#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2q67 h LEU 2 N 0.00 0.49 0.13 3.17 6.46 -2.05 -1.05 115.31 122.47 2q67 h LEU 2 Ca 0.00 0.04 0.01 0.00 -0.12 0.00 0.00 57.88 57.81 2q67 h LEU 2 Cb 0.00 -0.06 -0.02 0.00 -0.73 0.00 0.00 40.66 39.85 2q67 h LEU 2 CO 0.00 0.23 -0.20 -1.28 -0.62 0.00 0.00 178.44 176.57 2q67 h SER 3 N 0.51 -0.55 -0.28 1.25 0.87 -2.05 0.39 113.55 113.70 2q67 h SER 3 Ca 0.44 0.06 0.03 0.00 -1.23 0.00 0.00 61.79 61.10 2q67 h SER 3 Cb 0.94 0.20 -0.03 0.00 -0.44 0.00 0.00 62.40 63.08 2q67 h SER 3 CO -0.18 -0.29 0.08 0.15 -0.53 0.00 0.00 176.83 176.07 2q67 h PHE 4 N -0.39 0.15 -0.70 2.24 3.57 -1.65 -0.26 116.94 119.89 2q67 h PHE 4 Ca 0.02 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.53 2q67 h PHE 4 Cb 0.40 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 39.08 2q67 h PHE 4 CO -0.18 0.06 0.43 1.25 -2.23 0.00 0.00 178.31 177.64 2q67 h LEU 5 N 0.20 0.84 -0.44 0.59 7.12 -1.06 -0.07 115.31 122.50 2q67 h LEU 5 Ca 0.13 -0.06 -0.07 0.00 0.13 0.00 0.00 57.88 58.01 2q67 h LEU 5 Cb 0.10 -0.21 -0.02 0.00 -0.53 0.00 0.00 40.66 40.01 2q67 h LEU 5 CO -0.14 0.65 -0.01 -0.07 -0.13 0.00 0.00 178.44 178.74 2q67 h LEU 6 N 0.96 0.76 -0.77 2.25 3.38 0.21 -0.53 115.31 121.57 2q67 h LEU 6 Ca 0.25 -0.31 -0.02 0.00 0.09 0.00 0.00 57.88 57.89 2q67 h LEU 6 Cb -0.04 -0.21 -0.04 0.00 0.09 0.00 0.00 40.66 40.47 2q67 h LEU 6 CO -0.05 0.89 0.41 0.74 0.09 0.00 0.00 178.44 180.52 2q67 h THR 7 N 0.62 1.24 0.32 0.22 2.02 -0.76 -0.75 112.91 115.81 2q67 h THR 7 Ca 0.12 -0.62 -0.02 0.00 0.77 0.00 0.00 66.41 66.67 2q67 h THR 7 Cb 0.51 0.23 0.00 0.00 -1.74 0.00 0.00 68.15 67.15 2q67 h THR 7 CO 0.02 0.27 -0.15 0.25 0.37 0.00 0.00 175.52 176.28 2q67 h LEU 8 N 1.07 -0.36 -1.15 2.58 5.85 -0.78 -1.67 115.31 120.87 2q67 h LEU 8 Ca 0.27 -0.07 0.15 0.00 0.84 0.00 0.00 57.88 59.07 2q67 h LEU 8 Cb 0.06 0.09 -0.08 0.00 0.37 0.00 0.00 40.66 41.10 2q67 h LEU 8 CO -0.04 -0.15 0.61 0.11 -0.34 0.00 0.00 178.44 178.62 2q67 h LYS 9 N -0.56 0.77 -0.55 1.25 1.57 -0.94 0.26 116.57 118.37 2q67 h LYS 9 Ca -0.04 -0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 58.65 2q67 h LYS 9 Cb 0.41 -0.17 -0.02 0.00 0.08 0.00 0.00 32.23 32.52 2q67 h LYS 9 CO 0.07 0.51 0.19 -0.09 -0.57 0.00 0.00 179.45 179.57 2q67 h ARG 10 N 0.80 0.84 -0.37 3.15 2.43 -0.89 -0.84 114.38 119.50 2q67 h ARG 10 Ca 0.50 -0.17 -0.08 0.00 -0.81 0.00 0.00 59.98 59.41 2q67 h ARG 10 Cb 0.71 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 30.12 2q67 h ARG 10 CO -0.26 0.75 -0.10 0.52 -1.51 0.00 0.00 179.97 179.37 2q67 h MET 11 N 0.76 0.72 -0.89 0.20 2.86 0.07 -2.02 114.93 116.63 2q67 h MET 11 Ca 0.18 -0.28 -0.01 0.00 -2.06 0.00 0.00 59.70 57.53 2q67 h MET 11 Cb 0.24 -0.04 -0.04 0.00 0.06 0.00 0.00 31.60 31.82 2q67 h MET 11 CO -0.01 0.88 0.50 -0.07 1.06 0.00 0.00 176.91 179.27 2q67 h LEU 12 N 0.52 1.10 -0.85 1.22 4.07 -0.44 -1.16 115.31 119.78 2q67 h LEU 12 Ca 0.09 -0.09 -0.05 0.00 0.08 0.00 0.00 57.88 57.91 2q67 h LEU 12 Cb 0.62 -0.28 -0.03 0.00 1.08 0.00 0.00 40.66 42.04 2q67 h LEU 12 CO 0.04 0.87 0.27 0.03 -1.08 0.00 0.00 178.44 178.57 2q67 h ARG 13 N 1.25 1.12 -0.10 1.13 3.08 -0.97 -0.53 114.38 119.35 2q67 h ARG 13 Ca 0.32 -0.21 -0.06 0.00 0.07 0.00 0.00 59.98 60.09 2q67 h ARG 13 Cb 0.01 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 29.87 2q67 h ARG 13 CO -0.05 0.93 -0.23 0.00 -1.07 0.00 0.00 179.97 179.55 2q67 h ALA 14 N 1.20 1.44 -0.09 0.04 0.00 -0.66 -0.42 119.26 120.77 2q67 h ALA 14 Ca 0.24 -0.26 -0.09 0.00 0.00 0.00 0.00 54.91 54.80 2q67 h ALA 14 Cb 0.25 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2q67 h ALA 14 CO -0.02 0.39 -0.31 0.00 0.00 0.00 0.00 179.25 179.32 2q67 h LEU 16 N -0.08 0.67 -1.21 0.00 3.38 -0.91 -1.46 115.31 115.70 2q67 h LEU 16 Ca -0.01 -0.10 0.05 0.00 0.09 0.00 0.00 57.88 57.91 2q67 h LEU 16 Cb 0.94 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 41.47 2q67 h LEU 16 CO 0.07 0.64 0.55 -0.09 0.09 0.00 0.00 178.44 179.70 2q67 h ARG 17 N 0.71 0.95 -0.39 1.13 2.43 -1.00 -2.00 114.38 116.22 2q67 h ARG 17 Ca 0.17 -0.06 -0.02 0.00 -0.81 0.00 0.00 59.98 59.26 2q67 h ARG 17 Cb 0.21 -0.22 -0.02 0.00 -0.42 0.00 0.00 29.97 29.53 2q67 h ARG 17 CO -0.01 0.63 0.18 0.00 -1.51 0.00 0.00 179.97 179.26 2q67 h ALA 18 N 1.53 0.50 0.00 2.80 0.00 -0.96 -2.22 119.26 120.92 2q67 h ALA 18 Ca 0.35 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.15 2q67 h ALA 18 Cb 0.15 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.78 2q67 h ALA 18 CO -0.12 0.08 0.00 0.91 0.00 0.00 0.00 179.25 180.12 2q67 n TRP 19 N -4.69 0.00 -0.00 0.00 8.01 -0.75 -0.41 117.44 119.60 2q67 n TRP 19 Ca -0.00 0.00 0.02 0.00 -1.31 0.00 0.00 57.50 56.21 2q67 n TRP 19 Cb 0.12 -0.01 -0.04 0.00 -2.01 0.00 0.00 31.31 29.38 2q67 n TRP 19 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.69 177.85 2q67 n LYS 20 N -0.17 0.22 -2.32 -0.99 4.81 -0.83 -4.92 118.16 113.96 2q67 n LYS 20 Ca 0.00 -0.04 -0.42 0.00 -0.87 0.00 0.00 58.31 56.97 2q67 n LYS 20 Cb 0.02 -1.12 -0.03 0.00 0.02 0.00 0.00 35.03 33.92 2q67 n LYS 20 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 2q67 s ASP 21 N -2.59 6.95 0.23 3.14 2.15 0.46 -4.93 116.67 122.08 2q67 s ASP 21 Ca -0.02 2.05 -0.06 0.00 0.43 0.00 0.00 52.55 54.95 2q67 s ASP 21 Cb 0.03 -2.57 0.33 0.00 -0.30 0.00 0.00 42.92 40.41 2q67 s ASP 21 CO 0.20 -0.62 1.83 0.11 -0.17 0.00 0.00 175.17 176.52 2q67 h LYS 22 N 7.37 0.81 -0.25 4.34 1.57 -1.94 -1.34 116.57 127.12 2q67 h LYS 22 Ca -0.38 -0.05 -0.07 0.00 -1.87 0.00 0.00 60.65 58.28 2q67 h LYS 22 Cb 1.19 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 33.30 2q67 h LYS 22 CO 0.87 0.53 -0.13 0.93 -0.57 0.00 0.00 179.45 181.08 2q67 h GLU 23 N 0.83 0.42 -0.37 3.15 5.08 -1.95 0.29 114.58 122.03 2q67 h GLU 23 Ca 0.36 -0.12 -0.15 0.00 -1.00 0.00 0.00 59.36 58.45 2q67 h GLU 23 Cb 0.24 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 2q67 h GLU 23 CO -0.20 0.55 -0.38 0.35 -1.00 0.00 0.00 179.01 178.34 2q67 h PHE 24 N 0.39 1.05 -0.66 4.33 3.04 -1.70 -1.63 116.94 121.77 2q67 h PHE 24 Ca 0.07 -0.31 -0.04 0.00 3.98 0.00 0.00 57.97 61.68 2q67 h PHE 24 Cb 0.47 -0.22 -0.03 0.00 2.56 0.00 0.00 35.95 38.72 2q67 h PHE 24 CO 0.01 1.12 0.26 1.96 -2.02 0.00 0.00 178.31 179.64 2q67 h GLN 25 N 0.72 0.99 0.33 1.11 4.20 -0.54 0.34 115.11 122.26 2q67 h GLN 25 Ca 0.06 -0.18 -0.02 0.00 0.06 0.00 0.00 58.65 58.57 2q67 h GLN 25 Cb 0.96 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 28.58 2q67 h GLN 25 CO 0.09 0.83 -0.16 0.28 -0.67 0.00 0.00 178.83 179.20 2q67 h VAL 26 N 0.94 0.69 -0.83 -0.54 2.07 -0.80 0.11 116.25 117.89 2q67 h VAL 26 Ca 0.22 -0.15 0.09 0.00 0.82 0.00 0.00 66.70 67.68 2q67 h VAL 26 Cb 0.21 0.77 -0.07 0.00 -1.52 0.00 0.00 31.29 30.69 2q67 h VAL 26 CO -0.02 0.03 0.49 -0.07 0.02 0.00 0.00 177.57 178.02 2q67 h LEU 27 N -0.52 0.72 -0.21 2.57 3.38 -0.99 0.24 115.31 120.49 2q67 h LEU 27 Ca -0.05 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 2q67 h LEU 27 Cb 0.39 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 2q67 h LEU 27 CO 0.07 0.42 0.08 0.15 0.09 0.00 0.00 178.44 179.25 2q67 h PHE 28 N 0.83 0.32 -0.51 1.13 3.57 -0.06 -1.70 116.94 120.52 2q67 h PHE 28 Ca 0.39 -0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.85 2q67 h PHE 28 Cb 0.32 -0.09 -0.02 0.00 2.79 0.00 0.00 35.95 38.94 2q67 h PHE 28 CO -0.05 0.37 0.27 0.28 -2.23 0.00 0.00 178.31 176.95 2q67 h VAL 29 N 0.17 1.18 -0.96 1.41 2.07 -0.05 -1.81 116.25 118.26 2q67 h VAL 29 Ca 0.07 -0.47 0.04 0.00 0.82 0.00 0.00 66.70 67.16 2q67 h VAL 29 Cb 0.19 0.55 -0.06 0.00 -1.52 0.00 0.00 31.29 30.46 2q67 h VAL 29 CO -0.00 0.19 0.63 -0.07 0.02 0.00 0.00 177.57 178.34 2q67 h LEU 30 N 0.68 1.04 -0.43 2.57 3.38 -0.44 0.17 115.31 122.29 2q67 h LEU 30 Ca 0.18 -0.01 -0.17 0.00 0.09 0.00 0.00 57.88 57.97 2q67 h LEU 30 Cb 0.06 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.57 2q67 h LEU 30 CO -0.03 0.71 -0.53 0.71 0.09 0.00 0.00 178.44 179.39 2q67 h THR 31 N 1.21 1.30 -0.51 0.22 1.35 -0.92 0.14 112.91 115.69 2q67 h THR 31 Ca 0.39 -1.75 -0.04 0.00 -0.55 0.00 0.00 66.41 64.46 2q67 h THR 31 Cb 0.01 1.68 -0.02 0.00 -1.73 0.00 0.00 68.15 68.09 2q67 h THR 31 CO -0.13 0.56 0.16 0.40 -0.25 0.00 0.00 175.52 176.26 2q67 h ILE 32 N 0.55 1.23 -0.87 6.82 1.08 -0.85 0.14 117.51 125.61 2q67 h ILE 32 Ca 0.01 -0.78 -0.02 0.00 -0.39 0.00 0.00 64.86 63.68 2q67 h ILE 32 Cb 1.11 0.78 -0.04 0.00 -3.07 0.00 0.00 36.82 35.59 2q67 h ILE 32 CO 0.11 0.29 0.46 -0.07 -0.69 0.00 0.00 178.15 178.25 2q67 h LEU 33 N 0.69 1.10 -0.87 1.44 4.07 -0.50 -0.43 115.31 120.82 2q67 h LEU 33 Ca 0.16 -0.11 -0.09 0.00 0.08 0.00 0.00 57.88 57.92 2q67 h LEU 33 Cb 0.28 -0.28 -0.02 0.00 1.08 0.00 0.00 40.66 41.72 2q67 h LEU 33 CO -0.00 0.90 -0.14 0.74 -1.08 0.00 0.00 178.44 178.85 2q67 h THR 34 N 1.22 1.25 -0.37 0.22 2.02 -0.22 -1.11 112.91 115.93 2q67 h THR 34 Ca 0.30 -1.17 -0.13 0.00 0.77 0.00 0.00 66.41 66.18 2q67 h THR 34 Cb 0.05 1.12 -0.01 0.00 -1.74 0.00 0.00 68.15 67.57 2q67 h THR 34 CO -0.05 0.39 -0.28 -0.07 0.37 0.00 0.00 175.52 175.88 2q67 h LEU 35 N 0.62 0.88 -0.35 2.58 4.07 -0.16 -1.63 115.31 121.33 2q67 h LEU 35 Ca 0.10 -0.44 -0.02 0.00 0.08 0.00 0.00 57.88 57.60 2q67 h LEU 35 Cb 0.59 -0.25 -0.02 0.00 1.08 0.00 0.00 40.66 42.07 2q67 h LEU 35 CO 0.04 1.14 0.14 0.40 -1.08 0.00 0.00 178.44 179.08 2q67 h ILE 36 N 0.64 1.19 -0.62 1.22 2.04 -0.93 -0.23 117.51 120.82 2q67 h ILE 36 Ca 0.07 -0.59 0.03 0.00 1.00 0.00 0.00 64.86 65.37 2q67 h ILE 36 Cb 0.86 0.93 -0.04 0.00 -0.74 0.00 0.00 36.82 37.83 2q67 h ILE 36 CO 0.07 0.21 0.38 0.28 0.00 0.00 0.00 178.15 179.09 2q67 h SER 37 N 0.42 0.62 -0.48 1.72 0.02 -1.14 -0.46 113.55 114.24 2q67 h SER 37 Ca 0.12 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.06 2q67 h SER 37 Cb 0.19 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 62.58 2q67 h SER 37 CO -0.01 0.43 0.25 1.23 -1.14 0.00 0.00 176.83 177.59 2q67 h GLY 38 N 0.74 0.72 0.98 -3.77 0.00 -0.98 0.26 103.07 101.01 2q67 h GLY 38 Ca 0.25 -0.33 0.01 0.00 0.00 0.00 0.00 47.33 47.25 2q67 h GLY 38 CO -0.11 0.32 0.29 -0.84 0.00 0.00 0.00 176.54 176.20 2q67 h THR 39 N 0.63 1.10 0.44 4.70 2.02 -0.49 -1.05 112.91 120.25 2q67 h THR 39 Ca 0.17 -0.20 -0.02 0.00 0.77 0.00 0.00 66.41 67.12 2q67 h THR 39 Cb 0.07 0.46 0.00 0.00 -1.74 0.00 0.00 68.15 66.95 2q67 h THR 39 CO -0.03 0.11 -0.21 0.40 0.37 0.00 0.00 175.52 176.16 2q67 h ILE 40 N 0.59 0.57 0.09 3.11 2.04 -0.78 -2.04 117.51 121.08 2q67 h ILE 40 Ca 0.17 -0.01 0.02 0.00 1.00 0.00 0.00 64.86 66.04 2q67 h ILE 40 Cb -0.05 0.57 -0.04 0.00 -0.74 0.00 0.00 36.82 36.56 2q67 h ILE 40 CO -0.05 0.00 -0.34 0.15 0.00 0.00 0.00 178.15 177.92 2q67 h PHE 41 N -0.60 -0.92 0.00 1.37 3.57 -0.76 -1.42 116.94 118.19 2q67 h PHE 41 Ca -0.06 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.43 2q67 h PHE 41 Cb 0.46 0.39 -0.01 0.00 2.79 0.00 0.00 35.95 39.58 2q67 h PHE 41 CO -0.04 -0.44 -0.18 1.88 -2.23 0.00 0.00 178.31 177.30 2q67 h TYR 42 N -0.55 0.00 -0.04 0.41 -1.99 -1.22 0.46 116.97 114.05 2q67 h TYR 42 Ca 0.04 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.75 2q67 h TYR 42 Cb 0.59 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 39.32 2q67 h TYR 42 CO -0.31 0.18 -0.05 0.77 -0.00 0.00 0.00 178.16 178.75 2q67 h SER 43 N 0.00 0.10 0.32 3.88 0.02 -1.01 -2.24 113.55 114.63 2q67 h SER 43 Ca -0.00 -0.51 -0.02 0.00 -0.84 0.00 0.00 61.79 60.42 2q67 h SER 43 Cb 0.36 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.88 2q67 h SER 43 CO 0.02 0.60 -0.16 0.74 -1.14 0.00 0.00 176.83 176.89 2q67 h THR 44 N -0.39 0.34 -0.01 -2.27 2.02 -0.90 -1.90 112.91 109.80 2q67 h THR 44 Ca 0.00 -0.77 -0.18 0.00 0.77 0.00 0.00 66.41 66.23 2q67 h THR 44 Cb 0.57 0.56 -0.01 0.00 -1.74 0.00 0.00 68.15 67.53 2q67 h THR 44 CO 0.01 0.08 -0.81 0.58 0.37 0.00 0.00 175.52 175.75 2q67 h VAL 45 N -1.02 1.49 -0.02 3.16 2.07 -0.25 -3.31 116.25 118.37 2q67 h VAL 45 Ca -0.04 -2.51 0.00 0.00 0.82 0.00 0.00 66.70 64.96 2q67 h VAL 45 Cb 0.47 2.38 0.00 0.00 -1.52 0.00 0.00 31.29 32.62 2q67 h VAL 45 CO 0.07 0.73 -0.11 -0.62 0.02 0.00 0.00 177.57 177.67 2q67 n GLU 46 N -3.69 1.40 -2.94 1.57 -0.58 -0.88 -4.91 120.64 110.61 2q67 n GLU 46 Ca -0.03 -1.22 -0.19 0.00 -0.42 0.00 0.00 57.16 55.30 2q67 n GLU 46 Cb 0.76 -1.28 0.03 0.00 -0.57 0.00 0.00 31.44 30.38 2q67 n GLU 46 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2q67 n GLY 47 N 0.97 -0.35 3.89 0.62 0.00 -0.73 -4.96 105.19 104.63 2q67 n GLY 47 Ca 0.08 0.01 -0.30 0.00 0.00 0.00 0.00 46.02 45.81 2q67 n GLY 47 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2q67 s LEU 48 N -5.85 4.13 0.46 0.99 1.02 -0.99 -4.99 118.68 113.45 2q67 s LEU 48 Ca 0.27 0.76 -0.23 0.00 0.02 0.00 0.00 54.13 54.95 2q67 s LEU 48 Cb -0.12 -3.55 -0.07 0.00 0.02 0.00 0.00 46.19 42.47 2q67 s LEU 48 CO 0.34 -0.11 1.22 -0.13 0.02 0.00 0.00 176.35 177.69 2q67 s ARG 49 N -3.15 3.72 0.30 1.70 0.52 -1.26 -4.23 118.95 116.56 2q67 s ARG 49 Ca 0.45 1.92 0.06 0.00 -0.52 0.00 0.00 55.73 57.63 2q67 s ARG 49 Cb -0.11 -2.47 0.82 0.00 0.52 0.00 0.00 34.95 33.71 2q67 s ARG 49 CO 0.26 -0.62 1.65 -1.35 0.02 0.00 0.00 175.30 175.26 2q67 h PRO 50 N 2.12 0.25 -0.69 3.54 0.11 -1.94 0.14 132.00 135.53 2q67 h PRO 50 Ca -0.50 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.58 2q67 h PRO 50 Cb 1.25 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 32.28 2q67 h PRO 50 CO 0.60 0.16 0.35 0.97 -0.21 0.00 0.00 178.00 179.87 2q67 h ILE 51 N 0.25 1.22 0.00 4.15 -0.00 -1.96 0.40 117.51 121.57 2q67 h ILE 51 Ca 0.61 -0.59 -0.11 0.00 -0.00 0.00 0.00 64.86 64.77 2q67 h ILE 51 Cb 1.27 0.32 -0.02 0.00 -0.00 0.00 0.00 36.82 38.39 2q67 h ILE 51 CO -0.64 0.25 -0.55 0.44 -0.00 0.00 0.00 178.15 177.66 2q67 h ASP 52 N 0.97 0.00 0.15 2.19 3.32 -1.15 -2.22 116.42 119.68 2q67 h ASP 52 Ca 0.24 0.00 -0.20 0.00 0.02 0.00 0.00 57.03 57.09 2q67 h ASP 52 Cb 0.07 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.62 2q67 h ASP 52 CO -0.03 0.55 -0.76 0.00 -1.72 0.00 0.00 179.24 177.27 2q67 h ALA 53 N 1.45 0.50 -0.29 3.45 0.00 -0.29 -1.62 119.26 122.46 2q67 h ALA 53 Ca -0.01 -0.61 -0.07 0.00 0.00 0.00 0.00 54.91 54.22 2q67 h ALA 53 Cb 1.35 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 2q67 h ALA 53 CO 0.07 0.74 -0.09 1.25 0.00 0.00 0.00 179.25 181.22 2q67 h LEU 54 N 0.35 0.58 0.10 0.00 5.85 -0.91 -1.20 115.31 120.07 2q67 h LEU 54 Ca -0.04 -0.38 0.01 0.00 0.84 0.00 0.00 57.88 58.31 2q67 h LEU 54 Cb 1.35 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 42.21 2q67 h LEU 54 CO 0.14 0.83 -0.13 0.22 -0.34 0.00 0.00 178.44 179.15 2q67 h TYR 55 N 0.33 -0.34 -0.82 1.25 3.20 -1.32 0.11 116.97 119.38 2q67 h TYR 55 Ca 0.07 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 61.94 2q67 h TYR 55 Cb 0.58 0.14 -0.04 0.00 1.54 0.00 0.00 36.73 38.95 2q67 h TYR 55 CO 0.05 -0.20 0.48 0.35 -1.64 0.00 0.00 178.16 177.20 2q67 h PHE 56 N -0.27 1.09 -0.53 -3.82 3.57 -1.28 -0.64 116.94 115.07 2q67 h PHE 56 Ca 0.01 -0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.52 2q67 h PHE 56 Cb 0.27 -0.36 -0.03 0.00 2.79 0.00 0.00 35.95 38.63 2q67 h PHE 56 CO -0.14 0.74 0.34 0.77 -2.23 0.00 0.00 178.31 177.79 2q67 h SER 57 N 1.13 0.57 0.32 0.41 0.02 -0.82 -1.55 113.55 113.63 2q67 h SER 57 Ca 0.29 -0.01 -0.02 0.00 -0.84 0.00 0.00 61.79 61.22 2q67 h SER 57 Cb -0.02 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.40 2q67 h SER 57 CO -0.05 0.41 -0.16 0.58 -1.14 0.00 0.00 176.83 176.47 2q67 h VAL 58 N 0.68 0.67 0.00 2.27 2.07 -0.23 0.23 116.25 121.95 2q67 h VAL 58 Ca 0.20 -0.54 -0.00 0.00 0.82 0.00 0.00 66.70 67.18 2q67 h VAL 58 Cb -0.04 0.94 -0.00 0.00 -1.52 0.00 0.00 31.29 30.68 2q67 h VAL 58 CO -0.07 0.10 -0.01 -0.37 0.02 0.00 0.00 177.57 177.24 2q67 h VAL 59 N -0.75 0.07 0.00 2.57 -1.51 -1.13 -1.96 116.25 113.54 2q67 h VAL 59 Ca -0.04 -0.23 -0.06 0.00 -1.23 0.00 0.00 66.70 65.13 2q67 h VAL 59 Cb 0.50 1.21 -0.01 0.00 -2.13 0.00 0.00 31.29 30.87 2q67 h VAL 59 CO 0.07 0.01 -0.37 0.74 -1.23 0.00 0.00 177.57 176.80 2q67 h THR 60 N 0.00 1.15 0.00 7.19 2.02 -1.17 0.69 112.91 122.79 2q67 h THR 60 Ca -0.00 -1.99 -0.01 0.00 0.77 0.00 0.00 66.41 65.18 2q67 h THR 60 Cb 0.21 2.30 -0.00 0.00 -1.74 0.00 0.00 68.15 68.93 2q67 h THR 60 CO 0.00 0.39 -0.04 0.25 0.37 0.00 0.00 175.52 176.49 2q67 h LEU 61 N -1.00 0.00 -0.90 2.58 5.85 -0.77 -2.44 115.31 118.63 2q67 h LEU 61 Ca -0.09 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.63 2q67 h LEU 61 Cb 0.89 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.92 2q67 h LEU 61 CO -0.06 0.04 -0.37 0.35 -0.34 0.00 0.00 178.44 178.07 2q67 n THR 62 N -3.52 0.00 -0.95 1.05 -2.24 -0.75 -4.66 114.28 103.20 2q67 n THR 62 Ca -0.02 -0.23 0.00 0.00 -2.27 0.00 0.00 64.05 61.52 2q67 n THR 62 Cb 0.15 0.98 0.00 0.00 -2.10 0.00 0.00 70.33 69.36 2q67 n THR 62 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 2q67 n THR 63 N -0.13 0.00 0.09 4.28 -2.24 -0.92 -4.89 114.28 110.47 2q67 n THR 63 Ca 0.11 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.76 2q67 n THR 63 Cb 0.44 -0.26 -0.07 0.00 -2.10 0.00 0.00 70.33 68.33 2q67 n THR 63 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 2q67 h VAL 64 N 0.00 0.84 0.00 2.28 2.07 -1.54 -3.49 116.25 116.42 2q67 h VAL 64 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2q67 h VAL 64 Cb 0.22 0.84 0.00 0.00 -1.52 0.00 0.00 31.29 30.83 2q67 h VAL 64 CO 0.00 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.20 2q67 n GLY 65 N -1.18 0.65 3.80 2.17 0.00 0.23 -5.02 105.19 105.84 2q67 n GLY 65 Ca -0.08 -1.50 -0.39 0.00 0.00 0.00 0.00 46.02 44.05 2q67 n GLY 65 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2q67 s ALA 66 N -1.70 3.55 -0.44 4.61 0.00 -1.26 -4.89 121.76 121.63 2q67 s ALA 66 Ca 0.00 0.09 0.23 0.00 0.00 0.00 0.00 51.96 52.28 2q67 s ALA 66 Cb 0.00 -2.70 0.29 0.00 0.00 0.00 0.00 23.12 20.71 2q67 s ALA 66 CO 0.00 0.35 1.40 0.78 0.00 0.00 0.00 175.76 178.30 2q67 h GLY 67 N 4.64 0.00 0.00 0.00 0.00 -2.01 -3.41 103.07 102.29 2q67 h GLY 67 Ca -0.49 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.84 2q67 h GLY 67 CO 0.65 0.00 -0.25 0.70 0.00 0.00 0.00 176.54 177.63 2q67 n ASN 68 N -2.69 1.26 -4.91 0.19 3.02 -1.26 -5.10 115.26 105.76 2q67 n ASN 68 Ca 0.03 0.00 -0.29 0.00 -0.03 0.00 0.00 54.58 54.29 2q67 n ASN 68 Cb 0.51 0.23 -0.04 0.00 -0.61 0.00 0.00 39.78 39.87 2q67 n ASN 68 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 2q67 s PHE 69 N -0.62 3.46 -0.27 3.10 5.36 -1.26 -5.10 117.98 122.65 2q67 s PHE 69 Ca 0.00 0.17 -0.19 0.00 -0.96 0.00 0.00 56.93 55.95 2q67 s PHE 69 Cb 0.00 -1.70 0.07 0.00 -0.34 0.00 0.00 43.02 41.06 2q67 s PHE 69 CO 0.00 0.55 0.69 0.45 -1.46 0.00 0.00 175.22 175.45 2q67 s SER 70 N -2.82 -0.85 0.19 6.13 0.15 -1.26 -4.75 113.70 110.48 2q67 s SER 70 Ca 0.34 1.47 -0.33 0.00 0.70 0.00 0.00 55.95 58.14 2q67 s SER 70 Cb -0.12 1.40 -0.15 0.00 -1.71 0.00 0.00 66.02 65.44 2q67 s SER 70 CO 0.27 -0.24 1.23 -2.65 1.20 0.00 0.00 173.24 173.06 2q67 n PRO 71 N 3.64 1.38 -0.02 5.44 -0.02 -1.26 -4.93 135.00 139.24 2q67 n PRO 71 Ca -0.18 0.49 -0.07 0.00 -2.02 0.00 0.00 63.50 61.73 2q67 n PRO 71 Cb 0.57 -2.04 -0.13 0.00 -0.02 0.00 0.00 33.50 31.88 2q67 n PRO 71 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2q67 n GLN 72 N 1.87 0.63 -3.49 -0.52 1.13 -1.26 -4.78 117.38 110.96 2q67 n GLN 72 Ca 0.14 0.27 -0.26 0.00 -1.94 0.00 0.00 57.00 55.21 2q67 n GLN 72 Cb 0.26 -1.78 -0.02 0.00 0.11 0.00 0.00 30.24 28.81 2q67 n GLN 72 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 2q67 s THR 73 N -2.65 5.12 0.27 5.09 -4.23 -1.26 -5.01 115.64 112.97 2q67 s THR 73 Ca -0.05 -0.34 0.02 0.00 -1.18 0.00 0.00 61.69 60.14 2q67 s THR 73 Cb 0.08 -3.80 0.05 0.00 1.34 0.00 0.00 72.50 70.18 2q67 s THR 73 CO 0.82 -0.38 1.70 0.44 -0.54 0.00 0.00 174.62 176.66 2q67 h ASP 74 N 1.34 0.50 -0.36 3.99 3.45 -1.99 -1.42 116.42 121.93 2q67 h ASP 74 Ca -0.49 -0.18 -0.05 0.00 0.43 0.00 0.00 57.03 56.74 2q67 h ASP 74 Cb 1.20 -0.14 -0.01 0.00 -0.56 0.00 0.00 39.33 39.82 2q67 h ASP 74 CO 0.64 0.77 0.02 0.15 -1.57 0.00 0.00 179.24 179.26 2q67 h PHE 75 N 0.43 0.68 -0.56 4.55 3.57 -1.98 -1.50 116.94 122.13 2q67 h PHE 75 Ca 0.06 -0.11 0.00 0.00 3.53 0.00 0.00 57.97 61.45 2q67 h PHE 75 Cb 0.72 -0.18 -0.03 0.00 2.79 0.00 0.00 35.95 39.25 2q67 h PHE 75 CO 0.02 0.71 0.35 0.78 -2.23 0.00 0.00 178.31 177.95 2q67 h GLY 76 N 0.45 0.80 0.96 2.40 0.00 -1.85 -0.41 103.07 105.43 2q67 h GLY 76 Ca 0.11 -0.32 -0.02 0.00 0.00 0.00 0.00 47.33 47.09 2q67 h GLY 76 CO 0.01 0.31 0.20 0.50 0.00 0.00 0.00 176.54 177.57 2q67 h LYS 77 N 0.76 0.67 -0.64 4.80 1.57 -1.08 -0.57 116.57 122.08 2q67 h LYS 77 Ca 0.20 -0.11 -0.09 0.00 -1.87 0.00 0.00 60.65 58.78 2q67 h LYS 77 Cb -0.05 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.12 2q67 h LYS 77 CO -0.04 0.59 0.05 0.82 -0.57 0.00 0.00 179.45 180.30 2q67 h ILE 78 N 0.60 1.26 -0.26 1.86 2.04 -1.02 -2.11 117.51 119.88 2q67 h ILE 78 Ca 0.16 -1.11 -0.02 0.00 1.00 0.00 0.00 64.86 64.89 2q67 h ILE 78 Cb 0.16 0.72 -0.01 0.00 -0.74 0.00 0.00 36.82 36.95 2q67 h ILE 78 CO -0.02 0.41 0.10 0.15 0.00 0.00 0.00 178.15 178.79 2q67 h PHE 79 N 1.00 0.40 -0.76 1.37 3.04 -0.85 -2.50 116.94 118.64 2q67 h PHE 79 Ca 0.19 -0.03 0.08 0.00 3.98 0.00 0.00 57.97 62.18 2q67 h PHE 79 Cb 0.51 -0.12 -0.06 0.00 2.56 0.00 0.00 35.95 38.83 2q67 h PHE 79 CO 0.04 0.42 0.43 1.15 -2.02 0.00 0.00 178.31 178.33 2q67 h THR 80 N 0.27 0.94 -0.12 4.41 2.02 -0.92 0.32 112.91 119.83 2q67 h THR 80 Ca 0.09 -0.26 0.01 0.00 0.77 0.00 0.00 66.41 67.02 2q67 h THR 80 Cb 0.20 0.11 -0.01 0.00 -1.74 0.00 0.00 68.15 66.71 2q67 h THR 80 CO -0.01 0.14 0.04 0.40 0.37 0.00 0.00 175.52 176.46 2q67 h ILE 81 N 0.76 0.97 -0.14 3.11 2.04 -1.16 0.50 117.51 123.59 2q67 h ILE 81 Ca 0.35 -0.03 -0.12 0.00 1.00 0.00 0.00 64.86 66.06 2q67 h ILE 81 Cb 0.27 0.86 -0.01 0.00 -0.74 0.00 0.00 36.82 37.20 2q67 h ILE 81 CO -0.21 0.02 -0.43 -0.07 0.00 0.00 0.00 178.15 177.45 2q67 h LEU 82 N 0.09 0.36 -0.64 1.44 -0.00 -0.99 -2.92 115.31 112.65 2q67 h LEU 82 Ca 0.05 -0.16 0.01 0.00 -0.00 0.00 0.00 57.88 57.78 2q67 h LEU 82 Cb 0.03 -0.10 -0.03 0.00 -0.00 0.00 0.00 40.66 40.56 2q67 h LEU 82 CO -0.06 0.75 0.41 0.22 -0.00 0.00 0.00 178.44 179.77 2q67 h TYR 83 N 0.28 0.78 -0.78 1.13 3.20 0.16 -1.65 116.97 120.09 2q67 h TYR 83 Ca 0.02 0.02 0.00 0.00 3.14 0.00 0.00 58.73 61.91 2q67 h TYR 83 Cb 0.88 -0.26 -0.04 0.00 1.54 0.00 0.00 36.73 38.85 2q67 h TYR 83 CO 0.02 0.47 0.49 0.82 -1.64 0.00 0.00 178.16 178.33 2q67 h ILE 84 N 0.83 1.21 0.00 1.81 2.04 -0.73 -1.36 117.51 121.32 2q67 h ILE 84 Ca 0.24 -0.43 -0.07 0.00 1.00 0.00 0.00 64.86 65.60 2q67 h ILE 84 Cb -0.06 0.09 -0.01 0.00 -0.74 0.00 0.00 36.82 36.11 2q67 h ILE 84 CO -0.07 0.21 -0.34 -0.26 0.00 0.00 0.00 178.15 177.70 2q67 h PHE 85 N 1.07 0.00 -0.29 1.37 -1.00 -1.36 -0.09 116.94 116.64 2q67 h PHE 85 Ca 0.28 0.00 -0.06 0.00 2.81 0.00 0.00 57.97 61.00 2q67 h PHE 85 Cb -0.08 0.00 -0.01 0.00 3.61 0.00 0.00 35.95 39.47 2q67 h PHE 85 CO -0.01 0.34 -0.05 0.82 -1.61 0.00 0.00 178.31 177.79 2q67 h ILE 86 N 0.00 1.28 -0.49 -0.55 2.04 -0.65 0.68 117.51 119.82 2q67 h ILE 86 Ca -0.00 -1.06 0.03 0.00 1.00 0.00 0.00 64.86 64.83 2q67 h ILE 86 Cb 0.81 1.38 -0.04 0.00 -0.74 0.00 0.00 36.82 38.23 2q67 h ILE 86 CO 0.04 0.34 0.27 1.23 0.00 0.00 0.00 178.15 180.03 2q67 h GLY 87 N 0.31 0.69 1.02 5.37 0.00 -0.63 0.19 103.07 110.02 2q67 h GLY 87 Ca 0.08 -0.20 -0.04 0.00 0.00 0.00 0.00 47.33 47.17 2q67 h GLY 87 CO 0.02 0.15 0.26 -2.22 0.00 0.00 0.00 176.54 174.75 2q67 h ILE 88 N 0.54 1.24 -0.71 2.60 1.08 -0.85 0.10 117.51 121.51 2q67 h ILE 88 Ca 0.21 -0.77 0.01 0.00 -0.39 0.00 0.00 64.86 63.92 2q67 h ILE 88 Cb 0.07 0.49 -0.04 0.00 -3.07 0.00 0.00 36.82 34.28 2q67 h ILE 88 CO -0.12 0.30 0.47 1.23 -0.69 0.00 0.00 178.15 179.34 2q67 h GLY 89 N 0.95 1.01 0.88 5.37 0.00 -0.08 -0.62 103.07 110.59 2q67 h GLY 89 Ca 0.22 -0.37 -0.03 0.00 0.00 0.00 0.00 47.33 47.15 2q67 h GLY 89 CO -0.02 0.36 0.06 1.41 0.00 0.00 0.00 176.54 178.35 2q67 h LEU 90 N 0.95 0.42 -0.53 3.11 4.07 -0.19 -2.14 115.31 121.00 2q67 h LEU 90 Ca 0.26 -0.25 0.02 0.00 0.08 0.00 0.00 57.88 57.99 2q67 h LEU 90 Cb -0.10 -0.11 -0.03 0.00 1.08 0.00 0.00 40.66 41.50 2q67 h LEU 90 CO -0.06 0.56 0.34 0.58 -1.08 0.00 0.00 178.44 178.77 2q67 h VAL 91 N 0.27 1.10 -0.70 1.22 2.07 -0.67 -0.81 116.25 118.73 2q67 h VAL 91 Ca 0.08 -0.23 0.02 0.00 0.82 0.00 0.00 66.70 67.39 2q67 h VAL 91 Cb 0.31 0.36 -0.04 0.00 -1.52 0.00 0.00 31.29 30.40 2q67 h VAL 91 CO 0.00 0.12 0.46 -0.26 0.02 0.00 0.00 177.57 177.92 2q67 h PHE 92 N 0.68 0.84 -0.10 1.57 0.05 -1.04 0.77 116.94 119.71 2q67 h PHE 92 Ca 0.20 0.02 -0.00 0.00 3.82 0.00 0.00 57.97 62.01 2q67 h PHE 92 Cb -0.03 -0.28 -0.00 0.00 2.00 0.00 0.00 35.95 37.63 2q67 h PHE 92 CO -0.05 0.51 0.05 0.78 -0.18 0.00 0.00 178.31 179.42 2q67 h GLY 93 N 0.89 0.16 0.99 -1.45 0.00 -0.52 0.31 103.07 103.44 2q67 h GLY 93 Ca 0.27 -0.08 -0.02 0.00 0.00 0.00 0.00 47.33 47.50 2q67 h GLY 93 CO -0.07 0.07 0.29 0.74 0.00 0.00 0.00 176.54 177.58 2q67 h PHE 94 N 0.04 0.81 0.02 5.60 0.04 -0.69 -0.88 116.94 121.88 2q67 h PHE 94 Ca 0.03 -0.03 -0.00 0.00 2.80 0.00 0.00 57.97 60.77 2q67 h PHE 94 Cb 0.12 -0.25 0.00 0.00 2.20 0.00 0.00 35.95 38.01 2q67 h PHE 94 CO -0.03 0.61 -0.01 0.82 -0.60 0.00 0.00 178.31 179.10 2q67 h ILE 95 N 0.78 0.99 -0.99 -0.55 2.04 -0.59 0.33 117.51 119.51 2q67 h ILE 95 Ca 0.20 -0.05 0.08 0.00 1.00 0.00 0.00 64.86 66.09 2q67 h ILE 95 Cb 0.09 1.03 -0.07 0.00 -0.74 0.00 0.00 36.82 37.12 2q67 h ILE 95 CO -0.03 0.01 0.63 -0.74 0.00 0.00 0.00 178.15 178.03 2q67 h HIS 96 N -0.05 1.17 -0.62 1.37 2.76 -0.25 -0.74 115.15 118.78 2q67 h HIS 96 Ca -0.00 0.03 -0.03 0.00 -2.20 0.00 0.00 60.37 58.17 2q67 h HIS 96 Cb 0.05 -0.38 -0.03 0.00 1.55 0.00 0.00 27.41 28.60 2q67 h HIS 96 CO -0.07 0.56 0.26 -0.22 -1.30 0.00 0.00 177.93 177.17 2q67 h LYS 97 N 1.11 0.91 0.00 5.26 1.63 -0.49 -1.26 116.57 123.73 2q67 h LYS 97 Ca 0.45 -0.16 -0.02 0.00 -0.85 0.00 0.00 60.65 60.07 2q67 h LYS 97 Cb 0.26 -0.15 -0.00 0.00 -0.60 0.00 0.00 32.23 31.73 2q67 h LYS 97 CO -0.20 0.76 -0.08 -0.07 -3.45 0.00 0.00 179.45 176.41 2q67 h LEU 98 N 0.86 0.00 0.00 5.20 3.38 0.09 -2.11 115.31 122.73 2q67 h LEU 98 Ca 0.21 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.18 2q67 h LEU 98 Cb 0.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.93 2q67 h LEU 98 CO -0.02 0.08 -0.49 0.00 0.09 0.00 0.00 178.44 178.10 2q67 n ALA 99 N -2.15 3.13 -0.01 1.53 0.00 -0.39 -3.18 120.51 119.45 2q67 n ALA 99 Ca 0.00 -0.27 -0.22 0.00 0.00 0.00 0.00 53.44 52.95 2q67 n ALA 99 Cb 0.35 -1.18 -0.14 0.00 0.00 0.00 0.00 19.45 18.47 2q67 n ALA 99 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2q67 h VAL 100 N 0.00 0.76 0.00 0.00 2.07 -0.62 -3.34 116.25 115.12 2q67 h VAL 100 Ca 0.00 -2.34 -0.00 0.00 0.82 0.00 0.00 66.70 65.18 2q67 h VAL 100 Cb 0.61 2.51 -0.00 0.00 -1.52 0.00 0.00 31.29 32.89 2q67 h VAL 100 CO 0.00 0.76 -0.02 0.78 0.02 0.00 0.00 177.57 179.12 2q67 h ASN 101 N -0.17 0.00 -0.27 0.57 4.21 -1.53 -3.26 115.58 115.13 2q67 h ASN 101 Ca -0.39 0.00 -0.37 0.00 1.21 0.00 0.00 56.30 56.75 2q67 h ASN 101 Cb 1.87 0.00 -0.07 0.00 -1.12 0.00 0.00 38.32 39.00 2q67 h ASN 101 CO 0.04 0.02 0.75 0.55 -1.29 0.00 0.00 177.43 177.49 2q67 n VAL 102 N -3.11 3.46 -1.80 2.81 3.14 -1.19 -5.12 118.33 116.52 2q67 n VAL 102 Ca 0.01 -2.17 0.00 0.00 -2.96 0.00 0.00 64.34 59.22 2q67 n VAL 102 Cb 0.32 -2.05 0.00 0.00 -1.06 0.00 0.00 33.84 31.05 2q67 n VAL 102 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37