Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ha6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A NH1 GLN 31.A OE1 no hydrogen 2.611 N/A ARG 3.A NH2 ASP 9.A OD1 no hydrogen 2.841 N/A GLN 4.A NE2 LYS 2.A O no hydrogen 3.315 N/A GLN 4.A NE2 ARG 3.A O no hydrogen 3.600 N/A ALA 6.A N ASP 9.A OD2 no hydrogen 3.011 N/A ASP 9.A N ALA 6.A O no hydrogen 2.769 N/A PHE 10.A N LEU 7.A O no hydrogen 3.234 N/A GLU 11.A N ARG 28.A O no hydrogen 2.661 N/A GLY 13.A N LEU 26.A O no hydrogen 2.784 N/A LEU 16.A N VAL 24.A O no hydrogen 2.682 N/A GLY 17.A N VAL 24.A O no hydrogen 3.338 N/A GLY 22.A N GLY 19.A O no hydrogen 3.431 N/A VAL 24.A N GLY 17.A O no hydrogen 2.840 N/A TYR 25.A N LEU 38.A O no hydrogen 2.821 N/A LEU 26.A N ARG 14.A O no hydrogen 2.822 N/A ALA 27.A N LEU 36.A O no hydrogen 2.829 N/A ARG 28.A N GLU 11.A O no hydrogen 2.749 N/A ARG 28.A NH1 LYS 33.A O no hydrogen 3.396 N/A GLU 29.A N PHE 34.A O no hydrogen 3.032 N/A LYS 30.A N ASP 9.A O no hydrogen 3.098 N/A LYS 30.A NZ GLU 8.A O no hydrogen 2.646 N/A GLN 31.A N GLU 29.A OE1 no hydrogen 2.599 N/A SER 32.A N GLU 29.A OE2 no hydrogen 3.031 N/A SER 32.A OG GLU 29.A OE2 no hydrogen 2.706 N/A LYS 33.A N GLU 29.A O no hydrogen 2.832 N/A LEU 36.A N ALA 27.A O no hydrogen 2.650 N/A ALA 37.A N LEU 87.A O no hydrogen 2.826 N/A LEU 38.A N TYR 25.A O no hydrogen 2.832 N/A LYS 39.A N LEU 85.A O no hydrogen 2.933 N/A VAL 40.A N ASN 23.A O no hydrogen 2.832 N/A LEU 41.A N VAL 83.A O no hydrogen 2.803 N/A PHE 42.A N PHE 21.A O no hydrogen 2.861 N/A LYS 43.A N THR 81.A O no hydrogen 2.818 N/A LYS 43.A NZ HIS 78.A ND1 no hydrogen 2.911 N/A LYS 43.A NZ ASP 79.A O no hydrogen 2.988 N/A GLN 45.A N PHE 42.A O no hydrogen 3.100 N/A LEU 46.A N PHE 42.A O no hydrogen 3.023 N/A GLU 47.A N LYS 43.A O no hydrogen 2.967 N/A LYS 48.A N ALA 44.A O no hydrogen 3.066 N/A ALA 49.A N GLN 45.A O no hydrogen 3.098 N/A GLY 50.A N GLU 47.A O no hydrogen 3.193 N/A VAL 51.A N LEU 46.A O no hydrogen 2.821 N/A LEU 55.A N VAL 51.A O no hydrogen 2.909 N/A ARG 56.A N GLU 52.A O no hydrogen 2.800 N/A ARG 57.A N HIS 53.A O no hydrogen 3.141 N/A GLU 58.A N GLN 54.A O no hydrogen 3.142 N/A VAL 59.A N LEU 55.A O no hydrogen 3.182 N/A GLU 60.A N ARG 56.A O no hydrogen 2.908 N/A ILE 61.A N ARG 57.A O no hydrogen 2.939 N/A GLN 62.A N GLU 58.A O no hydrogen 2.809 N/A GLN 62.A NE2 LEU 71.A O no hydrogen 2.926 N/A SER 63.A N VAL 59.A O no hydrogen 3.342 N/A SER 63.A OG VAL 59.A O no hydrogen 2.841 N/A HIS 64.A N ILE 61.A O no hydrogen 2.929 N/A HIS 64.A ND1 GLU 60.A O no hydrogen 2.662 N/A LEU 65.A N GLN 62.A O no hydrogen 2.982 N/A ARG 66.A N TYR 123.A OH no hydrogen 2.764 N/A ARG 66.A NH1 SER 63.A O no hydrogen 2.723 N/A ARG 66.A NH1 LEU 65.A O no hydrogen 3.566 N/A ASN 69.A N HIS 67.A ND1 no hydrogen 2.880 N/A ASN 69.A ND2 LEU 147.A O no hydrogen 2.710 N/A ILE 70.A N HIS 67.A O no hydrogen 3.023 N/A LEU 71.A N ILE 149.A O no hydrogen 2.964 N/A ARG 72.A N GLU 88.A OE2 no hydrogen 3.103 N/A TYR 74.A N ILE 86.A O no hydrogen 2.856 N/A PHE 77.A N TYR 84.A O no hydrogen 3.094 N/A ASP 79.A N ARG 82.A O no hydrogen 3.135 N/A THR 81.A N ASP 79.A OD1 no hydrogen 2.861 N/A THR 81.A OG1 ASP 79.A OD1 no hydrogen 3.459 N/A ARG 82.A N ASP 79.A OD1 no hydrogen 2.878 N/A ARG 82.A NH2 ASP 79.A OD2 no hydrogen 3.322 N/A VAL 83.A N LEU 41.A O no hydrogen 2.645 N/A TYR 84.A N PHE 77.A O no hydrogen 2.699 N/A TYR 84.A OH ASP 79.A OD2 no hydrogen 2.719 N/A LEU 85.A N LYS 39.A O no hydrogen 2.830 N/A ILE 86.A N GLY 75.A O no hydrogen 2.811 N/A LEU 87.A N ALA 37.A O no hydrogen 2.832 N/A GLU 88.A N ARG 72.A O no hydrogen 2.974 N/A LEU 92.A N LEU 141.A O no hydrogen 3.017 N/A GLY 93.A N ALA 90.A O no hydrogen 3.255 N/A VAL 95.A N LEU 139.A O no hydrogen 2.722 N/A ARG 97.A N THR 94.A OG1 no hydrogen 3.133 N/A GLU 98.A N THR 94.A O no hydrogen 3.427 N/A LEU 99.A N VAL 95.A O no hydrogen 2.863 N/A GLN 100.A N TYR 96.A O no hydrogen 3.031 N/A LYS 101.A N ARG 97.A O no hydrogen 3.087 N/A LYS 101.A N GLU 98.A O no hydrogen 3.051 N/A LEU 102.A N GLU 98.A O no hydrogen 3.090 N/A LYS 104.A N LEU 102.A O no hydrogen 2.685 N/A PHE 105.A N PHE 197.A O no hydrogen 2.754 N/A GLN 108.A NE2 ASN 261.A OD1 no hydrogen 2.723 N/A ARG 109.A N ASP 106.A OD1 no hydrogen 2.577 N/A THR 110.A N ASP 106.A O no hydrogen 3.229 N/A THR 110.A OG1 ASP 106.A O no hydrogen 2.938 N/A ALA 111.A N GLU 107.A O no hydrogen 2.981 N/A THR 112.A N GLN 108.A O no hydrogen 3.249 N/A THR 112.A OG1 GLN 108.A O no hydrogen 2.595 N/A THR 112.A OG1 SER 263.A OG no hydrogen 3.228 N/A TYR 113.A N ARG 109.A O no hydrogen 3.092 N/A ILE 114.A N THR 110.A O no hydrogen 2.852 N/A THR 115.A N ALA 111.A O no hydrogen 3.011 N/A THR 115.A N THR 112.A O no hydrogen 3.187 N/A THR 115.A OG1 ALA 111.A O no hydrogen 2.618 N/A THR 115.A OG1 SER 262.A OG no hydrogen 3.006 N/A GLU 116.A N THR 112.A O no hydrogen 2.978 N/A LEU 117.A N TYR 113.A O no hydrogen 2.754 N/A ALA 118.A N ILE 114.A O no hydrogen 3.130 N/A ASN 119.A N THR 115.A O no hydrogen 2.756 N/A ALA 120.A N GLU 116.A O no hydrogen 3.143 N/A LEU 121.A N LEU 117.A O no hydrogen 2.761 N/A SER 122.A N ALA 118.A O no hydrogen 2.907 N/A TYR 123.A N ASN 119.A O no hydrogen 3.025 N/A CYS 124.A N ALA 120.A O no hydrogen 3.040 N/A CYS 124.A SG ALA 120.A O no hydrogen 3.394 N/A HIS 125.A N LEU 121.A O no hydrogen 2.826 N/A HIS 125.A NE2 ASP 186.A OD2 no hydrogen 2.852 N/A SER 126.A N SER 122.A O no hydrogen 3.063 N/A SER 126.A OG TYR 123.A O no hydrogen 2.572 N/A LYS 127.A N TYR 123.A O no hydrogen 3.141 N/A LYS 127.A N CYS 124.A O no hydrogen 2.811 N/A ARG 128.A N HIS 125.A O no hydrogen 3.195 N/A ARG 128.A NH1 HIS 125.A O no hydrogen 2.968 N/A ARG 128.A NH1 GLU 183.A OE1 no hydrogen 2.853 N/A VAL 129.A N CYS 124.A O no hydrogen 2.884 N/A ILE 130.A N VAL 156.A O no hydrogen 2.933 N/A HIS 131.A N ASP 186.A OD2 no hydrogen 2.872 N/A HIS 131.A NE2 ALA 150.A O no hydrogen 2.801 N/A ARG 132.A N ASP 186.A OD1 no hydrogen 2.946 N/A ARG 132.A NE TRP 154.A O no hydrogen 2.782 N/A ARG 132.A NH1 HIS 181.A NE2 no hydrogen 3.148 N/A ARG 132.A NH2 TRP 154.A O no hydrogen 2.971 N/A ASP 133.A N HIS 131.A ND1 no hydrogen 3.020 N/A LYS 135.A NZ THR 167.A OG1 no hydrogen 3.174 N/A GLU 137.A N GLU 137.A OE1 no hydrogen 2.620 N/A ASN 138.A N LYS 135.A O no hydrogen 2.922 N/A ASN 138.A ND2 ASP 133.A O no hydrogen 2.565 N/A ASN 138.A ND2 ASP 133.A OD2 no hydrogen 2.735 N/A LEU 139.A N PRO 136.A O no hydrogen 3.128 N/A LEU 140.A N LYS 148.A O no hydrogen 2.750 N/A GLY 142.A N GLU 146.A O no hydrogen 2.882 N/A ALA 144.A N GLU 146.A OE1 no hydrogen 2.750 N/A GLY 145.A N GLY 142.A O no hydrogen 3.091 N/A GLU 146.A N GLU 146.A OE1 no hydrogen 2.751 N/A LEU 147.A N GLU 116.A OE1 no hydrogen 2.861 N/A LYS 148.A N LEU 140.A O no hydrogen 2.801 N/A LYS 148.A NZ PRO 68.A O no hydrogen 2.606 N/A LYS 148.A NZ GLU 88.A OE1 no hydrogen 3.151 N/A ILE 149.A N ASN 69.A O no hydrogen 2.971 N/A ALA 150.A N ASN 138.A O no hydrogen 3.027 N/A PHE 152.A N GLU 58.A OE2 no hydrogen 2.820 N/A SER 155.A N PHE 152.A O no hydrogen 3.249 N/A SER 155.A OG PHE 152.A O no hydrogen 2.577 N/A VAL 156.A N ILE 130.A O no hydrogen 2.999 N/A ALA 158.A N ARG 128.A O no hydrogen 2.829 N/A SER 161.A OG ARG 162.A O no hydrogen 3.250 N/A ARG 163.A N HIS 181.A O no hydrogen 2.798 N/A THR 167.A OG1 ASP 133.A OD1 no hydrogen 3.023 N/A TYR 170.A N THR 167.A O no hydrogen 2.759 N/A TYR 170.A OH GLU 196.A OE1 no hydrogen 2.486 N/A LEU 171.A N LEU 168.A O no hydrogen 3.494 N/A GLU 174.A N GLU 174.A OE1 no hydrogen 3.011 N/A MET 175.A N PRO 172.A O no hydrogen 3.174 N/A ILE 176.A N PRO 172.A O no hydrogen 3.391 N/A GLU 177.A N PRO 173.A O no hydrogen 2.787 N/A GLY 178.A N MET 175.A O no hydrogen 3.046 N/A ARG 179.A N GLU 174.A O no hydrogen 2.719 N/A ARG 179.A NE GLU 177.A OE1 no hydrogen 3.041 N/A ARG 179.A NH2 GLU 177.A OE1 no hydrogen 2.724 N/A HIS 181.A N ARG 163.A O no hydrogen 2.793 N/A LYS 184.A N ASP 182.A OD1 no hydrogen 3.216 N/A LYS 184.A NZ ARG 246.A O no hydrogen 2.912 N/A VAL 185.A N ASP 182.A O no hydrogen 3.314 N/A ASP 186.A N GLU 183.A O no hydrogen 3.197 N/A TRP 188.A N LYS 184.A O no hydrogen 3.397 N/A SER 189.A N VAL 185.A O no hydrogen 3.198 N/A SER 189.A OG TYR 170.A O no hydrogen 2.647 N/A SER 189.A OG VAL 185.A O no hydrogen 3.353 N/A LEU 190.A N ASP 186.A O no hydrogen 3.013 N/A GLY 191.A N LEU 187.A O no hydrogen 3.220 N/A GLY 191.A N TRP 188.A O no hydrogen 2.960 N/A VAL 192.A N TRP 188.A O no hydrogen 3.208 N/A LEU 193.A N SER 189.A O no hydrogen 2.887 N/A CYS 194.A N LEU 190.A O no hydrogen 3.023 N/A TYR 195.A N GLY 191.A O no hydrogen 2.954 N/A TYR 195.A OH THR 222.A O no hydrogen 2.501 N/A GLU 196.A N VAL 192.A O no hydrogen 3.091 N/A PHE 197.A N LEU 193.A O no hydrogen 2.785 N/A LEU 198.A N CYS 194.A O no hydrogen 3.227 N/A VAL 199.A N TYR 195.A O no hydrogen 2.763 N/A GLY 200.A N GLU 196.A O no hydrogen 2.817 N/A GLU 205.A N PRO 202.A O no hydrogen 3.260 N/A GLN 210.A N GLN 210.A OE1 no hydrogen 3.017 N/A GLU 211.A N THR 208.A OG1 no hydrogen 3.207 N/A THR 212.A N THR 208.A O no hydrogen 3.194 N/A THR 212.A OG1 PHE 204.A O no hydrogen 3.552 N/A THR 212.A OG1 THR 208.A O no hydrogen 3.078 N/A TYR 213.A N TYR 209.A O no hydrogen 2.973 N/A LYS 214.A N GLN 210.A O no hydrogen 3.209 N/A ARG 215.A N GLU 211.A O no hydrogen 2.986 N/A ILE 216.A N THR 212.A O no hydrogen 2.868 N/A SER 217.A N TYR 213.A O no hydrogen 3.035 N/A SER 217.A OG GLU 177.A OE2 no hydrogen 2.838 N/A ARG 218.A N LYS 214.A O no hydrogen 2.928 N/A VAL 219.A N ILE 216.A O no hydrogen 3.015 N/A GLU 220.A N ARG 215.A O no hydrogen 2.729 N/A VAL 227.A N PRO 224.A O no hydrogen 3.240 N/A THR 228.A OG1 GLU 107.A OE2 no hydrogen 2.567 N/A ARG 232.A N THR 228.A O no hydrogen 2.783 N/A ARG 232.A NE VAL 227.A O no hydrogen 2.908 N/A ARG 232.A NH2 PRO 224.A O no hydrogen 3.391 N/A ASP 233.A N GLU 229.A O no hydrogen 2.849 N/A LEU 234.A N GLY 230.A O no hydrogen 3.283 N/A ILE 235.A N ALA 231.A O no hydrogen 3.176 N/A SER 236.A N ARG 232.A O no hydrogen 3.104 N/A SER 236.A OG ARG 232.A O no hydrogen 2.814 N/A ARG 237.A N ASP 233.A O no hydrogen 3.038 N/A ARG 237.A NE ASP 233.A OD2 no hydrogen 3.098 N/A ARG 237.A NH2 ASP 233.A OD2 no hydrogen 3.291 N/A LEU 238.A N LEU 234.A O no hydrogen 2.969 N/A LEU 239.A N ILE 235.A O no hydrogen 2.765 N/A LYS 240.A NZ SER 236.A O no hydrogen 3.518 N/A HIS 241.A NE2 GLU 177.A OE2 no hydrogen 2.967 N/A SER 244.A N ASN 242.A OD1 no hydrogen 3.081 N/A SER 244.A OG ASN 242.A OD1 no hydrogen 2.550 N/A GLN 245.A N ASN 242.A O no hydrogen 2.930 N/A ARG 246.A N PRO 243.A O no hydrogen 3.094 N/A ARG 246.A NE LYS 240.A O no hydrogen 2.874 N/A ARG 246.A NH1 GLU 174.A OE1 no hydrogen 3.268 N/A ARG 246.A NH1 GLU 174.A OE2 no hydrogen 2.990 N/A ARG 246.A NH1 LYS 184.A O no hydrogen 2.842 N/A ARG 246.A NH2 GLU 174.A OE1 no hydrogen 2.794 N/A ARG 246.A NH2 LYS 240.A O no hydrogen 2.991 N/A MET 248.A N GLU 251.A OE1 no hydrogen 2.528 N/A GLU 251.A N MET 248.A O no hydrogen 3.058 N/A VAL 252.A N MET 248.A O no hydrogen 3.342 N/A LEU 253.A N LEU 249.A O no hydrogen 2.893 N/A GLU 254.A N ARG 250.A O no hydrogen 3.204 N/A HIS 255.A N VAL 252.A O no hydrogen 3.242 N/A HIS 255.A NE2 ASP 233.A OD2 no hydrogen 2.883 N/A TRP 257.A N HIS 255.A ND1 no hydrogen 3.075 N/A TRP 257.A NE1 GLU 107.A OE2 no hydrogen 2.813 N/A THR 259.A N HIS 255.A O no hydrogen 2.867 N/A THR 259.A OG1 HIS 255.A O no hydrogen 3.182 N/A THR 259.A OG1 PRO 256.A O no hydrogen 3.160 N/A ALA 260.A N PRO 256.A O no hydrogen 2.978 N/A ASN 261.A N ILE 258.A O no hydrogen 3.325 N/A ASN 261.A ND2 TRP 257.A O no hydrogen 2.867 N/A SER 262.A N ILE 258.A O no hydrogen 2.676 N/A SER 262.A OG THR 115.A OG1 no hydrogen 3.006 N/A SER 263.A N THR 112.A OG1 no hydrogen 3.391 N/A SER 263.A OG THR 112.A OG1 no hydrogen 3.228 N/A