171B.A N GLU 168.A O no hydrogen 2.744 N/A ILE 79C.A N PRO 77A.A O no hydrogen 3.135 N/A