Upper HA LYS+ 20 - HN TYR 22 4.32 20 1.27 1.30 +++++++++++*++++++++ Upper HN GLU- 19 - HN LYS+ 20 3.58 20 0.86 1.05 +++++++++++++*++++++ Upper HN THR 2 - HN GLU- 3 3.64 20 0.66 0.67 +++++*++++++++++++++ Upper HN LYS+ 109 - HN ARG+ 110 3.73 20 0.58 0.58 +++++*++++++++++++++ Upper HN ASP- 75 - HN GLY 76 4.04 20 0.44 0.51 *+++++++++++++++++++ Upper HB2 LEU 37 - HN VAL 38 3.64 20 0.43 0.45 +++++++++++++++++*++ Upper HN LYS+ 20 - HN LYS+ 21 3.89 20 0.42 0.46 ++++++*+++++++++++++ Upper HG LEU 50 - HN TYR 77 4.88 20 0.41 0.61 ++++++++++++++++++*+ Upper HN GLU- 19 - HB3 GLU- 19 3.08 20 0.39 0.50 +++++++++++++*++++++ Upper HA MET 26 - HN SER 27 2.52 20 0.39 0.44 *+++++++++++++++++++ Upper HN GLN 56 - HB3 GLN 56 3.33 18 0.38 0.56 +++ +++++++ +++++++* Upper HN THR 42 - HN VAL 43 4.07 20 0.36 0.40 +++++++++*++++++++++ Upper HN MET 26 - HN SER 27 4.04 20 0.36 0.51 +++++++++++++++++*++ Upper HA GLN 56 - HB3 LEU 57 4.17 20 0.36 0.39 ++++++++++++++++++*+ Upper HA ASP- 70 - HN LEU 71 3.21 20 0.36 0.38 ++*+++++++++++++++++ Upper HN LYS+ 66 - HB3 LYS+ 66 3.14 14 0.35 0.61 ++++++++ *+ +++ + Upper HA GLN 56 - HB2 LEU 57 4.17 20 0.35 0.37 +++++++++++++++*++++ Upper HB THR 62 - HN ASP- 63 3.76 20 0.33 0.79 ++++++++*+++++++++++ Upper HN LYS+ 66 - HN SER 67 3.95 20 0.32 0.40 +++++++++++++++++*++ Upper HN LYS+ 20 - HB3 LYS+ 20 3.36 14 0.32 0.50 ++ +++++++ + + *++ Upper HA VAL 38 - HN VAL 39 3.27 20 0.32 0.33 ++++++++++++*+++++++ Upper HA ASN 29 - HN ASP- 30 3.27 20 0.32 0.37 ++++++++++*+++++++++ Upper HN MET 46 - HN ARG+ 47 4.11 20 0.30 0.41 +*++++++++++++++++++ Upper HA THR 10 - HN ALA 81 4.23 19 0.30 0.42 ++++++++++++++ +++*+ Upper HA ARG+ 78 - HB ILE 79 3.80 20 0.30 0.36 ++++*+++++++++++++++ Upper HB2 LYS+ 20 - HN LYS+ 21 3.92 9 0.29 0.62 ++ + ++ *+++ Upper HA LYS+ 34 - HN LEU 37 3.08 19 0.29 0.37 ++++++++++++++++*++ Upper HN VAL 4 - HB VAL 4 3.14 16 0.28 0.41 +++*++++++ + +++++ Upper HN ARG+ 47 - HA ALA 81 3.83 18 0.27 0.39 ++++ + +++++++++++*+ Upper HA VAL 4 - HN TYR 22 4.42 19 0.27 0.37 +++++++++++++ ++++*+ Upper HN GLU- 36 - HB3 GLU- 36 3.24 17 0.26 0.31 +++++++ ++++*++++ + Upper HN ALA 24 - HN MET 26 4.01 19 0.26 0.31 ++++++++++++++*+ +++ Upper HA LEU 61 - HN THR 62 2.87 16 0.26 0.45 + ++++++++ +*++++ + Upper HA LYS+ 33 - HG2 GLU- 36 3.70 14 0.25 0.48 ++ + ++ +++++++*+ Upper HN LEU 37 - HB2 LEU 37 3.05 20 0.24 0.26 ++++++*+++++++++++++ Upper HN GLY 25 - HA MET 26 4.23 12 0.24 0.41 ++++ ++++ ++* + Upper HB2 LYS+ 21 - HN TYR 22 4.23 17 0.24 0.31 + ++++++++*+ +++ +++ Upper HN GLU- 3 - HA GLU- 3 2.40 20 0.23 0.25 +++++++++++*++++++++ Upper HN ASP- 6 - HB3 ASP- 6 3.14 13 0.23 0.43 ++ + * +++ +++++ + Upper HB3 LYS+ 21 - HN TYR 22 4.23 17 0.23 0.31 + +++*++++++ +++ +++ Upper HN THR 11 - HB THR 11 3.21 14 0.22 0.35 +++++ ++++ + ++* + Upper HN ASP- 63 - HB3 ASP- 63 3.02 13 0.22 0.34 +*++ + ++ +++++ + Upper HA THR 85 - HN GLY 86 3.05 20 0.22 0.24 +++++++++++*++++++++ Upper HA THR 11 - HB THR 11 2.68 16 0.22 0.26 +++*+++++++++++ + Upper HN SER 67 - HN LYS+ 69 4.38 13 0.21 0.31 + +++ ++ +++*++ + Upper HN LYS+ 66 - HB2 LYS+ 66 3.14 8 0.21 0.65 + ++ ++++ * Upper HN GLY 59 - HN GLU- 60 4.11 13 0.21 0.26 +++++ + + ++++*+ Upper HN GLY 53 - HN ASP- 55 3.95 10 0.21 0.42 ++* + +++++ + Upper HA VAL 39 - HN THR 41 3.86 12 0.21 0.26 ++ + + ++++ ++ *+ Upper HA LEU 68 - HN ASP- 70 3.83 10 0.21 0.29 + + ++ + +++*+ Upper HA2 GLY 64 - HN LYS+ 66 4.32 10 0.21 0.33 ++ ++ + *+ +++ Upper HN VAL 4 - HN ALA 24 3.95 11 0.20 0.27 + + * ++++ +++ + Upper HN GLU- 19 - HB2 GLU- 19 3.08 10 0.20 0.42 +*++ + + + + ++ Upper HB3 LEU 68 - HN LYS+ 69 3.61 9 0.20 0.42 ++ + + + + + +* Upper HA MET 26 - HB3 MET 26 2.80 7 0.20 0.24 + * + ++ + + Upper HA LYS+ 66 - HN SER 67 2.68 11 0.20 0.29 ++++ ++ ++*+ + Upper HB3 GLU- 36 - HN LEU 37 3.49 9 0.19 0.32 + + + *+ +++ + Upper HB2 GLN 56 - HN LEU 57 3.92 8 0.19 0.45 +++ + + +* + Upper HN SER 27 - HN LEU 28 4.14 4 0.18 0.24 + * + + Upper HN LEU 7 - HB3 LEU 7 3.45 8 0.18 0.32 + ++ + ++ +* Upper HN MET 18 - HN GLU- 19 4.07 2 0.17 0.24 * + Upper HN HIS 80 - HN ALA 81 4.20 3 0.17 0.21 + + * Upper HN ASP- 6 - HN TYR 77 4.76 6 0.17 0.30 ++ ++ * + Upper HB2 SER 45 - HN MET 46 3.98 3 0.17 0.23 * + + Upper HA THR 41 - HB THR 41 2.83 15 0.17 0.23 +++*+++ ++ +++++ + Upper HN VAL 82 - HN ASP- 83 4.07 1 0.16 0.26 * Upper HN ASP- 54 - HN GLN 56 3.30 9 0.16 0.37 +++ * ++++ + Upper HB ILE 9 - HN THR 10 3.83 5 0.16 0.25 ++ * + + Upper HB3 HIS 80 - HN ALA 81 4.23 4 0.16 0.24 + + * + Upper HB3 ASP- 6 - HN LEU 7 3.92 7 0.16 0.43 ++ + + + +* Upper HN LYS+ 69 - HB3 ASP- 70 4.97 1 0.15 0.23 * Upper HN ASP- 54 - HB3 ASP- 54 3.30 8 0.14 0.49 +++ *++ + + Upper HB VAL 4 - HN TYR 5 3.24 3 0.14 0.24 + + * Upper HA THR 11 - HN ALA 13 3.86 1 0.14 0.22 * Upper HA ASP- 75 - HB3 ASP- 75 2.83 11 0.14 0.22 +++ ++ + ++ + *+ Upper HA ALA 24 - HG LEU 68 4.01 4 0.14 0.43 + * ++ Upper HN LYS+ 66 - QB LYS+ 66 2.89 2 0.13 0.20 +* Upper HB2 ASP- 6 - HN LEU 7 3.92 7 0.13 0.41 *+ + + + ++ Upper HB2 ARG+ 74 - HN ASP- 75 3.11 5 0.13 0.29 + + +*+ Upper HN ASP- 75 - HB2 ASP- 75 3.08 6 0.12 0.42 * + + + + + Upper HG LEU 50 - HA VAL 73 3.92 6 0.12 0.34 + +++ * + Upper HB THR 11 - HN ASN 12 2.80 1 0.12 0.23 * Upper HB THR 11 - HN ALA 81 4.82 1 0.12 0.26 * Upper HA TYR 5 - HN ASP- 75 4.35 5 0.12 0.30 + + + + * Upper HB2 MET 46 - HN ARG+ 47 4.07 2 0.11 0.20 + * Upper HA GLU- 36 - QG2 THR 41 4.95 2 0.11 0.28 + * Upper HA ALA 24 - HN LYS+ 69 3.61 1 0.11 0.21 * Upper HN LEU 7 - HN LYS+ 21 4.82 5 0.10 0.31 + + + +* Upper HN GLY 53 - QB GLN 56 4.02 1 0.10 0.23 * Upper HG LEU 50 - QB ASP- 52 5.95 4 0.10 0.29 ++ * + Upper HB THR 41 - HN THR 42 3.11 5 0.10 0.46 + + * ++ Upper HB2 ASP- 52 - HN GLY 53 3.33 2 0.10 0.32 * + Upper HA TYR 100 - HN GLU- 101 2.68 4 0.10 0.49 * + ++ Upper HA THR 42 - HN ASP- 44 4.01 5 0.10 0.22 + +* ++ Upper HA THR 41 - HN THR 42 2.74 7 0.10 0.30 * + + + +++ Upper QG LYS+ 66 - HN ASP- 70 5.61 3 0.09 0.22 + * + Upper HN LYS+ 21 - HB2 LYS+ 21 2.93 3 0.09 0.62 * + + Upper HN ASP- 75 - HB3 ASP- 75 3.08 5 0.09 0.36 + * + + + Upper HN LEU 50 - HN LEU 61 3.89 2 0.08 0.48 +* Upper HN ILE 48 - HN LEU 61 4.38 1 0.08 0.23 * Upper HB2 PHE 16 - HD3 PRO 17 4.29 1 0.07 0.24 * Upper QE TYR 5 - HN ASP- 75 7.63 2 0.06 0.26 * + Upper HN LEU 7 - HA LYS+ 20 4.82 1 0.06 0.23 * Upper HN LEU 50 - QG2 ILE 79 5.26 2 0.06 0.58 + * Upper HN ASP- 75 - QB ASP- 75 2.82 1 0.06 0.21 * Upper HN ASP- 105 - HN THR 106 3.58 4 0.06 0.35 + * ++ Upper HG LEU 50 - HA ILE 79 4.32 1 0.06 0.22 * Upper HB3 PHE 16 - HD3 PRO 17 4.29 1 0.06 0.23 * Upper HB3 ASP- 52 - QE TYR 77 7.63 2 0.06 0.64 +* Upper QB LYS+ 20 - HN LYS+ 21 3.46 3 0.05 0.28 + *+ Upper HA ILE 9 - HN ILE 79 3.55 1 0.05 0.20 * Upper HA ASP- 52 - HN GLY 53 3.30 4 0.05 0.29 + * ++ Upper HA ASP- 52 - HN ARG+ 78 3.64 2 0.05 0.40 *+ Upper HN VAL 84 - HB VAL 84 3.30 3 0.04 0.24 + + * Upper HN LYS+ 21 - HB3 LYS+ 21 2.93 2 0.04 0.35 * + Upper HN LEU 68 - HG LEU 68 2.99 1 0.04 0.21 * Upper HN ASP- 44 - HB3 ASP- 44 3.08 1 0.04 0.27 * Upper HG LEU 50 - QD1 ILE 79 3.74 1 0.04 0.29 * Upper HA VAL 97 - HN GLU- 98 2.74 2 0.04 0.35 + * Upper QG2 THR 10 - HN ASN 12 6.53 1 0.03 0.36 * Upper HN VAL 97 - HN GLU- 98 3.76 2 0.03 0.37 * + Upper HN VAL 73 - HB VAL 73 2.99 1 0.03 0.50 * Upper HN LYS+ 66 - HG2 LYS+ 66 4.54 1 0.03 0.21 * Upper HN GLN 56 - HG3 GLN 56 3.83 1 0.03 0.36 * Upper HN ASP- 90 - HB2 ASP- 90 3.21 2 0.03 0.26 * + Upper HN ASP- 52 - HB2 ASP- 52 3.33 1 0.03 0.22 * Upper HB3 GLN 56 - HN LEU 57 3.92 1 0.03 0.50 * Upper HB3 ASP- 83 - HN VAL 84 3.92 2 0.03 0.22 + * Upper HB2 LEU 35 - HN GLU- 36 4.01 2 0.03 0.32 + * Upper HB2 ASP- 83 - HN VAL 84 3.92 2 0.03 0.22 + * Upper HN LYS+ 32 - HE3 LYS+ 32 5.50 1 0.02 0.21 * Upper HN GLY 53 - QE TYR 77 6.98 1 0.02 0.39 * Upper HG3 GLN 56 - HN LEU 57 5.16 1 0.02 0.25 * Upper HG2 LYS+ 58 - QE TYR 77 7.63 1 0.02 0.26 * Upper HB2 ASP- 52 - QE TYR 77 7.63 1 0.02 0.20 * Upper HA LYS+ 32 - HB2 LEU 35 3.83 1 0.02 0.23 * Upper HA LEU 7 - HN GLY 76 3.86 1 0.02 0.21 * Upper HN ASN 12 - HD22 ASN 12 5.50 1 0.01 0.21 * Upper HB ILE 48 - QB LEU 61 4.74 1 0.01 0.26 * Cutoffs: Upper distance limits : 0.20 A