#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2efn n ASP 2 N 0.00 1.74 -0.11 3.17 5.68 -1.26 -5.00 116.55 120.77 2efn n ASP 2 Ca 0.00 -1.61 0.01 0.00 -0.50 0.00 0.00 54.79 52.69 2efn n ASP 2 Cb 0.00 0.02 0.31 0.00 -1.14 0.00 0.00 41.12 40.31 2efn n ASP 2 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 2efn h GLU 3 N 0.00 0.78 -0.58 0.11 4.11 -2.06 -2.28 114.58 114.66 2efn h GLU 3 Ca -0.11 -0.06 -0.06 0.00 0.07 0.00 0.00 59.36 59.19 2efn h GLU 3 Cb 0.40 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 2efn h GLU 3 CO 0.18 0.54 0.12 0.82 0.07 0.00 0.00 179.01 180.75 2efn h ILE 4 N 0.80 1.25 -0.83 -1.06 2.04 -1.99 -1.56 117.51 116.16 2efn h ILE 4 Ca 0.21 -0.93 -0.00 0.00 1.00 0.00 0.00 64.86 65.14 2efn h ILE 4 Cb -0.04 0.75 -0.04 0.00 -0.74 0.00 0.00 36.82 36.75 2efn h ILE 4 CO -0.04 0.34 0.51 0.44 0.00 0.00 0.00 178.15 179.41 2efn h ASP 5 N 0.84 0.98 -0.89 1.72 3.32 -1.82 -1.54 116.42 119.03 2efn h ASP 5 Ca 0.18 -0.05 -0.01 0.00 0.02 0.00 0.00 57.03 57.17 2efn h ASP 5 Cb 0.38 -0.25 -0.04 0.00 0.22 0.00 0.00 39.33 39.64 2efn h ASP 5 CO 0.01 0.74 0.52 -0.07 -1.72 0.00 0.00 179.24 178.71 2efn h LEU 6 N 1.13 1.08 -0.76 1.55 3.38 -1.01 0.90 115.31 121.58 2efn h LEU 6 Ca 0.30 -0.08 -0.09 0.00 0.09 0.00 0.00 57.88 58.10 2efn h LEU 6 Cb -0.07 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.39 2efn h LEU 6 CO -0.06 0.84 -0.06 0.03 0.09 0.00 0.00 178.44 179.29 2efn h ARG 7 N 1.22 0.88 -0.19 1.13 3.08 -0.81 0.89 114.38 120.58 2efn h ARG 7 Ca 0.32 -0.28 -0.02 0.00 0.07 0.00 0.00 59.98 60.06 2efn h ARG 7 Cb -0.02 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 29.94 2efn h ARG 7 CO -0.06 0.91 0.02 0.82 -1.07 0.00 0.00 179.97 180.60 2efn h ILE 8 N 0.80 1.23 -0.50 2.04 2.04 -0.62 -2.85 117.51 119.65 2efn h ILE 8 Ca 0.14 -0.76 -0.05 0.00 1.00 0.00 0.00 64.86 65.18 2efn h ILE 8 Cb 0.56 1.36 -0.02 0.00 -0.74 0.00 0.00 36.82 37.98 2efn h ILE 8 CO 0.03 0.23 0.09 -0.07 0.00 0.00 0.00 178.15 178.44 2efn h LEU 9 N 0.11 0.73 -2.03 1.44 3.38 -0.66 -1.07 115.31 117.21 2efn h LEU 9 Ca 0.06 -0.14 0.03 0.00 0.09 0.00 0.00 57.88 57.92 2efn h LEU 9 Cb 0.33 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.88 2efn h LEU 9 CO 0.01 0.74 0.07 0.50 0.09 0.00 0.00 178.44 179.85 2efn h LYS 10 N 0.75 0.00 0.02 1.13 3.64 -0.61 -0.57 116.57 120.92 2efn h LYS 10 Ca 0.16 0.00 -0.12 0.00 -1.27 0.00 0.00 60.65 59.42 2efn h LYS 10 Cb 0.33 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.13 2efn h LYS 10 CO 0.00 0.00 -0.62 0.82 -2.27 0.00 0.00 179.45 177.38 2efn h ILE 11 N 0.00 1.40 0.00 2.00 2.04 -1.14 -3.36 117.51 118.44 2efn h ILE 11 Ca 0.04 -2.30 -0.01 0.00 1.00 0.00 0.00 64.86 63.59 2efn h ILE 11 Cb 0.18 2.91 -0.00 0.00 -0.74 0.00 0.00 36.82 39.17 2efn h ILE 11 CO -0.00 0.52 -0.04 -0.07 0.00 0.00 0.00 178.15 178.56 2efn h LEU 12 N -0.90 0.00 -1.47 1.44 3.38 -0.90 -1.12 115.31 115.73 2efn h LEU 12 Ca -0.16 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.76 2efn h LEU 12 Cb 1.22 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.96 2efn h LEU 12 CO -0.06 0.04 -0.23 0.06 0.09 0.00 0.00 178.44 178.33 2efn h GLN 13 N 0.00 0.00 0.02 1.13 3.07 -1.26 -3.28 115.11 114.79 2efn h GLN 13 Ca -0.00 0.00 -0.39 0.00 0.09 0.00 0.00 58.65 58.35 2efn h GLN 13 Cb 0.10 0.00 -0.06 0.00 0.08 0.00 0.00 27.48 27.60 2efn h GLN 13 CO 0.01 0.23 -2.35 0.66 0.09 0.00 0.00 178.83 177.47 2efn n TYR 14 N -3.69 0.28 -3.43 0.06 4.02 -0.61 -4.66 117.16 109.13 2efn n TYR 14 Ca -0.01 0.07 -0.17 0.00 -0.01 0.00 0.00 57.90 57.78 2efn n TYR 14 Cb 0.35 -1.04 -0.11 0.00 -0.02 0.00 0.00 39.34 38.53 2efn n TYR 14 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 176.86 177.06 2efn s ASN 15 N -6.79 1.45 0.00 7.72 3.84 -0.52 -4.99 114.94 115.64 2efn s ASN 15 Ca -0.33 -0.48 0.29 0.00 0.21 0.00 0.00 52.86 52.55 2efn s ASN 15 Cb 0.09 0.53 1.29 0.00 -0.55 0.00 0.00 41.25 42.61 2efn s ASN 15 CO 0.61 -0.36 1.91 0.00 -2.79 0.00 0.00 177.10 176.47 2efn n ALA 16 N 5.32 2.70 0.01 1.71 0.00 -1.24 -3.74 120.51 125.27 2efn n ALA 16 Ca -0.03 -0.23 0.09 0.00 0.00 0.00 0.00 53.44 53.26 2efn n ALA 16 Cb 0.48 -1.37 0.27 0.00 0.00 0.00 0.00 19.45 18.83 2efn n ALA 16 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2efn n LYS 17 N -1.06 2.67 -2.43 0.00 4.76 -1.26 -4.91 118.16 115.93 2efn n LYS 17 Ca 0.14 -2.19 -0.42 0.00 -2.87 0.00 0.00 58.31 52.97 2efn n LYS 17 Cb 0.27 -1.57 -0.03 0.00 -1.84 0.00 0.00 35.03 31.86 2efn n LYS 17 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 2efn s TYR 18 N -1.42 3.28 0.86 2.13 2.02 -1.24 -4.99 117.35 118.00 2efn s TYR 18 Ca 0.40 1.23 -0.12 0.00 -0.37 0.00 0.00 57.07 58.21 2efn s TYR 18 Cb 0.23 -3.43 0.08 0.00 -0.40 0.00 0.00 41.96 38.44 2efn s TYR 18 CO 0.24 -1.36 0.97 -1.13 -1.57 0.00 0.00 175.55 172.71 2efn n SER 19 N 4.63 0.01 -0.29 2.29 3.41 -1.26 -4.81 113.62 117.60 2efn n SER 19 Ca 0.10 0.49 -0.04 0.00 -0.26 0.00 0.00 58.87 59.16 2efn n SER 19 Cb 0.46 -1.41 0.07 0.00 -0.26 0.00 0.00 64.21 63.07 2efn n SER 19 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 2efn h LEU 20 N -1.28 0.92 -0.26 1.04 -0.00 -1.98 -2.67 115.31 111.08 2efn h LEU 20 Ca -0.45 -0.04 0.06 0.00 -0.00 0.00 0.00 57.88 57.45 2efn h LEU 20 Cb 1.29 -0.23 -0.05 0.00 -0.00 0.00 0.00 40.66 41.67 2efn h LEU 20 CO 0.42 0.68 -0.09 0.44 -0.00 0.00 0.00 178.44 179.89 2efn h ASP 21 N 1.07 -0.32 -0.12 -0.43 5.19 -1.96 0.40 116.42 120.26 2efn h ASP 21 Ca 0.29 0.09 0.02 0.00 -0.62 0.00 0.00 57.03 56.81 2efn h ASP 21 Cb -0.10 0.19 -0.02 0.00 0.18 0.00 0.00 39.33 39.58 2efn h ASP 21 CO -0.06 -0.12 -0.04 -0.33 -3.12 0.00 0.00 179.24 175.57 2efn h GLU 22 N -0.04 -0.01 -0.56 3.56 5.08 -1.86 -0.91 114.58 119.83 2efn h GLU 22 Ca 0.13 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.44 2efn h GLU 22 Cb 0.24 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 2efn h GLU 22 CO -0.29 -0.01 0.15 0.82 -1.00 0.00 0.00 179.01 178.68 2efn h ILE 23 N -0.01 1.24 -0.98 3.13 2.04 -1.14 -1.57 117.51 120.22 2efn h ILE 23 Ca 0.06 -0.86 0.08 0.00 1.00 0.00 0.00 64.86 65.15 2efn h ILE 23 Cb 0.10 0.73 -0.07 0.00 -0.74 0.00 0.00 36.82 36.84 2efn h ILE 23 CO -0.13 0.32 0.63 0.00 0.00 0.00 0.00 178.15 178.96 2efn h ALA 24 N 1.03 1.40 -0.21 1.87 0.00 0.17 -1.45 119.26 122.07 2efn h ALA 24 Ca 0.18 -0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.98 2efn h ALA 24 Cb 0.32 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 2efn h ALA 24 CO -0.00 0.34 -0.29 0.00 0.00 0.00 0.00 179.25 179.31 2efn h ARG 25 N 1.08 0.56 -0.24 0.00 3.08 -0.86 -0.68 114.38 117.33 2efn h ARG 25 Ca 0.45 -0.33 -0.00 0.00 0.07 0.00 0.00 59.98 60.17 2efn h ARG 25 Cb 0.28 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 30.34 2efn h ARG 25 CO -0.21 0.93 0.15 1.49 -1.07 0.00 0.00 179.97 181.26 2efn h GLU 26 N 0.24 0.32 -0.00 0.04 4.81 -0.70 -3.01 114.58 116.28 2efn h GLU 26 Ca 0.02 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2efn h GLU 26 Cb 0.86 -0.07 0.00 0.00 0.63 0.00 0.00 28.75 30.17 2efn h GLU 26 CO 0.07 0.24 -0.37 0.44 -0.73 0.00 0.00 179.01 178.66 2efn n ILE 27 N -4.90 0.00 -2.73 2.32 -6.64 -0.60 -5.00 119.36 101.80 2efn n ILE 27 Ca -0.03 -0.01 -0.09 0.00 -1.77 0.00 0.00 62.75 60.85 2efn n ILE 27 Cb 0.04 0.11 0.04 0.00 -1.44 0.00 0.00 39.64 38.39 2efn n ILE 27 CO 0.00 0.00 0.00 0.54 -1.77 0.00 0.00 176.55 175.32 2efn n ARG 28 N -1.40 -1.49 -3.73 6.28 3.00 -0.31 -5.07 116.66 113.94 2efn n ARG 28 Ca 0.07 0.74 -0.11 0.00 -0.01 0.00 0.00 57.85 58.54 2efn n ARG 28 Cb 0.33 -4.61 -0.07 0.00 0.00 0.00 0.00 32.46 28.11 2efn n ARG 28 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.63 178.59 2efn s ILE 29 N -3.23 0.08 0.32 0.55 -4.36 -0.91 -5.06 121.20 108.60 2efn s ILE 29 Ca 0.27 -0.66 -0.29 0.00 -0.26 0.00 0.00 60.65 59.71 2efn s ILE 29 Cb -0.03 -1.01 -0.12 0.00 1.25 0.00 0.00 42.46 42.54 2efn s ILE 29 CO 0.53 -0.36 1.36 -2.65 0.24 0.00 0.00 174.94 174.06 2efn n PRO 30 N 0.40 2.20 -0.25 0.37 -0.02 -1.26 -4.66 135.00 131.78 2efn n PRO 30 Ca -0.18 0.77 0.01 0.00 -2.02 0.00 0.00 63.50 62.09 2efn n PRO 30 Cb 0.60 -2.40 0.13 0.00 -0.02 0.00 0.00 33.50 31.81 2efn n PRO 30 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 2efn h LYS 31 N 3.13 0.61 -0.53 -0.52 3.64 -1.92 -0.13 116.57 120.86 2efn h LYS 31 Ca -0.46 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 58.87 2efn h LYS 31 Cb 1.27 -0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 32.93 2efn h LYS 31 CO 0.67 0.41 0.27 0.00 -2.27 0.00 0.00 179.45 178.52 2efn h ALA 32 N 1.42 1.48 -0.20 5.00 0.00 -1.99 -0.34 119.26 124.63 2efn h ALA 32 Ca 0.34 -0.10 -0.15 0.00 0.00 0.00 0.00 54.91 55.01 2efn h ALA 32 Cb 0.33 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2efn h ALA 32 CO -0.25 0.42 -0.50 1.15 0.00 0.00 0.00 179.25 180.07 2efn h THR 33 N 0.73 1.32 0.16 0.00 2.02 -1.48 -1.49 112.91 114.17 2efn h THR 33 Ca 0.19 -1.73 -0.01 0.00 0.77 0.00 0.00 66.41 65.63 2efn h THR 33 Cb 0.06 1.71 0.00 0.00 -1.74 0.00 0.00 68.15 68.17 2efn h THR 33 CO -0.03 0.54 -0.08 0.25 0.37 0.00 0.00 175.52 176.57 2efn h LEU 34 N 0.43 -0.19 -0.67 2.58 5.85 -0.32 -0.95 115.31 122.05 2efn h LEU 34 Ca 0.02 -0.18 0.10 0.00 0.84 0.00 0.00 57.88 58.65 2efn h LEU 34 Cb 1.03 0.05 -0.07 0.00 0.37 0.00 0.00 40.66 42.03 2efn h LEU 34 CO 0.09 0.08 0.30 -1.28 -0.34 0.00 0.00 178.44 177.29 2efn h SER 35 N -0.46 0.35 0.06 1.25 0.87 -1.04 -0.31 113.55 114.28 2efn h SER 35 Ca -0.02 0.07 -0.00 0.00 -1.23 0.00 0.00 61.79 60.60 2efn h SER 35 Cb 0.36 0.02 0.00 0.00 -0.44 0.00 0.00 62.40 62.34 2efn h SER 35 CO 0.04 0.20 -0.03 0.22 -0.53 0.00 0.00 176.83 176.73 2efn h TYR 36 N 0.51 -0.08 -0.95 2.24 3.20 -1.13 -0.83 116.97 119.94 2efn h TYR 36 Ca 0.33 -0.00 0.05 0.00 3.14 0.00 0.00 58.73 62.25 2efn h TYR 36 Cb 0.38 0.03 -0.06 0.00 1.54 0.00 0.00 36.73 38.62 2efn h TYR 36 CO -0.13 -0.04 0.61 0.00 -1.64 0.00 0.00 178.16 176.96 2efn h ARG 37 N -0.09 1.11 -0.24 1.82 3.08 -0.48 0.15 114.38 119.72 2efn h ARG 37 Ca -0.01 -0.07 -0.04 0.00 0.07 0.00 0.00 59.98 59.94 2efn h ARG 37 Cb 0.07 -0.25 -0.01 0.00 0.08 0.00 0.00 29.97 29.87 2efn h ARG 37 CO 0.01 0.73 0.01 0.82 -1.07 0.00 0.00 179.97 180.48 2efn h ILE 38 N 1.14 1.25 -0.61 2.04 2.04 -0.84 -1.13 117.51 121.40 2efn h ILE 38 Ca 0.40 -0.86 0.00 0.00 1.00 0.00 0.00 64.86 65.40 2efn h ILE 38 Cb 0.09 1.34 -0.03 0.00 -0.74 0.00 0.00 36.82 37.48 2efn h ILE 38 CO -0.15 0.27 0.39 0.11 0.00 0.00 0.00 178.15 178.76 2efn h LYS 39 N 0.20 0.81 -0.35 2.37 1.57 -0.68 -1.73 116.57 118.76 2efn h LYS 39 Ca 0.07 -0.06 -0.14 0.00 -1.87 0.00 0.00 60.65 58.65 2efn h LYS 39 Cb 0.38 -0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.51 2efn h LYS 39 CO 0.01 0.55 -0.35 -0.22 -0.57 0.00 0.00 179.45 178.87 2efn h LYS 40 N 0.83 0.81 -0.52 3.15 3.64 -0.67 -1.76 116.57 122.06 2efn h LYS 40 Ca 0.22 -0.40 -0.07 0.00 -1.27 0.00 0.00 60.65 59.13 2efn h LYS 40 Cb -0.07 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.73 2efn h LYS 40 CO -0.04 1.04 0.04 -0.07 -2.27 0.00 0.00 179.45 178.14 2efn h LEU 41 N 0.68 0.80 -0.30 5.20 3.38 -0.53 0.08 115.31 124.61 2efn h LEU 41 Ca 0.06 -0.18 -0.10 0.00 0.09 0.00 0.00 57.88 57.76 2efn h LEU 41 Cb 0.91 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.44 2efn h LEU 41 CO 0.08 0.84 -0.20 -0.33 0.09 0.00 0.00 178.44 178.93 2efn h GLU 42 N 0.79 0.67 -0.24 1.13 5.08 -1.21 0.14 114.58 120.94 2efn h GLU 42 Ca 0.16 -0.31 -0.07 0.00 -1.00 0.00 0.00 59.36 58.13 2efn h GLU 42 Cb 0.41 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.64 2efn h GLU 42 CO 0.01 0.91 -0.18 0.87 -1.00 0.00 0.00 179.01 179.63 2efn h LYS 43 N 0.42 0.41 -0.10 2.33 1.79 -1.05 -2.53 116.57 117.85 2efn h LYS 43 Ca 0.06 -0.13 0.00 0.00 -2.18 0.00 0.00 60.65 58.41 2efn h LYS 43 Cb 0.74 -0.04 0.00 0.00 -1.58 0.00 0.00 32.23 31.35 2efn h LYS 43 CO 0.05 0.58 0.00 -0.25 -1.08 0.00 0.00 179.45 178.75 2efn n ASP 44 N -4.19 0.73 0.00 0.86 8.00 -0.01 -4.89 116.55 117.06 2efn n ASP 44 Ca -0.00 -1.70 0.00 0.00 0.71 0.00 0.00 54.79 53.80 2efn n ASP 44 Cb 0.34 -0.06 0.00 0.00 -0.02 0.00 0.00 41.12 41.38 2efn n ASP 44 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2efn n GLY 45 N 0.87 0.49 0.09 0.44 0.00 -0.95 -4.92 105.19 101.20 2efn n GLY 45 Ca 0.12 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.02 2efn n GLY 45 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2efn h VAL 46 N 0.00 1.22 -3.57 1.61 2.07 -1.20 -3.39 116.25 112.98 2efn h VAL 46 Ca 0.00 -1.47 -0.67 0.00 0.82 0.00 0.00 66.70 65.38 2efn h VAL 46 Cb 0.10 2.11 -0.16 0.00 -1.52 0.00 0.00 31.29 31.82 2efn h VAL 46 CO 0.00 0.34 -0.00 -0.63 0.02 0.00 0.00 177.57 177.30 2efn s ILE 47 N -3.22 4.93 -0.03 4.57 1.01 -0.91 -4.92 121.20 122.63 2efn s ILE 47 Ca -0.15 -0.04 0.13 0.00 0.00 0.00 0.00 60.65 60.59 2efn s ILE 47 Cb -0.00 -4.13 -0.01 0.00 0.01 0.00 0.00 42.46 38.33 2efn s ILE 47 CO 0.57 -0.51 1.44 0.11 0.00 0.00 0.00 174.94 176.54 2efn h LYS 48 N 8.80 0.00 0.00 2.79 1.79 -1.89 -3.39 116.57 124.67 2efn h LYS 48 Ca -0.26 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.21 2efn h LYS 48 Cb 1.10 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.75 2efn h LYS 48 CO 0.85 0.63 0.00 0.41 -1.08 0.00 0.00 179.45 180.26 2efn n GLY 49 N 1.12 -1.72 3.07 3.86 0.00 -1.26 -5.14 105.19 105.12 2efn n GLY 49 Ca 0.01 -1.12 -0.25 0.00 0.00 0.00 0.00 46.02 44.66 2efn n GLY 49 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2efn s TYR 50 N -2.54 1.50 0.18 1.61 1.51 -1.26 -5.14 117.35 113.20 2efn s TYR 50 Ca 0.00 -0.47 0.08 0.00 -1.01 0.00 0.00 57.07 55.67 2efn s TYR 50 Cb 0.00 -1.05 -0.04 0.00 -0.11 0.00 0.00 41.96 40.76 2efn s TYR 50 CO 0.00 -0.20 -0.16 0.71 -1.11 0.00 0.00 175.55 174.79 2efn s TYR 51 N 0.30 1.74 -0.01 2.71 4.12 -1.26 -5.13 117.35 119.81 2efn s TYR 51 Ca -0.08 -0.51 -0.15 0.00 0.02 0.00 0.00 57.07 56.34 2efn s TYR 51 Cb -0.13 -0.85 -0.06 0.00 -1.52 0.00 0.00 41.96 39.41 2efn s TYR 51 CO 0.03 0.32 0.42 0.00 0.02 0.00 0.00 175.55 176.34 2efn s ALA 52 N -2.39 3.67 -0.38 3.71 0.00 -1.26 -5.01 121.76 120.09 2efn s ALA 52 Ca 0.17 -0.21 -0.19 0.00 0.00 0.00 0.00 51.96 51.73 2efn s ALA 52 Cb -0.04 -2.42 0.01 0.00 0.00 0.00 0.00 23.12 20.67 2efn s ALA 52 CO 0.06 0.42 0.56 -0.47 0.00 0.00 0.00 175.76 176.34 2efn s TYR 53 N -0.86 3.14 -0.16 0.00 5.04 -1.26 -5.04 117.35 118.21 2efn s TYR 53 Ca 0.24 0.09 -0.08 0.00 -2.44 0.00 0.00 57.07 54.88 2efn s TYR 53 Cb -0.17 -3.08 -0.04 0.00 0.35 0.00 0.00 41.96 39.02 2efn s TYR 53 CO 0.13 -0.67 0.11 0.42 -1.34 0.00 0.00 175.55 174.20 2efn s ILE 54 N 2.54 5.19 -0.32 3.14 1.01 -1.26 -5.05 121.20 126.45 2efn s ILE 54 Ca 0.20 0.10 -0.29 0.00 0.00 0.00 0.00 60.65 60.67 2efn s ILE 54 Cb -0.15 -3.32 -0.01 0.00 0.01 0.00 0.00 42.46 38.99 2efn s ILE 54 CO 0.15 0.51 1.57 0.21 0.00 0.00 0.00 174.94 177.39 2efn s ASN 55 N -0.16 6.25 0.41 3.58 2.47 -1.26 -4.89 114.94 121.33 2efn s ASN 55 Ca 0.09 1.23 0.18 0.00 0.42 0.00 0.00 52.86 54.78 2efn s ASN 55 Cb -0.12 -2.53 1.10 0.00 -1.45 0.00 0.00 41.25 38.25 2efn s ASN 55 CO 0.01 -1.43 1.81 -0.65 -3.72 0.00 0.00 177.10 173.11 2efn h PRO 56 N 11.23 0.39 -0.49 0.43 0.11 -1.96 0.48 132.00 142.19 2efn h PRO 56 Ca -0.31 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 65.72 2efn h PRO 56 Cb 1.14 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.14 2efn h PRO 56 CO 1.04 0.26 0.08 0.00 -0.21 0.00 0.00 178.00 179.17 2efn h ALA 57 N 1.61 1.23 -0.00 -0.75 0.00 -1.90 -0.94 119.26 118.50 2efn h ALA 57 Ca 0.54 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.24 2efn h ALA 57 Cb 1.38 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.97 2efn h ALA 57 CO -0.24 0.52 0.01 0.77 0.00 0.00 0.00 179.25 180.31 2efn h SER 58 N 0.73 0.00 -0.52 0.00 0.02 -1.29 0.36 113.55 112.85 2efn h SER 58 Ca 0.16 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.11 2efn h SER 58 Cb 0.33 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.87 2efn h SER 58 CO 0.00 0.00 0.00 0.18 -1.14 0.00 0.00 176.83 175.87 2efn n LEU 59 N -3.46 3.90 -2.34 5.07 4.77 -0.62 -4.95 117.00 119.37 2efn n LEU 59 Ca -0.03 -2.29 -0.20 0.00 -0.03 0.00 0.00 56.01 53.46 2efn n LEU 59 Cb 0.08 -0.44 -0.02 0.00 -2.33 0.00 0.00 43.42 40.71 2efn n LEU 59 CO 0.24 0.80 -0.26 0.59 -1.33 0.00 0.00 177.39 177.43 2efn n ASN 60 N 0.81 -5.77 -4.57 -1.43 5.03 0.12 -4.88 115.26 104.57 2efn n ASN 60 Ca 0.20 0.03 -0.42 0.00 0.87 0.00 0.00 54.58 55.27 2efn n ASN 60 Cb 0.69 -4.83 -0.01 0.00 -1.02 0.00 0.00 39.78 34.60 2efn n ASN 60 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 2efn s LEU 61 N -5.92 3.75 0.05 3.41 1.43 -0.46 -4.11 118.68 116.83 2efn s LEU 61 Ca 0.00 -2.08 0.22 0.00 -1.03 0.00 0.00 54.13 51.24 2efn s LEU 61 Cb 0.00 -2.57 -0.16 0.00 0.03 0.00 0.00 46.19 43.49 2efn s LEU 61 CO 0.00 -1.29 0.77 -0.67 0.23 0.00 0.00 176.35 175.39 2efn n ASP 62 N 8.51 0.41 -4.23 2.29 4.64 -0.86 -4.57 116.55 122.74 2efn n ASP 62 Ca 0.42 -0.03 -0.42 0.00 -1.38 0.00 0.00 54.79 53.38 2efn n ASP 62 Cb 0.48 1.28 -0.07 0.00 -1.04 0.00 0.00 41.12 41.78 2efn n ASP 62 CO 0.00 0.00 0.00 -0.47 -0.82 0.00 0.00 177.20 175.91 2efn s TYR 63 N -3.38 3.50 -0.19 -0.67 5.04 0.79 -4.98 117.35 117.47 2efn s TYR 63 Ca -0.03 -2.05 -0.08 0.00 -2.44 0.00 0.00 57.07 52.48 2efn s TYR 63 Cb 0.13 -3.55 -0.04 0.00 0.35 0.00 0.00 41.96 38.85 2efn s TYR 63 CO 0.85 -0.96 0.07 0.42 -1.34 0.00 0.00 175.55 174.59 2efn s ILE 64 N 0.70 4.85 0.05 3.14 -1.09 -1.26 -0.44 121.20 127.15 2efn s ILE 64 Ca 0.12 -0.01 0.02 0.00 -2.23 0.00 0.00 60.65 58.55 2efn s ILE 64 Cb -0.21 -3.19 -0.03 0.00 -1.58 0.00 0.00 42.46 37.46 2efn s ILE 64 CO -0.03 0.46 -0.08 0.68 -1.23 0.00 0.00 174.94 174.74 2efn s VAL 65 N 0.40 0.57 -0.16 2.92 -7.23 -0.84 -0.84 120.40 115.22 2efn s VAL 65 Ca 0.04 -1.23 -0.00 0.00 -1.81 0.00 0.00 61.98 58.97 2efn s VAL 65 Cb -0.12 -0.80 0.04 0.00 0.56 0.00 0.00 36.38 36.05 2efn s VAL 65 CO 0.00 -0.47 -0.06 -0.63 -0.31 0.00 0.00 175.10 173.63 2efn s ILE 66 N -1.78 1.13 -0.06 -0.62 1.01 -0.59 -1.63 121.20 118.66 2efn s ILE 66 Ca -0.06 -0.59 0.06 0.00 0.00 0.00 0.00 60.65 60.06 2efn s ILE 66 Cb -0.07 -1.27 -0.01 0.00 0.01 0.00 0.00 42.46 41.12 2efn s ILE 66 CO -0.01 0.18 -0.24 -0.89 0.00 0.00 0.00 174.94 173.98 2efn s THR 67 N 1.63 2.14 -0.16 2.92 2.01 0.09 -0.04 115.64 124.23 2efn s THR 67 Ca 0.01 -1.03 -0.15 0.00 0.31 0.00 0.00 61.69 60.83 2efn s THR 67 Cb -0.15 -1.78 -0.04 0.00 0.01 0.00 0.00 72.50 70.54 2efn s THR 67 CO -0.08 0.57 0.34 -0.44 -0.69 0.00 0.00 174.62 174.32 2efn s SER 68 N -0.13 6.47 -0.13 3.53 0.01 0.34 -0.13 113.70 123.65 2efn s SER 68 Ca -0.04 0.55 0.00 0.00 1.31 0.00 0.00 55.95 57.77 2efn s SER 68 Cb -0.14 -2.21 0.02 0.00 0.21 0.00 0.00 66.02 63.90 2efn s SER 68 CO 0.04 0.05 -0.12 -0.69 0.41 0.00 0.00 173.24 172.92 2efn s VAL 69 N 0.68 1.39 -0.07 3.43 1.01 0.18 -1.04 120.40 125.98 2efn s VAL 69 Ca 0.18 -0.53 -0.11 0.00 0.00 0.00 0.00 61.98 61.52 2efn s VAL 69 Cb -0.14 -1.32 -0.05 0.00 0.00 0.00 0.00 36.38 34.87 2efn s VAL 69 CO 0.06 0.43 0.26 -0.54 0.00 0.00 0.00 175.10 175.31 2efn s LYS 70 N 1.43 3.69 0.14 2.72 1.02 -0.01 -1.54 119.74 127.19 2efn s LYS 70 Ca 0.02 0.11 0.05 0.00 0.02 0.00 0.00 55.97 56.18 2efn s LYS 70 Cb -0.13 -3.22 -0.04 0.00 -0.52 0.00 0.00 37.83 33.92 2efn s LYS 70 CO -0.08 0.71 0.07 0.00 -0.92 0.00 0.00 175.35 175.13 2efn s ALA 71 N -0.97 3.44 0.50 5.17 0.00 -1.26 -0.45 121.76 128.19 2efn s ALA 71 Ca 0.19 -1.19 -0.21 0.00 0.00 0.00 0.00 51.96 50.75 2efn s ALA 71 Cb -0.14 -1.27 -0.07 0.00 0.00 0.00 0.00 23.12 21.64 2efn s ALA 71 CO 0.08 0.58 1.09 0.21 0.00 0.00 0.00 175.76 177.72 2efn s LYS 72 N -2.79 3.65 0.40 0.00 2.20 -0.19 -4.74 119.74 118.27 2efn s LYS 72 Ca 0.29 1.51 -0.05 0.00 -0.36 0.00 0.00 55.97 57.36 2efn s LYS 72 Cb -0.11 -2.13 -0.05 0.00 -1.51 0.00 0.00 37.83 34.04 2efn s LYS 72 CO 0.21 -0.58 0.69 0.71 -0.36 0.00 0.00 175.35 176.02 2efn s TYR 73 N -1.83 3.51 0.00 4.03 1.51 -1.26 -4.30 117.35 119.01 2efn s TYR 73 Ca 0.68 0.74 0.00 0.00 -1.01 0.00 0.00 57.07 57.49 2efn s TYR 73 Cb -0.21 -2.22 0.00 0.00 -0.11 0.00 0.00 41.96 39.43 2efn s TYR 73 CO 0.25 -0.07 0.00 0.41 -1.11 0.00 0.00 175.55 175.03 2efn n GLY 74 N -1.66 2.15 7.00 0.71 0.00 -1.26 -4.96 105.19 107.17 2efn n GLY 74 Ca -0.00 -1.99 0.00 0.00 0.00 0.00 0.00 46.02 44.03 2efn n GLY 74 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2efn n LYS 75 N 1.03 0.00 -0.92 1.61 5.02 -1.26 -2.48 118.16 121.16 2efn n LYS 75 Ca 0.00 0.00 0.05 0.00 -2.02 0.00 0.00 58.31 56.34 2efn n LYS 75 Cb 0.00 0.00 0.13 0.00 -0.02 0.00 0.00 35.03 35.14 2efn n LYS 75 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2efn n ASN 76 N 2.45 1.42 -0.15 4.39 4.05 -1.26 -4.88 115.26 121.27 2efn n ASN 76 Ca 0.00 -3.09 -0.03 0.00 0.45 0.00 0.00 54.58 51.91 2efn n ASN 76 Cb 0.00 -0.43 0.06 0.00 1.23 0.00 0.00 39.78 40.64 2efn n ASN 76 CO 0.00 0.00 0.00 1.88 -3.05 0.00 0.00 177.26 176.09 2efn h TYR 77 N 0.93 0.07 0.53 1.20 0.99 -1.76 -2.06 116.97 116.88 2efn h TYR 77 Ca -0.09 0.03 -0.02 0.00 2.00 0.00 0.00 58.73 60.65 2efn h TYR 77 Cb 1.36 0.04 -0.01 0.00 1.00 0.00 0.00 36.73 39.11 2efn h TYR 77 CO 0.49 -0.05 -0.40 0.45 -0.00 0.00 0.00 178.16 178.65 2efn h HIS 78 N 0.18 -1.10 -0.80 4.88 3.86 -1.81 0.51 115.15 120.87 2efn h HIS 78 Ca 0.24 -0.00 0.09 0.00 -1.16 0.00 0.00 60.37 59.54 2efn h HIS 78 Cb 0.33 0.41 -0.07 0.00 1.06 0.00 0.00 27.41 29.14 2efn h HIS 78 CO -0.26 -0.57 0.45 0.28 0.86 0.00 0.00 177.93 178.69 2efn h VAL 79 N -0.90 0.90 -0.38 2.45 2.07 -1.95 -2.02 116.25 116.42 2efn h VAL 79 Ca -0.07 -0.26 -0.01 0.00 0.82 0.00 0.00 66.70 67.18 2efn h VAL 79 Cb 0.75 0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 30.58 2efn h VAL 79 CO 0.02 0.14 0.20 -0.33 0.02 0.00 0.00 177.57 177.62 2efn h GLU 80 N 0.76 0.53 -0.77 1.57 5.08 -1.25 -2.79 114.58 117.71 2efn h GLU 80 Ca 0.38 -0.07 0.02 0.00 -1.00 0.00 0.00 59.36 58.70 2efn h GLU 80 Cb 0.35 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.46 2efn h GLU 80 CO -0.25 0.44 0.50 1.25 -1.00 0.00 0.00 179.01 179.96 2efn h LEU 81 N 0.48 0.85 -0.82 1.33 5.85 -0.31 -2.00 115.31 120.68 2efn h LEU 81 Ca 0.13 -0.01 0.10 0.00 0.84 0.00 0.00 57.88 58.94 2efn h LEU 81 Cb 0.07 -0.20 -0.08 0.00 0.37 0.00 0.00 40.66 40.83 2efn h LEU 81 CO -0.02 0.60 0.46 1.23 -0.34 0.00 0.00 178.44 180.37 2efn h GLY 82 N 1.00 1.28 1.09 3.75 0.00 -1.13 -0.86 103.07 108.19 2efn h GLY 82 Ca 0.30 -0.30 -0.12 0.00 0.00 0.00 0.00 47.33 47.21 2efn h GLY 82 CO -0.09 0.10 -0.12 3.43 0.00 0.00 0.00 176.54 179.86 2efn h ASN 83 N 0.75 1.01 -0.37 0.19 -0.26 -1.17 -2.32 115.58 113.41 2efn h ASN 83 Ca 0.40 -0.36 -0.07 0.00 -0.56 0.00 0.00 56.30 55.71 2efn h ASN 83 Cb 0.40 -0.28 -0.02 0.00 -1.06 0.00 0.00 38.32 37.36 2efn h ASN 83 CO -0.26 1.14 -0.01 0.11 -1.06 0.00 0.00 177.43 177.34 2efn h LYS 84 N 0.88 0.76 -0.30 0.81 1.57 -0.68 -2.86 116.57 116.75 2efn h LYS 84 Ca 0.13 -0.20 -0.06 0.00 -1.87 0.00 0.00 60.65 58.65 2efn h LYS 84 Cb 0.69 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.90 2efn h LYS 84 CO 0.05 0.77 -0.04 -0.07 -0.57 0.00 0.00 179.45 179.59 2efn h LEU 85 N 0.71 0.56 -1.66 2.94 3.38 -1.05 -3.05 115.31 117.15 2efn h LEU 85 Ca 0.14 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 57.76 2efn h LEU 85 Cb 0.45 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 41.05 2efn h LEU 85 CO 0.02 0.77 0.00 0.00 0.09 0.00 0.00 178.44 179.32 2efn h ALA 86 N 0.81 1.00 0.00 1.53 0.00 -1.24 -2.69 119.26 118.67 2efn h ALA 86 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2efn h ALA 86 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2efn h ALA 86 CO 0.02 0.00 -0.45 1.04 0.00 0.00 0.00 179.25 179.86 2efn n GLN 87 N -2.74 0.01 -2.17 0.00 6.02 -1.09 -4.89 117.38 112.51 2efn n GLN 87 Ca -0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 57.00 56.57 2efn n GLN 87 Cb 0.18 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 29.91 2efn n GLN 87 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2efn s ILE 88 N -3.00 3.50 0.28 5.09 1.01 -1.02 -4.95 121.20 122.11 2efn s ILE 88 Ca 0.11 0.97 -0.30 0.00 0.00 0.00 0.00 60.65 61.43 2efn s ILE 88 Cb 0.18 -3.62 -0.13 0.00 0.01 0.00 0.00 42.46 38.90 2efn s ILE 88 CO 0.68 0.02 1.42 -2.65 0.00 0.00 0.00 174.94 174.42 2efn n PRO 89 N 4.91 2.23 0.00 2.79 -0.02 -1.26 -1.64 135.00 142.01 2efn n PRO 89 Ca 0.13 0.79 0.00 0.00 -2.02 0.00 0.00 63.50 62.40 2efn n PRO 89 Cb 0.43 -2.46 0.00 0.00 -0.02 0.00 0.00 33.50 31.45 2efn n PRO 89 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2efn n GLY 90 N 1.73 3.17 3.65 -1.23 0.00 -1.26 -4.81 105.19 106.44 2efn n GLY 90 Ca 0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 2efn n GLY 90 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2efn s VAL 91 N -2.85 4.55 -0.09 1.61 1.01 -0.65 -1.69 120.40 122.28 2efn s VAL 91 Ca 0.00 1.85 0.11 0.00 0.00 0.00 0.00 61.98 63.94 2efn s VAL 91 Cb 0.00 -4.28 -0.16 0.00 0.00 0.00 0.00 36.38 31.94 2efn s VAL 91 CO 0.00 -0.26 0.28 -2.67 0.00 0.00 0.00 175.10 172.45 2efn n TRP 92 N 6.56 0.00 -4.11 5.22 4.27 -0.16 -4.90 117.44 124.33 2efn n TRP 92 Ca 0.12 0.00 -0.18 0.00 -3.89 0.00 0.00 57.50 53.56 2efn n TRP 92 Cb 0.46 -0.21 -0.16 0.00 -1.36 0.00 0.00 31.31 30.04 2efn n TRP 92 CO 0.00 0.00 0.00 0.20 -2.29 0.00 0.00 177.69 175.60 2efn s GLY 93 N -3.08 0.33 -0.04 -1.67 0.00 -1.01 -4.98 107.32 96.87 2efn s GLY 93 Ca -0.03 -0.04 -0.02 0.00 0.00 0.00 0.00 44.72 44.63 2efn s GLY 93 CO 0.46 0.28 0.05 0.14 0.00 0.00 0.00 173.10 174.03 2efn s VAL 94 N 0.61 -0.02 0.06 1.40 1.01 -1.26 0.04 120.40 122.24 2efn s VAL 94 Ca -0.07 0.35 0.04 0.00 0.00 0.00 0.00 61.98 62.30 2efn s VAL 94 Cb -0.11 -0.20 -0.03 0.00 0.00 0.00 0.00 36.38 36.05 2efn s VAL 94 CO -0.00 0.18 -0.12 -0.31 0.00 0.00 0.00 175.10 174.85 2efn s TYR 95 N 1.97 1.03 -0.17 5.22 1.51 -0.40 -4.97 117.35 121.55 2efn s TYR 95 Ca 0.03 -0.46 -0.05 0.00 -1.01 0.00 0.00 57.07 55.58 2efn s TYR 95 Cb -0.12 -0.59 -0.03 0.00 -0.11 0.00 0.00 41.96 41.11 2efn s TYR 95 CO -0.03 0.01 -0.01 0.12 -1.11 0.00 0.00 175.55 174.52 2efn s PHE 96 N -1.27 3.07 0.14 2.71 2.19 -1.26 -0.38 117.98 123.18 2efn s PHE 96 Ca -0.04 -0.24 0.08 0.00 0.33 0.00 0.00 56.93 57.06 2efn s PHE 96 Cb -0.10 -2.00 -0.04 0.00 -1.31 0.00 0.00 43.02 39.58 2efn s PHE 96 CO 0.02 -0.02 -0.18 0.14 1.83 0.00 0.00 175.22 177.01 2efn s VAL 97 N 0.43 1.66 0.60 3.12 -7.23 0.19 -4.98 120.40 114.19 2efn s VAL 97 Ca -0.02 -1.77 -0.05 0.00 -1.81 0.00 0.00 61.98 58.33 2efn s VAL 97 Cb -0.14 -1.68 0.02 0.00 0.56 0.00 0.00 36.38 35.14 2efn s VAL 97 CO 0.02 -0.28 0.89 -0.76 -0.31 0.00 0.00 175.10 174.67 2efn s LEU 98 N -2.42 3.19 0.00 1.32 1.43 -1.26 -1.97 118.68 118.97 2efn s LEU 98 Ca 0.11 0.58 0.00 0.00 -1.03 0.00 0.00 54.13 53.79 2efn s LEU 98 Cb -0.07 -3.38 0.00 0.00 0.03 0.00 0.00 46.19 42.78 2efn s LEU 98 CO 0.05 -1.14 0.00 0.61 0.23 0.00 0.00 176.35 176.10 2efn n GLY 99 N -2.59 1.88 0.04 -3.19 0.00 -1.26 -4.16 105.19 95.92 2efn n GLY 99 Ca 0.05 -0.60 0.13 0.00 0.00 0.00 0.00 46.02 45.60 2efn n GLY 99 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2efn n ASP 100 N 3.95 0.38 -3.97 1.61 8.00 -1.26 -4.94 116.55 120.32 2efn n ASP 100 Ca 0.00 0.44 -0.37 0.00 0.71 0.00 0.00 54.79 55.56 2efn n ASP 100 Cb 0.00 -0.49 0.01 0.00 -0.02 0.00 0.00 41.12 40.62 2efn n ASP 100 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2efn n ASN 101 N -1.81 -3.36 -1.41 -2.24 5.03 -0.83 -4.94 115.26 105.69 2efn n ASN 101 Ca 0.06 -1.17 -0.03 0.00 0.87 0.00 0.00 54.58 54.31 2efn n ASN 101 Cb 0.38 -2.37 0.00 0.00 -1.02 0.00 0.00 39.78 36.77 2efn n ASN 101 CO 0.00 0.00 0.00 -0.90 -1.83 0.00 0.00 177.26 174.53 2efn n ASP 102 N -2.51 -0.41 -4.86 6.41 5.68 -0.93 -4.84 116.55 115.08 2efn n ASP 102 Ca -0.16 -1.38 -0.36 0.00 -0.50 0.00 0.00 54.79 52.39 2efn n ASP 102 Cb 0.60 0.71 -0.06 0.00 -1.14 0.00 0.00 41.12 41.23 2efn n ASP 102 CO 0.00 0.00 0.00 -0.36 -1.33 0.00 0.00 177.20 175.51 2efn s PHE 103 N -6.09 3.63 -0.17 2.11 0.08 -0.59 -0.63 117.98 116.32 2efn s PHE 103 Ca 0.05 0.76 0.01 0.00 0.12 0.00 0.00 56.93 57.86 2efn s PHE 103 Cb -0.01 -2.12 0.01 0.00 -0.57 0.00 0.00 43.02 40.34 2efn s PHE 103 CO 0.04 0.62 -0.19 0.42 -0.10 0.00 0.00 175.22 176.01 2efn s ILE 104 N -1.20 2.24 -0.19 0.64 1.01 0.49 -0.64 121.20 123.55 2efn s ILE 104 Ca 0.25 -0.89 -0.02 0.00 0.00 0.00 0.00 60.65 59.99 2efn s ILE 104 Cb -0.14 -1.94 -0.01 0.00 0.01 0.00 0.00 42.46 40.38 2efn s ILE 104 CO 0.13 0.53 -0.09 -0.69 0.00 0.00 0.00 174.94 174.82 2efn s VAL 105 N 1.12 3.08 -0.19 2.92 1.01 0.81 -1.27 120.40 127.88 2efn s VAL 105 Ca 0.01 -0.61 -0.10 0.00 0.00 0.00 0.00 61.98 61.28 2efn s VAL 105 Cb -0.14 -2.36 -0.05 0.00 0.00 0.00 0.00 36.38 33.83 2efn s VAL 105 CO -0.08 0.47 0.13 -0.04 0.00 0.00 0.00 175.10 175.58 2efn s MET 106 N 1.15 4.12 0.13 2.72 1.00 0.11 -0.73 119.30 127.79 2efn s MET 106 Ca 0.01 -0.22 -0.10 0.00 0.00 0.00 0.00 55.69 55.39 2efn s MET 106 Cb -0.14 -3.39 0.00 0.00 0.00 0.00 0.00 34.83 31.29 2efn s MET 106 CO -0.03 0.34 0.27 0.00 0.00 0.00 0.00 175.02 175.60 2efn s ALA 107 N 0.24 -0.26 -0.01 3.03 0.00 -0.64 -0.99 121.76 123.12 2efn s ALA 107 Ca 0.08 -0.63 0.00 0.00 0.00 0.00 0.00 51.96 51.42 2efn s ALA 107 Cb -0.11 0.67 0.01 0.00 0.00 0.00 0.00 23.12 23.69 2efn s ALA 107 CO -0.01 -0.59 -0.01 1.03 0.00 0.00 0.00 175.76 176.18 2efn s ARG 108 N -3.89 0.14 0.07 0.00 0.52 -0.68 -1.99 118.95 113.12 2efn s ARG 108 Ca 0.10 0.01 -0.01 0.00 -0.52 0.00 0.00 55.73 55.30 2efn s ARG 108 Cb 0.04 -0.22 -0.04 0.00 0.52 0.00 0.00 34.95 35.25 2efn s ARG 108 CO -0.07 -0.03 -0.01 0.71 0.02 0.00 0.00 175.30 175.92 2efn s TYR 109 N 0.36 0.60 0.12 -0.53 2.02 0.41 -4.65 117.35 115.68 2efn s TYR 109 Ca -0.03 -1.11 -0.09 0.00 -0.37 0.00 0.00 57.07 55.47 2efn s TYR 109 Cb -0.05 -0.41 -0.12 0.00 -0.40 0.00 0.00 41.96 40.98 2efn s TYR 109 CO -0.01 -0.41 1.31 0.87 -1.57 0.00 0.00 175.55 175.74 2efn h LYS 110 N 3.08 0.63 -4.13 -0.62 1.57 -1.83 0.24 116.57 115.52 2efn h LYS 110 Ca -0.34 -0.57 -0.16 0.00 -1.87 0.00 0.00 60.65 57.71 2efn h LYS 110 Cb 1.15 0.14 -0.12 0.00 0.08 0.00 0.00 32.23 33.48 2efn h LYS 110 CO 0.64 1.19 -0.36 0.95 -0.57 0.00 0.00 179.45 181.30 2efn s THR 111 N -3.54 0.00 0.20 -0.16 -4.23 -1.26 -3.45 115.64 103.20 2efn s THR 111 Ca -0.08 -1.70 -0.11 0.00 -1.18 0.00 0.00 61.69 58.62 2efn s THR 111 Cb 0.09 -2.36 0.12 0.00 1.34 0.00 0.00 72.50 71.68 2efn s THR 111 CO 0.89 0.00 1.78 -0.09 -0.54 0.00 0.00 174.62 176.66 2efn h ARG 112 N 2.42 0.53 -0.45 3.99 2.43 -1.95 -1.52 114.38 119.83 2efn h ARG 112 Ca -0.31 -0.03 0.06 0.00 -0.81 0.00 0.00 59.98 58.89 2efn h ARG 112 Cb 1.25 -0.12 -0.05 0.00 -0.42 0.00 0.00 29.97 30.63 2efn h ARG 112 CO 0.44 0.35 0.14 0.93 -1.51 0.00 0.00 179.97 180.32 2efn h GLU 113 N 0.54 0.29 -0.44 0.20 3.07 -1.99 0.53 114.58 116.78 2efn h GLU 113 Ca 0.27 -0.02 -0.05 0.00 -0.50 0.00 0.00 59.36 59.06 2efn h GLU 113 Cb 0.21 -0.07 -0.02 0.00 -0.84 0.00 0.00 28.75 28.04 2efn h GLU 113 CO -0.20 0.19 0.09 1.49 -1.40 0.00 0.00 179.01 179.18 2efn h GLU 114 N 0.30 0.72 -0.45 2.33 4.81 -1.86 -1.01 114.58 119.43 2efn h GLU 114 Ca 0.21 -0.18 0.06 0.00 -0.13 0.00 0.00 59.36 59.32 2efn h GLU 114 Cb 0.23 -0.09 -0.05 0.00 0.63 0.00 0.00 28.75 29.46 2efn h GLU 114 CO -0.23 0.73 0.14 0.35 -0.73 0.00 0.00 179.01 179.28 2efn h PHE 115 N 0.59 0.25 -0.03 0.92 3.57 -0.69 0.24 116.94 121.78 2efn h PHE 115 Ca 0.14 0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.66 2efn h PHE 115 Cb 0.35 -0.05 -0.00 0.00 2.79 0.00 0.00 35.95 39.04 2efn h PHE 115 CO 0.02 0.08 0.01 0.52 -2.23 0.00 0.00 178.31 176.71 2efn h MET 116 N 0.31 0.04 -0.17 1.11 2.86 -0.67 0.09 114.93 118.50 2efn h MET 116 Ca 0.22 -0.01 -0.04 0.00 -2.06 0.00 0.00 59.70 57.81 2efn h MET 116 Cb 0.23 -0.01 -0.00 0.00 0.06 0.00 0.00 31.60 31.88 2efn h MET 116 CO -0.24 0.17 -0.06 1.49 1.06 0.00 0.00 176.91 179.33 2efn h GLU 117 N -0.09 0.34 0.10 1.72 4.81 -0.89 0.53 114.58 121.08 2efn h GLU 117 Ca 0.01 -0.14 -0.29 0.00 -0.13 0.00 0.00 59.36 58.81 2efn h GLU 117 Cb 0.14 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.50 2efn h GLU 117 CO -0.00 0.63 -1.41 0.87 -0.73 0.00 0.00 179.01 178.37 2efn h LYS 118 N 0.03 0.20 0.00 1.92 1.57 -0.60 -3.40 116.57 116.29 2efn h LYS 118 Ca 0.04 -0.35 0.00 0.00 -1.87 0.00 0.00 60.65 58.47 2efn h LYS 118 Cb 0.52 0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.96 2efn h LYS 118 CO 0.02 1.08 0.00 0.34 -0.57 0.00 0.00 179.45 180.32 2efn n PHE 119 N -3.43 0.00 -0.10 -1.35 -0.00 -0.06 -4.53 117.46 108.00 2efn n PHE 119 Ca -0.13 0.00 -0.06 0.00 -0.00 0.00 0.00 57.45 57.26 2efn n PHE 119 Cb 1.03 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 40.51 2efn n PHE 119 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.76 178.01 2efn h LEU 120 N 0.00 -0.53 -1.16 -2.13 5.85 -1.38 -0.03 115.31 115.92 2efn h LEU 120 Ca 0.00 0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 2efn h LEU 120 Cb 0.00 0.30 -0.04 0.00 0.37 0.00 0.00 40.66 41.29 2efn h LEU 120 CO 0.00 -0.19 0.45 -0.33 -0.34 0.00 0.00 178.44 178.02 2efn h GLU 121 N -0.10 1.02 -0.17 1.25 5.08 -1.13 0.10 114.58 120.63 2efn h GLU 121 Ca 0.17 -0.09 -0.03 0.00 -1.00 0.00 0.00 59.36 58.41 2efn h GLU 121 Cb 0.36 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 2efn h GLU 121 CO -0.41 0.72 -0.01 -0.09 -1.00 0.00 0.00 179.01 178.22 2efn h ARG 122 N 1.03 0.31 -0.78 2.33 2.43 -1.51 -2.82 114.38 115.38 2efn h ARG 122 Ca 0.27 -0.11 -0.05 0.00 -0.81 0.00 0.00 59.98 59.28 2efn h ARG 122 Cb -0.03 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.46 2efn h ARG 122 CO -0.05 0.54 0.28 0.28 -1.51 0.00 0.00 179.97 179.52 2efn h VAL 123 N 0.05 1.26 -0.12 0.20 2.07 -0.69 -2.12 116.25 116.90 2efn h VAL 123 Ca 0.05 -0.86 0.03 0.00 0.82 0.00 0.00 66.70 66.74 2efn h VAL 123 Cb 0.41 0.36 -0.00 0.00 -1.52 0.00 0.00 31.29 30.53 2efn h VAL 123 CO 0.01 0.35 0.11 0.24 0.02 0.00 0.00 177.57 178.30 2efn h MET 124 N 1.15 0.00 -0.00 1.57 2.86 -0.72 -1.01 114.93 118.77 2efn h MET 124 Ca 0.26 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.90 2efn h MET 124 Cb 0.25 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.91 2efn h MET 124 CO -0.02 0.00 -0.09 -1.13 1.06 0.00 0.00 176.91 176.74 2efn n SER 125 N -4.12 0.39 -4.56 1.22 3.41 -0.80 -4.75 113.62 104.40 2efn n SER 125 Ca -0.00 -0.53 -0.43 0.00 -0.26 0.00 0.00 58.87 57.66 2efn n SER 125 Cb 0.22 -0.10 -0.05 0.00 -0.26 0.00 0.00 64.21 64.02 2efn n SER 125 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2efn s ILE 126 N -2.47 4.62 0.48 -1.33 1.01 -0.38 -4.95 121.20 118.18 2efn s ILE 126 Ca 0.29 0.68 0.19 0.00 0.00 0.00 0.00 60.65 61.82 2efn s ILE 126 Cb 0.20 -4.32 0.24 0.00 0.01 0.00 0.00 42.46 38.60 2efn s ILE 126 CO 0.47 -0.66 2.08 1.55 0.00 0.00 0.00 174.94 178.38 2efn h PRO 127 N 8.83 0.00 -0.02 2.79 0.13 -1.87 -2.75 132.00 139.12 2efn h PRO 127 Ca -0.24 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.89 2efn h PRO 127 Cb 1.08 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.21 2efn h PRO 127 CO 0.96 0.10 0.00 -0.85 -0.23 0.00 0.00 178.00 177.99 2efn n GLU 128 N -4.22 1.06 -3.06 0.86 0.00 -1.26 -4.74 120.64 109.29 2efn n GLU 128 Ca -0.03 -0.09 -0.40 0.00 0.00 0.00 0.00 57.16 56.64 2efn n GLU 128 Cb 0.18 -1.14 -0.05 0.00 0.00 0.00 0.00 31.44 30.43 2efn n GLU 128 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.13 177.21 2efn s VAL 129 N -1.97 5.04 -0.18 3.84 1.01 -1.04 -1.02 120.40 126.08 2efn s VAL 129 Ca 0.14 1.39 -0.07 0.00 0.00 0.00 0.00 61.98 63.44 2efn s VAL 129 Cb 0.06 -4.02 -0.22 0.00 0.00 0.00 0.00 36.38 32.20 2efn s VAL 129 CO 0.10 0.22 0.14 1.21 0.00 0.00 0.00 175.10 176.77 2efn n GLU 130 N 4.09 0.70 -3.58 2.72 4.07 0.40 -4.88 120.64 124.16 2efn n GLU 130 Ca -0.01 0.27 -0.12 0.00 -0.06 0.00 0.00 57.16 57.24 2efn n GLU 130 Cb 0.51 -1.65 -0.05 0.00 -0.06 0.00 0.00 31.44 30.19 2efn n GLU 130 CO 0.00 0.00 0.00 1.03 -0.06 0.00 0.00 177.13 178.10 2efn s ARG 131 N -2.52 1.07 0.01 5.31 1.81 -1.23 -4.99 118.95 118.41 2efn s ARG 131 Ca -0.28 -0.46 -0.06 0.00 -1.72 0.00 0.00 55.73 53.21 2efn s ARG 131 Cb 0.08 0.48 -0.00 0.00 -0.45 0.00 0.00 34.95 35.06 2efn s ARG 131 CO 0.68 -0.41 0.11 0.95 -0.68 0.00 0.00 175.30 175.95 2efn s THR 132 N -3.15 0.09 -0.16 0.02 -4.23 -1.26 -0.83 115.64 106.12 2efn s THR 132 Ca -0.01 -0.75 -0.04 0.00 -1.18 0.00 0.00 61.69 59.71 2efn s THR 132 Cb 0.00 -0.43 0.07 0.00 1.34 0.00 0.00 72.50 73.48 2efn s THR 132 CO -0.07 -0.41 0.19 -0.55 -0.54 0.00 0.00 174.62 173.23 2efn s SER 133 N -1.44 1.22 -0.28 3.99 0.15 -0.21 -4.96 113.70 112.17 2efn s SER 133 Ca -0.15 -0.03 -0.10 0.00 0.70 0.00 0.00 55.95 56.37 2efn s SER 133 Cb -0.08 0.29 -0.04 0.00 -1.71 0.00 0.00 66.02 64.48 2efn s SER 133 CO 0.01 -0.30 0.17 -0.89 1.20 0.00 0.00 173.24 173.43 2efn s THR 134 N 2.30 5.12 -0.27 6.45 2.01 -1.26 -0.51 115.64 129.49 2efn s THR 134 Ca 0.05 0.07 -0.14 0.00 0.31 0.00 0.00 61.69 61.98 2efn s THR 134 Cb -0.14 -3.45 -0.04 0.00 0.01 0.00 0.00 72.50 68.87 2efn s THR 134 CO -0.09 0.24 0.32 -1.10 -0.69 0.00 0.00 174.62 173.29 2efn s GLN 135 N 1.73 4.02 -0.32 4.92 -1.52 0.94 -4.95 119.66 124.48 2efn s GLN 135 Ca 0.07 -0.05 -0.25 0.00 -1.95 0.00 0.00 55.36 53.17 2efn s GLN 135 Cb -0.16 -3.64 0.01 0.00 -0.22 0.00 0.00 33.01 29.00 2efn s GLN 135 CO 0.10 -0.21 0.87 0.08 -0.25 0.00 0.00 175.29 175.87 2efn s VAL 136 N 1.87 4.70 -0.23 1.09 1.01 -1.26 -1.54 120.40 126.05 2efn s VAL 136 Ca 0.13 1.31 -0.29 0.00 0.00 0.00 0.00 61.98 63.13 2efn s VAL 136 Cb -0.16 -4.23 -0.02 0.00 0.00 0.00 0.00 36.38 31.97 2efn s VAL 136 CO 0.10 -0.34 1.46 -0.69 0.00 0.00 0.00 175.10 175.63 2efn s VAL 137 N 3.18 3.92 -1.28 2.92 1.01 -0.02 -4.84 120.40 125.29 2efn s VAL 137 Ca 0.36 1.06 0.11 0.00 0.00 0.00 0.00 61.98 63.51 2efn s VAL 137 Cb -0.13 -3.88 0.16 0.00 0.00 0.00 0.00 36.38 32.52 2efn s VAL 137 CO 0.14 -0.31 0.98 1.33 0.00 0.00 0.00 175.10 177.24 2efn n VAL 138 N 6.11 0.30 -3.58 2.92 0.24 -1.26 -4.47 118.33 118.60 2efn n VAL 138 Ca 0.17 -0.65 -0.01 0.00 -2.04 0.00 0.00 64.34 61.80 2efn n VAL 138 Cb 0.45 1.02 -0.05 0.00 -1.47 0.00 0.00 33.84 33.80 2efn n VAL 138 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 2efn s LYS 139 N -0.96 0.50 -0.51 7.34 2.47 -1.26 -5.10 119.74 122.21 2efn s LYS 139 Ca 0.16 1.18 -0.13 0.00 -1.56 0.00 0.00 55.97 55.62 2efn s LYS 139 Cb 0.10 0.62 0.12 0.00 -1.46 0.00 0.00 37.83 37.21 2efn s LYS 139 CO 0.15 -0.16 0.44 0.42 0.16 0.00 0.00 175.35 176.36 2efn s ILE 140 N 2.52 4.82 0.08 5.43 1.01 -1.26 -4.90 121.20 128.90 2efn s ILE 140 Ca -0.06 -1.60 -0.16 0.00 0.00 0.00 0.00 60.65 58.83 2efn s ILE 140 Cb -0.09 -4.11 -0.11 0.00 0.01 0.00 0.00 42.46 38.16 2efn s ILE 140 CO -0.18 -0.82 1.38 0.40 0.00 0.00 0.00 174.94 175.71 2efn h ILE 141 N 5.98 1.32 -2.31 2.92 1.08 -2.04 -3.46 117.51 121.01 2efn h ILE 141 Ca -0.26 -1.48 -0.07 0.00 -0.39 0.00 0.00 64.86 62.65 2efn h ILE 141 Cb 1.09 1.73 -0.22 0.00 -3.07 0.00 0.00 36.82 36.35 2efn h ILE 141 CO 0.97 0.46 -0.01 -0.75 -0.69 0.00 0.00 178.15 178.13 2efn s LYS 142 N -4.25 0.73 -0.44 2.37 2.20 -1.26 -5.11 119.74 113.99 2efn s LYS 142 Ca -0.13 0.71 0.06 0.00 -0.36 0.00 0.00 55.97 56.26 2efn s LYS 142 Cb 0.07 0.35 0.18 0.00 -1.51 0.00 0.00 37.83 36.93 2efn s LYS 142 CO 0.81 -0.12 0.59 -2.00 -0.36 0.00 0.00 175.35 174.28 2efn s GLU 143 N 0.06 0.88 -0.48 4.03 2.12 -1.26 -5.04 118.70 119.01 2efn s GLU 143 Ca -0.02 -0.82 0.08 0.00 0.36 0.00 0.00 54.97 54.58 2efn s GLU 143 Cb -0.04 -0.25 0.30 0.00 0.26 0.00 0.00 34.13 34.40 2efn s GLU 143 CO 0.02 -1.26 0.72 0.43 -0.54 0.00 0.00 175.26 174.64 2efn n SER 144 N 3.75 2.05 0.34 -1.70 7.64 -1.26 -4.92 113.62 119.51 2efn n SER 144 Ca 0.15 -3.16 0.20 0.00 1.01 0.00 0.00 58.87 57.07 2efn n SER 144 Cb 0.53 -0.62 1.08 0.00 -1.01 0.00 0.00 64.21 64.19 2efn n SER 144 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 2efn h PRO 145 N 3.51 0.00 0.00 1.43 0.13 -2.01 -0.91 132.00 134.14 2efn h PRO 145 Ca 0.12 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.21 2efn h PRO 145 Cb 0.78 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.90 2efn h PRO 145 CO 0.63 0.00 -0.20 -2.95 -0.23 0.00 0.00 178.00 175.25 2efn h ASN 146 N 0.00 0.00 -2.86 1.44 -1.07 -1.91 -3.41 115.58 107.77 2efn h ASN 146 Ca 0.00 0.00 -0.56 0.00 0.07 0.00 0.00 56.30 55.81 2efn h ASN 146 Cb 0.24 0.00 -0.08 0.00 -2.07 0.00 0.00 38.32 36.41 2efn h ASN 146 CO 0.00 0.20 0.96 -0.63 0.07 0.00 0.00 177.43 178.03 2efn s ILE 147 N -3.83 3.95 -0.34 6.14 -1.09 -0.35 -4.78 121.20 120.90 2efn s ILE 147 Ca -0.01 0.62 0.10 0.00 -2.23 0.00 0.00 60.65 59.13 2efn s ILE 147 Cb 0.11 -4.78 -0.12 0.00 -1.58 0.00 0.00 42.46 36.09 2efn s ILE 147 CO 0.62 -1.52 0.36 1.33 -1.23 0.00 0.00 174.94 174.50 2efn n VAL 148 N 6.49 0.00 -4.03 2.92 0.24 -1.26 -4.89 118.33 117.80 2efn n VAL 148 Ca 0.05 -0.26 -0.31 0.00 -2.04 0.00 0.00 64.34 61.78 2efn n VAL 148 Cb 0.49 0.82 -0.15 0.00 -1.47 0.00 0.00 33.84 33.52 2efn n VAL 148 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 2efn s ILE 149 N -2.10 1.93 -2.74 1.34 1.01 -1.26 -5.16 121.20 114.22 2efn s ILE 149 Ca 0.02 -1.43 0.26 0.00 0.00 0.00 0.00 60.65 59.50 2efn s ILE 149 Cb 0.07 -2.07 0.37 0.00 0.01 0.00 0.00 42.46 40.85 2efn s ILE 149 CO 0.40 -0.00 1.51 0.49 0.00 0.00 0.00 174.94 177.33