#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2chs s ILE 3 N 0.00 5.27 -0.00 1.12 1.01 -1.26 -1.10 121.20 126.23 2chs s ILE 3 Ca 0.00 0.44 -0.01 0.00 0.00 0.00 0.00 60.65 61.08 2chs s ILE 3 Cb 0.00 -3.56 -0.00 0.00 0.01 0.00 0.00 42.46 38.90 2chs s ILE 3 CO 0.00 0.53 0.02 -0.13 0.00 0.00 0.00 174.94 175.36 2chs s ARG 4 N -1.27 0.12 0.17 2.79 1.81 0.12 -4.93 118.95 117.77 2chs s ARG 4 Ca 0.22 -0.12 -0.19 0.00 -1.72 0.00 0.00 55.73 53.92 2chs s ARG 4 Cb -0.14 0.05 -0.08 0.00 -0.45 0.00 0.00 34.95 34.33 2chs s ARG 4 CO 0.11 -0.02 0.66 0.20 -0.68 0.00 0.00 175.30 175.57 2chs s GLY 5 N -0.39 2.62 -0.07 -3.53 0.00 -1.26 -1.15 107.32 103.54 2chs s GLY 5 Ca -0.04 0.10 0.05 0.00 0.00 0.00 0.00 44.72 44.83 2chs s GLY 5 CO -0.00 0.46 -0.25 -0.42 0.00 0.00 0.00 173.10 172.90 2chs s ILE 6 N -1.40 2.04 0.04 0.90 1.01 0.71 -4.96 121.20 119.54 2chs s ILE 6 Ca 0.39 -1.04 0.05 0.00 0.00 0.00 0.00 60.65 60.04 2chs s ILE 6 Cb -0.17 -1.73 -0.04 0.00 0.01 0.00 0.00 42.46 40.53 2chs s ILE 6 CO 0.21 0.56 -0.08 -0.13 0.00 0.00 0.00 174.94 175.50 2chs s ARG 7 N -0.02 2.39 0.11 2.79 1.81 -1.26 -0.48 118.95 124.29 2chs s ARG 7 Ca -0.08 -0.84 -0.05 0.00 -1.72 0.00 0.00 55.73 53.04 2chs s ARG 7 Cb -0.15 -2.42 -0.02 0.00 -0.45 0.00 0.00 34.95 31.91 2chs s ARG 7 CO 0.05 0.57 0.13 0.20 -0.68 0.00 0.00 175.30 175.56 2chs s GLY 8 N -1.71 0.50 -0.19 -3.53 0.00 -1.02 -1.19 107.32 100.18 2chs s GLY 8 Ca 0.19 -1.04 -0.27 0.00 0.00 0.00 0.00 44.72 43.60 2chs s GLY 8 CO 0.10 -1.07 0.70 0.00 0.00 0.00 0.00 173.10 172.83 2chs s ALA 9 N -3.95 -1.76 0.27 3.20 0.00 -0.36 -1.56 121.76 117.60 2chs s ALA 9 Ca 0.13 1.76 -0.09 0.00 0.00 0.00 0.00 51.96 53.76 2chs s ALA 9 Cb 0.06 -0.75 -0.00 0.00 0.00 0.00 0.00 23.12 22.42 2chs s ALA 9 CO -0.05 -0.35 0.45 -0.08 0.00 0.00 0.00 175.76 175.73 2chs s THR 10 N -0.18 0.00 0.10 0.00 -1.32 -0.60 -1.31 115.64 112.32 2chs s THR 10 Ca -0.04 -1.50 0.04 0.00 -1.21 0.00 0.00 61.69 58.98 2chs s THR 10 Cb -0.03 -2.35 -0.04 0.00 -1.51 0.00 0.00 72.50 68.57 2chs s THR 10 CO 0.04 0.00 -0.10 0.42 -2.21 0.00 0.00 174.62 172.77 2chs s THR 11 N -3.77 0.95 0.08 5.08 -4.23 -1.26 -1.64 115.64 110.85 2chs s THR 11 Ca 0.26 -1.66 0.07 0.00 -1.18 0.00 0.00 61.69 59.18 2chs s THR 11 Cb 0.00 -1.39 -0.04 0.00 1.34 0.00 0.00 72.50 72.42 2chs s THR 11 CO 0.12 -0.57 -0.15 0.68 -0.54 0.00 0.00 174.62 174.16 2chs s VAL 12 N -2.50 3.06 -0.34 2.29 -7.23 -0.69 -4.79 120.40 110.21 2chs s VAL 12 Ca 0.06 -1.28 0.21 0.00 -1.81 0.00 0.00 61.98 59.16 2chs s VAL 12 Cb -0.02 -2.38 0.21 0.00 0.56 0.00 0.00 36.38 34.75 2chs s VAL 12 CO -0.00 0.19 1.45 -0.33 -0.31 0.00 0.00 175.10 176.10 2chs h GLU 13 N 3.98 0.00 -3.16 4.82 4.39 -1.96 -3.45 114.58 119.19 2chs h GLU 13 Ca -0.49 0.00 -0.15 0.00 0.34 0.00 0.00 59.36 59.06 2chs h GLU 13 Cb 1.16 0.00 -0.23 0.00 -0.10 0.00 0.00 28.75 29.58 2chs h GLU 13 CO 0.49 0.11 -0.39 1.03 -1.16 0.00 0.00 179.01 179.09 2chs s ARG 14 N -3.17 0.43 -1.22 2.33 0.52 -1.26 -5.08 118.95 111.49 2chs s ARG 14 Ca 0.05 0.08 -0.19 0.00 -0.52 0.00 0.00 55.73 55.15 2chs s ARG 14 Cb 0.06 0.19 0.08 0.00 0.52 0.00 0.00 34.95 35.81 2chs s ARG 14 CO 0.71 -0.09 1.63 0.34 0.02 0.00 0.00 175.30 177.91 2chs s ASP 15 N -0.51 6.79 0.09 0.23 2.15 -1.26 -4.65 116.67 119.51 2chs s ASP 15 Ca -0.06 -2.29 0.04 0.00 0.43 0.00 0.00 52.55 50.66 2chs s ASP 15 Cb -0.04 -2.55 -0.03 0.00 -0.30 0.00 0.00 42.92 39.99 2chs s ASP 15 CO 0.02 -1.19 -0.10 0.28 -0.17 0.00 0.00 175.17 174.00 2chs s THR 16 N 4.05 0.93 0.14 1.71 -1.32 -1.26 -4.70 115.64 115.19 2chs s THR 16 Ca 0.50 -1.59 -0.20 0.00 -1.21 0.00 0.00 61.69 59.19 2chs s THR 16 Cb 0.02 -1.30 0.00 0.00 -1.51 0.00 0.00 72.50 69.71 2chs s THR 16 CO 0.03 -0.53 1.68 -0.08 -2.21 0.00 0.00 174.62 173.51 2chs h GLU 17 N 3.66 -0.07 -0.73 7.08 4.81 -1.91 -1.26 114.58 126.15 2chs h GLU 17 Ca -0.37 0.00 0.14 0.00 -0.13 0.00 0.00 59.36 59.00 2chs h GLU 17 Cb 1.19 0.02 -0.09 0.00 0.63 0.00 0.00 28.75 30.49 2chs h GLU 17 CO 0.51 -0.05 0.27 1.49 -0.73 0.00 0.00 179.01 180.51 2chs h GLU 18 N -0.07 0.40 0.10 1.92 4.81 -1.96 -0.39 114.58 119.39 2chs h GLU 18 Ca 0.12 -0.02 -0.16 0.00 -0.13 0.00 0.00 59.36 59.16 2chs h GLU 18 Cb 0.24 -0.09 0.02 0.00 0.63 0.00 0.00 28.75 29.55 2chs h GLU 18 CO -0.26 0.26 -0.70 1.49 -0.73 0.00 0.00 179.01 179.07 2chs h GLU 19 N 0.41 0.30 -0.15 1.92 4.81 -1.70 -1.90 114.58 118.27 2chs h GLU 19 Ca 0.40 -0.45 0.04 0.00 -0.13 0.00 0.00 59.36 59.22 2chs h GLU 19 Cb 0.61 0.16 -0.04 0.00 0.63 0.00 0.00 28.75 30.11 2chs h GLU 19 CO -0.41 1.19 -0.10 0.82 -0.73 0.00 0.00 179.01 179.78 2chs h ILE 20 N -0.36 0.69 -0.40 2.32 2.04 -0.98 -0.28 117.51 120.54 2chs h ILE 20 Ca -0.12 0.00 -0.10 0.00 1.00 0.00 0.00 64.86 65.65 2chs h ILE 20 Cb 1.51 0.69 -0.02 0.00 -0.74 0.00 0.00 36.82 38.27 2chs h ILE 20 CO 0.13 0.00 -0.15 -0.07 0.00 0.00 0.00 178.15 178.06 2chs h LEU 21 N -0.11 0.74 -0.30 1.44 3.38 -1.15 -1.09 115.31 118.23 2chs h LEU 21 Ca 0.09 -0.24 -0.06 0.00 0.09 0.00 0.00 57.88 57.77 2chs h LEU 21 Cb 0.24 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 2chs h LEU 21 CO -0.22 0.90 -0.06 -0.61 0.09 0.00 0.00 178.44 178.55 2chs h GLN 22 N 0.66 0.57 -0.07 1.13 4.15 -0.85 -2.44 115.11 118.27 2chs h GLN 22 Ca 0.11 -0.21 -0.20 0.00 0.77 0.00 0.00 58.65 59.12 2chs h GLN 22 Cb 0.63 -0.04 -0.00 0.00 0.21 0.00 0.00 27.48 28.29 2chs h GLN 22 CO 0.04 0.75 -0.79 0.87 -1.93 0.00 0.00 178.83 177.78 2chs h LYS 23 N 0.34 0.46 -0.37 1.69 1.79 -1.03 -2.52 116.57 116.93 2chs h LYS 23 Ca 0.08 -0.40 -0.02 0.00 -2.18 0.00 0.00 60.65 58.13 2chs h LYS 23 Cb 0.53 0.09 -0.02 0.00 -1.58 0.00 0.00 32.23 31.26 2chs h LYS 23 CO 0.03 1.04 0.16 1.15 -1.08 0.00 0.00 179.45 180.75 2chs h THR 24 N 0.30 1.18 -0.33 -0.16 2.02 -1.18 -2.20 112.91 112.56 2chs h THR 24 Ca -0.05 -0.55 0.02 0.00 0.77 0.00 0.00 66.41 66.60 2chs h THR 24 Cb 1.38 0.85 -0.03 0.00 -1.74 0.00 0.00 68.15 68.62 2chs h THR 24 CO 0.14 0.20 0.17 0.50 0.37 0.00 0.00 175.52 176.90 2chs h LYS 25 N 0.46 0.34 -0.79 6.66 3.64 -1.47 -1.09 116.57 124.31 2chs h LYS 25 Ca 0.13 -0.02 0.11 0.00 -1.27 0.00 0.00 60.65 59.59 2chs h LYS 25 Cb 0.16 -0.08 -0.08 0.00 -0.41 0.00 0.00 32.23 31.83 2chs h LYS 25 CO -0.01 0.23 0.42 1.96 -2.27 0.00 0.00 179.45 179.78 2chs h GLN 26 N 0.35 0.67 -0.25 1.90 4.20 -1.32 0.19 115.11 120.85 2chs h GLN 26 Ca 0.13 -0.04 -0.05 0.00 0.06 0.00 0.00 58.65 58.75 2chs h GLN 26 Cb 0.03 -0.15 -0.01 0.00 0.30 0.00 0.00 27.48 27.65 2chs h GLN 26 CO -0.08 0.44 -0.03 1.25 -0.67 0.00 0.00 178.83 179.74 2chs h LEU 27 N 0.69 0.47 -1.12 1.46 5.85 -1.02 -1.74 115.31 119.90 2chs h LEU 27 Ca 0.40 -0.34 -0.04 0.00 0.84 0.00 0.00 57.88 58.74 2chs h LEU 27 Cb 0.43 -0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.31 2chs h LEU 27 CO -0.28 0.70 0.18 -0.07 -0.34 0.00 0.00 178.44 178.62 2chs h LEU 28 N 0.23 0.73 -0.41 2.25 3.38 -0.64 -1.90 115.31 118.94 2chs h LEU 28 Ca 0.07 -0.11 -0.07 0.00 0.09 0.00 0.00 57.88 57.86 2chs h LEU 28 Cb 0.48 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.02 2chs h LEU 28 CO 0.02 0.69 -0.01 -0.33 0.09 0.00 0.00 178.44 178.90 2chs h GLU 29 N 0.78 0.74 -0.50 1.13 5.08 -0.82 -2.21 114.58 118.77 2chs h GLU 29 Ca 0.18 -0.24 -0.04 0.00 -1.00 0.00 0.00 59.36 58.26 2chs h GLU 29 Cb 0.21 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.38 2chs h GLU 29 CO -0.01 0.82 0.16 -0.22 -1.00 0.00 0.00 179.01 178.76 2chs h LYS 30 N 0.57 0.77 -0.65 2.33 1.63 -1.05 -1.41 116.57 118.76 2chs h LYS 30 Ca 0.11 -0.17 0.04 0.00 -0.85 0.00 0.00 60.65 59.79 2chs h LYS 30 Cb 0.50 -0.11 -0.04 0.00 -0.60 0.00 0.00 32.23 31.97 2chs h LYS 30 CO 0.02 0.72 0.39 0.82 -3.45 0.00 0.00 179.45 177.96 2chs h ILE 31 N 0.68 1.05 -0.56 2.00 2.04 -1.28 -1.36 117.51 120.08 2chs h ILE 31 Ca 0.16 -0.26 -0.05 0.00 1.00 0.00 0.00 64.86 65.71 2chs h ILE 31 Cb 0.27 0.23 -0.03 0.00 -0.74 0.00 0.00 36.82 36.55 2chs h ILE 31 CO -0.01 0.14 0.16 0.40 0.00 0.00 0.00 178.15 178.84 2chs h ILE 32 N 0.76 1.22 0.63 -0.67 2.04 -1.03 -1.30 117.51 119.16 2chs h ILE 32 Ca 0.27 -0.78 -0.03 0.00 1.00 0.00 0.00 64.86 65.32 2chs h ILE 32 Cb 0.06 0.62 0.01 0.00 -0.74 0.00 0.00 36.82 36.77 2chs h ILE 32 CO -0.12 0.29 -0.30 -0.33 0.00 0.00 0.00 178.15 177.69 2chs h GLU 33 N 0.82 -0.81 -1.01 2.37 5.08 -0.99 0.13 114.58 120.17 2chs h GLU 33 Ca 0.18 0.06 0.25 0.00 -1.00 0.00 0.00 59.36 58.85 2chs h GLU 33 Cb 0.26 0.18 -0.09 0.00 0.50 0.00 0.00 28.75 29.61 2chs h GLU 33 CO -0.01 -0.54 0.66 0.93 -1.00 0.00 0.00 179.01 179.05 2chs h GLU 34 N -0.96 0.38 -0.01 2.33 4.39 -1.12 -2.51 114.58 117.07 2chs h GLU 34 Ca -0.09 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.59 2chs h GLU 34 Cb 0.65 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.21 2chs h GLU 34 CO 0.14 0.25 0.00 0.09 -1.16 0.00 0.00 179.01 178.33 2chs n ASN 35 N -4.58 1.27 -3.71 1.42 3.02 -0.50 -4.80 115.26 107.39 2chs n ASN 35 Ca 0.24 -1.19 -0.25 0.00 -0.03 0.00 0.00 54.58 53.35 2chs n ASN 35 Cb 0.84 -0.00 0.05 0.00 -0.61 0.00 0.00 39.78 40.06 2chs n ASN 35 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 2chs n HIS 36 N 0.05 -2.39 -2.66 3.10 8.25 0.45 -4.90 115.22 117.12 2chs n HIS 36 Ca 0.01 0.93 -0.43 0.00 -0.26 0.00 0.00 57.72 57.97 2chs n HIS 36 Cb 0.07 -4.55 -0.02 0.00 1.12 0.00 0.00 29.99 26.62 2chs n HIS 36 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 2chs s THR 37 N -3.39 4.69 0.13 1.59 2.01 -1.08 -5.02 115.64 114.56 2chs s THR 37 Ca 0.41 2.02 -0.23 0.00 0.31 0.00 0.00 61.69 64.20 2chs s THR 37 Cb -0.19 -4.30 -0.07 0.00 0.01 0.00 0.00 72.50 67.94 2chs s THR 37 CO 0.78 -0.15 0.70 -0.54 -0.69 0.00 0.00 174.62 174.73 2chs s LYS 38 N 3.00 4.44 0.37 4.92 -0.14 -1.26 -4.92 119.74 126.14 2chs s LYS 38 Ca 0.45 1.00 0.17 0.00 -1.36 0.00 0.00 55.97 56.23 2chs s LYS 38 Cb -0.16 -3.26 1.08 0.00 -1.68 0.00 0.00 37.83 33.82 2chs s LYS 38 CO 0.08 0.59 1.73 -1.00 -0.76 0.00 0.00 175.35 175.98 2chs h PRO 39 N 4.45 0.39 0.00 -1.68 0.13 -1.95 -1.78 132.00 131.55 2chs h PRO 39 Ca -0.48 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 2chs h PRO 39 Cb 1.21 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 32.25 2chs h PRO 39 CO 0.65 0.26 0.00 -0.85 -0.23 0.00 0.00 178.00 177.83 2chs n GLU 40 N -4.77 0.25 -0.42 0.86 0.00 -1.26 -2.19 120.64 113.11 2chs n GLU 40 Ca 0.28 0.10 0.10 0.00 0.00 0.00 0.00 57.16 57.64 2chs n GLU 40 Cb 0.92 -1.50 0.31 0.00 0.00 0.00 0.00 31.44 31.17 2chs n GLU 40 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 2chs n ASP 41 N -1.32 4.06 -4.63 -1.84 8.00 -0.67 -4.87 116.55 115.29 2chs n ASP 41 Ca 0.09 -2.17 -0.38 0.00 0.71 0.00 0.00 54.79 53.04 2chs n ASP 41 Cb 0.18 -0.48 -0.09 0.00 -0.02 0.00 0.00 41.12 40.71 2chs n ASP 41 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2chs s VAL 42 N -1.31 5.24 0.01 2.53 1.01 -0.93 -0.51 120.40 126.44 2chs s VAL 42 Ca 0.46 0.47 -0.20 0.00 0.00 0.00 0.00 61.98 62.71 2chs s VAL 42 Cb 0.26 -3.64 -0.20 0.00 0.00 0.00 0.00 36.38 32.80 2chs s VAL 42 CO 0.27 0.23 1.17 0.58 0.00 0.00 0.00 175.10 177.35 2chs h VAL 43 N 5.23 1.41 0.00 2.92 2.07 -1.19 -3.47 116.25 123.23 2chs h VAL 43 Ca -0.34 -1.85 0.00 0.00 0.82 0.00 0.00 66.70 65.32 2chs h VAL 43 Cb 1.17 2.37 0.00 0.00 -1.52 0.00 0.00 31.29 33.31 2chs h VAL 43 CO 0.65 0.54 0.00 0.00 0.02 0.00 0.00 177.57 178.78 2chs n GLN 44 N -4.32 0.00 -4.00 1.57 10.64 -1.23 -4.66 117.38 115.38 2chs n GLN 44 Ca -0.09 0.00 -0.13 0.00 -1.83 0.00 0.00 57.00 54.95 2chs n GLN 44 Cb 0.57 0.00 -0.14 0.00 -0.86 0.00 0.00 30.24 29.81 2chs n GLN 44 CO 0.00 0.00 0.00 1.41 -1.83 0.00 0.00 177.06 176.64 2chs s MET 45 N -2.00 0.22 -0.04 2.61 1.75 -0.17 -1.25 119.30 120.42 2chs s MET 45 Ca 0.00 -0.14 0.06 0.00 -1.25 0.00 0.00 55.69 54.36 2chs s MET 45 Cb 0.00 -0.18 -0.01 0.00 2.84 0.00 0.00 34.83 37.48 2chs s MET 45 CO 0.00 0.05 -0.23 -0.51 -0.65 0.00 0.00 175.02 173.67 2chs s LEU 46 N -0.20 2.03 -0.04 4.11 1.43 -0.47 -2.09 118.68 123.46 2chs s LEU 46 Ca -0.00 -0.45 0.04 0.00 -1.03 0.00 0.00 54.13 52.68 2chs s LEU 46 Cb -0.02 -1.24 -0.00 0.00 0.03 0.00 0.00 46.19 44.96 2chs s LEU 46 CO -0.00 0.25 -0.14 -0.76 0.23 0.00 0.00 176.35 175.93 2chs s LEU 47 N -0.29 1.87 0.11 1.79 1.43 -0.93 -0.88 118.68 121.78 2chs s LEU 47 Ca 0.02 -0.29 0.07 0.00 -1.03 0.00 0.00 54.13 52.89 2chs s LEU 47 Cb -0.11 -0.82 -0.04 0.00 0.03 0.00 0.00 46.19 45.25 2chs s LEU 47 CO 0.02 0.12 -0.16 -0.94 0.23 0.00 0.00 176.35 175.61 2chs s SER 48 N 0.09 2.17 -0.00 2.29 1.04 0.10 -1.82 113.70 117.56 2chs s SER 48 Ca -0.03 -0.74 0.04 0.00 0.48 0.00 0.00 55.95 55.69 2chs s SER 48 Cb -0.10 -0.10 -0.01 0.00 0.10 0.00 0.00 66.02 65.91 2chs s SER 48 CO 0.01 -0.06 -0.11 0.00 0.98 0.00 0.00 173.24 174.06 2chs s ALA 49 N -1.69 0.93 0.75 5.32 0.00 -1.00 -1.11 121.76 124.96 2chs s ALA 49 Ca 0.07 -0.52 -0.15 0.00 0.00 0.00 0.00 51.96 51.36 2chs s ALA 49 Cb -0.07 -0.22 0.05 0.00 0.00 0.00 0.00 23.12 22.88 2chs s ALA 49 CO 0.04 0.22 1.23 0.25 0.00 0.00 0.00 175.76 177.50 2chs n THR 50 N 2.67 3.06 0.73 0.00 -2.24 -0.61 -1.65 114.28 116.24 2chs n THR 50 Ca -0.14 -0.31 0.03 0.00 -2.27 0.00 0.00 64.05 61.35 2chs n THR 50 Cb 0.56 -1.30 0.16 0.00 -2.10 0.00 0.00 70.33 67.65 2chs n THR 50 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 2chs n PRO 51 N -2.80 0.37 -0.37 -0.78 -0.04 -1.26 -2.50 135.00 127.62 2chs n PRO 51 Ca 0.14 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.71 2chs n PRO 51 Cb 0.50 -1.23 0.31 0.00 -0.04 0.00 0.00 33.50 33.03 2chs n PRO 51 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2chs n ASP 52 N -0.73 3.76 -4.32 3.54 5.68 -1.26 -4.83 116.55 118.38 2chs n ASP 52 Ca 0.04 -2.04 -0.33 0.00 -0.50 0.00 0.00 54.79 51.97 2chs n ASP 52 Cb 0.02 -0.47 -0.15 0.00 -1.14 0.00 0.00 41.12 39.38 2chs n ASP 52 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 2chs s LEU 53 N -1.07 2.53 0.00 -2.12 1.43 -1.04 -4.84 118.68 113.57 2chs s LEU 53 Ca 0.46 -0.40 0.00 0.00 -1.03 0.00 0.00 54.13 53.16 2chs s LEU 53 Cb 0.25 -1.55 0.00 0.00 0.03 0.00 0.00 46.19 44.91 2chs s LEU 53 CO 0.31 0.15 0.00 1.41 0.23 0.00 0.00 176.35 178.45 2chs n HIS 54 N 3.59 0.00 -0.10 0.29 8.25 -1.26 -4.97 115.22 121.02 2chs n HIS 54 Ca -0.18 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.19 2chs n HIS 54 Cb 0.53 0.00 0.06 0.00 1.12 0.00 0.00 29.99 31.70 2chs n HIS 54 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2chs h ALA 55 N 0.00 0.80 -2.79 -1.41 0.00 -1.93 -3.47 119.26 110.46 2chs h ALA 55 Ca 0.00 -0.40 -0.04 0.00 0.00 0.00 0.00 54.91 54.47 2chs h ALA 55 Cb 0.07 -0.15 -0.13 0.00 0.00 0.00 0.00 17.79 17.58 2chs h ALA 55 CO 0.00 0.65 0.04 0.54 0.00 0.00 0.00 179.25 180.48 2chs s VAL 56 N -4.55 0.04 0.02 0.00 0.11 -1.26 -4.83 120.40 109.93 2chs s VAL 56 Ca -0.10 -0.33 -0.30 0.00 -2.93 0.00 0.00 61.98 58.33 2chs s VAL 56 Cb 0.13 -1.07 -0.04 0.00 -1.53 0.00 0.00 36.38 33.86 2chs s VAL 56 CO 0.85 -0.18 0.96 -0.36 -3.33 0.00 0.00 175.10 173.04 2chs s PHE 57 N -3.52 3.69 0.55 1.54 0.08 -1.26 -4.94 117.98 114.12 2chs s PHE 57 Ca 0.01 1.71 0.26 0.00 0.12 0.00 0.00 56.93 59.02 2chs s PHE 57 Cb 0.00 -3.09 1.46 0.00 -0.57 0.00 0.00 43.02 40.82 2chs s PHE 57 CO -0.10 0.05 2.01 -1.35 -0.10 0.00 0.00 175.22 175.73 2chs h PRO 58 N 6.50 0.00 -0.31 0.24 0.11 -1.96 -1.54 132.00 135.04 2chs h PRO 58 Ca -0.41 0.00 0.09 0.00 0.11 0.00 0.00 66.00 65.79 2chs h PRO 58 Cb 1.22 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 2chs h PRO 58 CO 0.74 0.00 0.29 0.00 -0.21 0.00 0.00 178.00 178.82 2chs h ALA 59 N 1.72 2.06 0.00 -0.75 0.00 -1.95 -0.80 119.26 119.53 2chs h ALA 59 Ca 0.20 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 2chs h ALA 59 Cb 0.87 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.69 2chs h ALA 59 CO -0.00 -0.45 -0.01 -0.22 0.00 0.00 0.00 179.25 178.57 2chs h LYS 60 N 0.00 0.00 0.00 0.00 3.64 -1.68 -1.77 116.57 116.75 2chs h LYS 60 Ca 0.15 0.00 -0.06 0.00 -1.27 0.00 0.00 60.65 59.47 2chs h LYS 60 Cb 0.73 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.54 2chs h LYS 60 CO -0.00 0.01 -0.30 0.00 -2.27 0.00 0.00 179.45 176.89 2chs h ALA 61 N 1.99 0.96 0.00 5.00 0.00 -1.36 -3.16 119.26 122.70 2chs h ALA 61 Ca -0.00 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.60 2chs h ALA 61 Cb 0.26 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 2chs h ALA 61 CO 0.00 0.37 -0.21 0.28 0.00 0.00 0.00 179.25 179.69 2chs h VAL 62 N 0.00 1.12 0.00 0.00 2.07 -1.48 -1.37 116.25 116.59 2chs h VAL 62 Ca -0.00 -0.73 0.00 0.00 0.82 0.00 0.00 66.70 66.79 2chs h VAL 62 Cb 0.88 1.39 0.00 0.00 -1.52 0.00 0.00 31.29 32.05 2chs h VAL 62 CO 0.04 0.21 0.00 0.03 0.02 0.00 0.00 177.57 177.86 2chs h ARG 63 N 0.00 0.00 0.00 1.57 3.08 -1.71 -2.56 114.38 114.76 2chs h ARG 63 Ca -0.00 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.03 2chs h ARG 63 Cb 0.38 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.42 2chs h ARG 63 CO 0.03 0.00 -0.10 0.93 -1.07 0.00 0.00 179.97 179.76 2chs h GLU 64 N 0.00 0.00 -5.83 0.04 5.08 -1.39 -3.42 114.58 109.06 2chs h GLU 64 Ca 0.00 0.00 -0.61 0.00 -1.00 0.00 0.00 59.36 57.75 2chs h GLU 64 Cb 0.62 0.00 -0.11 0.00 0.50 0.00 0.00 28.75 29.76 2chs h GLU 64 CO 0.00 0.10 0.41 -0.51 -1.00 0.00 0.00 179.01 178.01 2chs s LEU 65 N -6.43 4.11 -0.43 1.33 1.43 -0.96 -4.95 118.68 112.78 2chs s LEU 65 Ca 0.02 0.43 -0.33 0.00 -1.03 0.00 0.00 54.13 53.21 2chs s LEU 65 Cb 0.09 -3.07 -0.12 0.00 0.03 0.00 0.00 46.19 43.13 2chs s LEU 65 CO 0.60 -0.74 2.28 -1.20 0.23 0.00 0.00 176.35 177.52 2chs n SER 66 N 6.44 2.00 0.00 2.29 7.64 -1.26 -0.88 113.62 129.85 2chs n SER 66 Ca 0.04 0.25 0.00 0.00 1.01 0.00 0.00 58.87 60.17 2chs n SER 66 Cb 0.48 -1.28 0.00 0.00 -1.01 0.00 0.00 64.21 62.40 2chs n SER 66 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2chs n GLY 67 N 6.45 0.47 0.79 0.23 0.00 -1.26 -4.94 105.19 106.92 2chs n GLY 67 Ca 0.43 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.57 2chs n GLY 67 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2chs n TRP 68 N -1.44 0.00 0.00 1.61 7.02 -0.06 -4.59 117.44 119.99 2chs n TRP 68 Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.48 2chs n TRP 68 Cb 0.00 -0.00 0.00 0.00 -2.42 0.00 0.00 31.31 28.89 2chs n TRP 68 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2chs n GLN 69 N 0.90 0.00 -0.06 -0.99 0.00 -1.26 -1.89 117.38 114.08 2chs n GLN 69 Ca 0.14 0.33 0.04 0.00 0.00 0.00 0.00 57.00 57.51 2chs n GLN 69 Cb 0.53 -1.59 0.07 0.00 0.00 0.00 0.00 30.24 29.25 2chs n GLN 69 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 2chs n TYR 70 N -1.31 0.16 -2.13 2.61 4.01 -1.26 -4.99 117.16 114.25 2chs n TYR 70 Ca 0.00 -0.22 -0.43 0.00 -0.16 0.00 0.00 57.90 57.09 2chs n TYR 70 Cb 0.09 -0.01 -0.03 0.00 -0.31 0.00 0.00 39.34 39.08 2chs n TYR 70 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 2chs s VAL 71 N -0.84 3.78 0.06 -0.72 1.01 -0.79 -4.98 120.40 117.92 2chs s VAL 71 Ca 0.13 0.94 -0.30 0.00 0.00 0.00 0.00 61.98 62.75 2chs s VAL 71 Cb 0.08 -3.64 -0.09 0.00 0.00 0.00 0.00 36.38 32.73 2chs s VAL 71 CO 0.11 -0.12 1.90 -2.84 0.00 0.00 0.00 175.10 174.16 2chs s PRO 72 N 3.99 4.14 0.00 2.72 0.02 -1.26 -4.92 135.00 139.70 2chs s PRO 72 Ca 0.68 2.58 0.01 0.00 0.02 0.00 0.00 61.00 64.29 2chs s PRO 72 Cb -0.29 -3.97 -0.01 0.00 0.02 0.00 0.00 34.50 30.25 2chs s PRO 72 CO 0.26 -0.91 -0.02 0.14 -0.33 0.00 0.00 177.00 176.13 2chs s VAL 73 N 3.89 0.17 0.06 3.83 -7.23 -1.26 -0.99 120.40 118.87 2chs s VAL 73 Ca 0.85 -0.25 -0.13 0.00 -1.81 0.00 0.00 61.98 60.64 2chs s VAL 73 Cb -0.43 -0.18 0.02 0.00 0.56 0.00 0.00 36.38 36.35 2chs s VAL 73 CO 0.39 -0.05 0.30 0.28 -0.31 0.00 0.00 175.10 175.71 2chs s THR 74 N -0.31 0.09 0.43 5.32 -1.32 -0.89 -5.00 115.64 113.97 2chs s THR 74 Ca -0.02 -0.75 0.07 0.00 -1.21 0.00 0.00 61.69 59.79 2chs s THR 74 Cb -0.02 -1.04 -0.02 0.00 -1.51 0.00 0.00 72.50 69.90 2chs s THR 74 CO -0.00 -0.41 0.33 0.00 -2.21 0.00 0.00 174.62 172.32 2chs s MET 76 N -4.09 1.18 0.03 0.00 0.23 -0.76 -4.92 119.30 110.97 2chs s MET 76 Ca 0.44 -0.46 -0.18 0.00 -1.03 0.00 0.00 55.69 54.47 2chs s MET 76 Cb -0.01 0.53 -0.06 0.00 -1.53 0.00 0.00 34.83 33.76 2chs s MET 76 CO 0.26 -0.52 0.51 -1.14 -2.03 0.00 0.00 175.02 172.10 2chs s GLN 77 N -3.57 4.13 0.30 3.16 0.74 -1.26 -2.39 119.66 120.77 2chs s GLN 77 Ca 0.03 0.61 -0.19 0.00 0.05 0.00 0.00 55.36 55.86 2chs s GLN 77 Cb -0.01 -3.26 -0.09 0.00 1.10 0.00 0.00 33.01 30.75 2chs s GLN 77 CO -0.10 0.60 0.78 -2.00 -0.55 0.00 0.00 175.29 174.01 2chs s GLU 78 N -0.88 4.18 0.45 1.67 2.56 -0.66 -4.89 118.70 121.14 2chs s GLU 78 Ca 0.27 0.87 -0.23 0.00 0.00 0.00 0.00 54.97 55.88 2chs s GLU 78 Cb -0.18 -2.60 -0.08 0.00 2.00 0.00 0.00 34.13 33.27 2chs s GLU 78 CO 0.16 0.23 1.16 0.00 -0.56 0.00 0.00 175.26 176.26 2chs s MET 79 N -2.54 3.81 -0.57 4.30 0.23 -1.26 -4.56 119.30 118.71 2chs s MET 79 Ca 0.51 1.77 -0.23 0.00 -1.03 0.00 0.00 55.69 56.71 2chs s MET 79 Cb -0.13 -2.44 0.05 0.00 -1.53 0.00 0.00 34.83 30.78 2chs s MET 79 CO 0.19 -0.51 0.88 0.34 -2.03 0.00 0.00 175.02 173.89 2chs s ASP 80 N -1.34 6.27 -0.07 -1.18 2.15 -1.26 -4.93 116.67 116.31 2chs s ASP 80 Ca 0.63 -0.66 0.01 0.00 0.43 0.00 0.00 52.55 52.95 2chs s ASP 80 Cb -0.29 -2.40 -0.03 0.00 -0.30 0.00 0.00 42.92 39.91 2chs s ASP 80 CO 0.35 -1.22 -0.08 -0.69 -0.17 0.00 0.00 175.17 173.37 2chs s VAL 81 N 3.68 3.64 0.10 1.11 1.01 -1.26 -5.06 120.40 123.62 2chs s VAL 81 Ca 0.25 -0.50 -0.32 0.00 0.00 0.00 0.00 61.98 61.40 2chs s VAL 81 Cb -0.15 -2.48 -0.12 0.00 0.00 0.00 0.00 36.38 33.63 2chs s VAL 81 CO 0.15 0.60 1.79 0.41 0.00 0.00 0.00 175.10 178.05 2chs n THR 82 N 2.25 0.32 -0.98 3.92 -1.04 -1.26 -0.65 114.28 116.85 2chs n THR 82 Ca -0.18 -0.06 0.00 0.00 -2.04 0.00 0.00 64.05 61.77 2chs n THR 82 Cb 0.53 -1.96 0.00 0.00 -1.82 0.00 0.00 70.33 67.08 2chs n THR 82 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2chs n GLY 83 N 4.09 0.94 3.74 3.41 0.00 -1.26 -5.02 105.19 111.09 2chs n GLY 83 Ca 0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 2chs n GLY 83 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2chs s GLY 84 N -2.00 1.89 -0.05 -0.02 0.00 0.18 -4.91 107.32 102.41 2chs s GLY 84 Ca 0.00 0.49 -0.30 0.00 0.00 0.00 0.00 44.72 44.91 2chs s GLY 84 CO 0.00 0.86 1.45 -2.27 0.00 0.00 0.00 173.10 173.14 2chs s LEU 85 N -5.70 4.29 0.49 0.66 2.96 -1.26 -4.96 118.68 115.16 2chs s LEU 85 Ca 0.65 2.07 -0.18 0.00 -0.22 0.00 0.00 54.13 56.45 2chs s LEU 85 Cb -0.21 -3.55 -0.09 0.00 0.50 0.00 0.00 46.19 42.85 2chs s LEU 85 CO 0.51 -0.79 0.98 -0.54 -1.32 0.00 0.00 176.35 175.19 2chs s LYS 86 N 3.10 3.99 -1.38 1.98 -0.14 -1.26 -4.14 119.74 121.88 2chs s LYS 86 Ca 0.65 1.07 -0.02 0.00 -1.36 0.00 0.00 55.97 56.31 2chs s LYS 86 Cb -0.30 -2.14 0.00 0.00 -1.68 0.00 0.00 37.83 33.71 2chs s LYS 86 CO 0.25 -0.24 0.45 1.63 -0.76 0.00 0.00 175.35 176.68 2chs n LYS 87 N -1.22 -3.09 -4.64 1.68 5.02 -1.26 -4.81 118.16 109.85 2chs n LYS 87 Ca 0.07 0.40 -0.33 0.00 -2.02 0.00 0.00 58.31 56.43 2chs n LYS 87 Cb 0.54 -4.47 -0.12 0.00 -0.02 0.00 0.00 35.03 30.96 2chs n LYS 87 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2chs s ILE 89 N -0.19 2.50 0.25 0.00 1.01 -0.65 -1.57 121.20 122.55 2chs s ILE 89 Ca 0.02 -0.81 0.12 0.00 0.00 0.00 0.00 60.65 59.97 2chs s ILE 89 Cb -0.13 -2.06 -0.05 0.00 0.01 0.00 0.00 42.46 40.23 2chs s ILE 89 CO 0.03 0.51 -0.20 -0.13 0.00 0.00 0.00 174.94 175.15 2chs s ARG 90 N 1.04 1.67 0.01 2.79 0.52 -0.27 -1.56 118.95 123.16 2chs s ARG 90 Ca -0.01 -1.65 0.01 0.00 -0.52 0.00 0.00 55.73 53.55 2chs s ARG 90 Cb -0.15 -1.83 -0.01 0.00 0.52 0.00 0.00 34.95 33.49 2chs s ARG 90 CO -0.04 0.36 -0.03 0.54 0.02 0.00 0.00 175.30 176.14 2chs s VAL 91 N -2.19 0.22 -0.25 3.52 0.11 -0.60 -0.72 120.40 120.48 2chs s VAL 91 Ca 0.27 -0.51 0.00 0.00 -2.93 0.00 0.00 61.98 58.81 2chs s VAL 91 Cb -0.06 -0.26 0.07 0.00 -1.53 0.00 0.00 36.38 34.60 2chs s VAL 91 CO 0.13 -0.19 -0.00 -0.32 -3.33 0.00 0.00 175.10 171.39 2chs s MET 92 N -0.74 1.30 -0.19 1.54 1.75 -0.06 -2.43 119.30 120.47 2chs s MET 92 Ca -0.06 -1.01 -0.05 0.00 -1.25 0.00 0.00 55.69 53.32 2chs s MET 92 Cb -0.05 -2.47 -0.03 0.00 2.84 0.00 0.00 34.83 35.12 2chs s MET 92 CO -0.00 -0.71 0.01 1.41 -0.65 0.00 0.00 175.02 175.07 2chs s MET 93 N 1.45 3.70 -0.22 4.11 1.75 0.37 -1.37 119.30 129.08 2chs s MET 93 Ca -0.01 -0.49 -0.13 0.00 -1.25 0.00 0.00 55.69 53.82 2chs s MET 93 Cb -0.18 -3.08 -0.05 0.00 2.84 0.00 0.00 34.83 34.36 2chs s MET 93 CO -0.10 0.10 0.25 0.99 -0.65 0.00 0.00 175.02 175.61 2chs s THR 94 N 0.77 5.30 0.06 10.11 2.01 -0.38 -0.21 115.64 133.30 2chs s THR 94 Ca 0.01 0.38 -0.00 0.00 0.31 0.00 0.00 61.69 62.39 2chs s THR 94 Cb -0.14 -3.59 -0.04 0.00 0.01 0.00 0.00 72.50 68.74 2chs s THR 94 CO 0.02 0.31 -0.04 0.68 -0.69 0.00 0.00 174.62 174.90 2chs s VAL 95 N 1.13 0.37 -0.24 3.82 -7.23 -0.30 -0.63 120.40 117.32 2chs s VAL 95 Ca 0.12 -1.82 -0.17 0.00 -1.81 0.00 0.00 61.98 58.30 2chs s VAL 95 Cb -0.14 -1.54 -0.03 0.00 0.56 0.00 0.00 36.38 35.23 2chs s VAL 95 CO 0.06 -0.95 0.46 -1.58 -0.31 0.00 0.00 175.10 172.78 2chs s GLN 96 N -3.82 4.09 0.11 4.82 0.74 0.34 0.14 119.66 126.07 2chs s GLN 96 Ca 0.08 0.25 -0.22 0.00 0.05 0.00 0.00 55.36 55.52 2chs s GLN 96 Cb 0.07 -3.62 0.06 0.00 1.10 0.00 0.00 33.01 30.62 2chs s GLN 96 CO -0.08 -0.24 0.54 -0.08 -0.55 0.00 0.00 175.29 174.87 2chs s THR 97 N 1.96 0.02 -1.68 -0.34 -1.32 -0.26 -4.91 115.64 109.12 2chs s THR 97 Ca 0.20 -0.20 0.24 0.00 -1.21 0.00 0.00 61.69 60.72 2chs s THR 97 Cb -0.15 -1.03 0.06 0.00 -1.51 0.00 0.00 72.50 69.86 2chs s THR 97 CO 0.09 -0.11 1.26 0.47 -2.21 0.00 0.00 174.62 174.12 2chs n ASP 98 N -0.04 1.37 -4.73 8.08 9.92 -1.26 0.02 116.55 129.91 2chs n ASP 98 Ca -0.17 -1.09 -0.41 0.00 -0.53 0.00 0.00 54.79 52.58 2chs n ASP 98 Cb 0.63 0.41 -0.03 0.00 -0.64 0.00 0.00 41.12 41.49 2chs n ASP 98 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 2chs s VAL 99 N -2.62 3.71 0.70 2.53 1.01 -1.26 -4.88 120.40 119.59 2chs s VAL 99 Ca 0.18 1.38 -0.17 0.00 0.00 0.00 0.00 61.98 63.38 2chs s VAL 99 Cb 0.18 -3.88 0.01 0.00 0.00 0.00 0.00 36.38 32.68 2chs s VAL 99 CO 0.61 0.19 1.14 -0.81 0.00 0.00 0.00 175.10 176.24 2chs n PRO 100 N 2.85 0.73 -0.28 2.72 -0.04 -1.26 -4.87 135.00 134.85 2chs n PRO 100 Ca 0.05 0.31 0.06 0.00 -0.04 0.00 0.00 63.50 63.88 2chs n PRO 100 Cb 0.45 -2.38 0.20 0.00 -0.04 0.00 0.00 33.50 31.74 2chs n PRO 100 CO 0.00 0.00 0.00 0.37 -0.04 0.00 0.00 175.50 175.83 2chs h GLN 101 N 0.02 0.57 0.00 0.54 4.15 -1.98 0.50 115.11 118.91 2chs h GLN 101 Ca -0.49 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 58.90 2chs h GLN 101 Cb 1.33 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 28.89 2chs h GLN 101 CO 0.50 0.38 0.00 0.38 -1.93 0.00 0.00 178.83 178.15 2chs h ASP 102 N 0.59 0.00 -0.16 -0.69 2.03 -2.03 -3.02 116.42 113.14 2chs h ASP 102 Ca 0.44 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.74 2chs h ASP 102 Cb 0.60 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.10 2chs h ASP 102 CO -0.35 0.00 0.00 0.00 -1.03 0.00 0.00 179.24 177.86 2chs n GLN 103 N -2.97 1.70 -1.90 4.15 6.02 0.15 -4.95 117.38 119.58 2chs n GLN 103 Ca 0.00 -1.71 -0.41 0.00 -0.01 0.00 0.00 57.00 54.87 2chs n GLN 103 Cb 0.24 -1.33 -0.01 0.00 1.02 0.00 0.00 30.24 30.16 2chs n GLN 103 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2chs s ILE 104 N -1.24 2.33 -0.42 5.09 -1.09 -1.13 -4.96 121.20 119.78 2chs s ILE 104 Ca 0.23 0.30 -0.11 0.00 -2.23 0.00 0.00 60.65 58.84 2chs s ILE 104 Cb 0.15 -3.19 0.06 0.00 -1.58 0.00 0.00 42.46 37.90 2chs s ILE 104 CO 0.21 0.06 0.28 -0.13 -1.23 0.00 0.00 174.94 174.13 2chs s ARG 105 N -1.17 2.76 0.27 2.79 0.52 -1.26 -5.07 118.95 117.80 2chs s ARG 105 Ca 0.57 -1.33 -0.17 0.00 -0.52 0.00 0.00 55.73 54.28 2chs s ARG 105 Cb -0.44 -3.86 -0.09 0.00 0.52 0.00 0.00 34.95 31.08 2chs s ARG 105 CO 0.52 -0.90 0.73 -1.01 0.02 0.00 0.00 175.30 174.66 2chs s HIS 106 N 1.52 3.51 -0.10 -0.53 3.76 -1.26 -4.84 115.29 117.35 2chs s HIS 106 Ca 0.03 1.31 0.02 0.00 -0.15 0.00 0.00 55.06 56.27 2chs s HIS 106 Cb -0.22 -2.58 0.01 0.00 1.11 0.00 0.00 32.58 30.90 2chs s HIS 106 CO 0.05 0.22 -0.16 0.08 -0.85 0.00 0.00 174.74 174.07 2chs s VAL 107 N -1.75 1.54 -0.16 -0.90 1.01 -0.33 -4.99 120.40 114.82 2chs s VAL 107 Ca 0.48 -0.68 0.00 0.00 0.00 0.00 0.00 61.98 61.79 2chs s VAL 107 Cb -0.13 -1.40 0.03 0.00 0.00 0.00 0.00 36.38 34.88 2chs s VAL 107 CO 0.19 0.45 -0.12 -0.31 0.00 0.00 0.00 175.10 175.31 2chs s TYR 108 N 0.87 2.15 0.40 5.22 1.51 -1.26 -1.22 117.35 125.01 2chs s TYR 108 Ca -0.09 -1.27 0.05 0.00 -1.01 0.00 0.00 57.07 54.76 2chs s TYR 108 Cb -0.15 -1.56 -0.07 0.00 -0.11 0.00 0.00 41.96 40.07 2chs s TYR 108 CO 0.00 -0.67 0.03 -0.51 -1.11 0.00 0.00 175.55 173.28 2chs s LEU 109 N 1.49 2.59 0.00 -1.29 1.43 -0.43 -4.50 118.68 117.98 2chs s LEU 109 Ca 0.03 -1.41 0.00 0.00 -1.03 0.00 0.00 54.13 51.72 2chs s LEU 109 Cb -0.14 -0.71 0.00 0.00 0.03 0.00 0.00 46.19 45.37 2chs s LEU 109 CO -0.10 -0.55 0.00 -0.62 0.23 0.00 0.00 176.35 175.31 2chs n GLU 110 N -0.92 0.00 0.03 1.70 -0.58 -1.26 -2.18 120.64 117.43 2chs n GLU 110 Ca -0.06 0.00 0.13 0.00 -0.42 0.00 0.00 57.16 56.81 2chs n GLU 110 Cb 0.67 0.00 0.53 0.00 -0.57 0.00 0.00 31.44 32.07 2chs n GLU 110 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2chs n LYS 111 N 14.00 0.06 0.00 3.49 4.76 -1.26 -3.06 118.16 136.15 2chs n LYS 111 Ca 0.00 0.10 0.07 0.00 -2.87 0.00 0.00 58.31 55.61 2chs n LYS 111 Cb 0.00 -1.58 0.38 0.00 -1.84 0.00 0.00 35.03 31.99 2chs n LYS 111 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2chs n ALA 112 N -1.57 1.88 0.28 7.82 0.00 -0.92 -3.27 120.51 124.73 2chs n ALA 112 Ca 0.06 -0.07 0.12 0.00 0.00 0.00 0.00 53.44 53.55 2chs n ALA 112 Cb 0.33 -1.24 0.66 0.00 0.00 0.00 0.00 19.45 19.21 2chs n ALA 112 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 2chs h VAL 113 N 0.00 0.00 -1.16 0.00 -1.51 -1.62 -2.68 116.25 109.28 2chs h VAL 113 Ca 0.00 0.00 -0.61 0.00 -1.23 0.00 0.00 66.70 64.86 2chs h VAL 113 Cb 0.10 0.54 -0.24 0.00 -2.13 0.00 0.00 31.29 29.56 2chs h VAL 113 CO 0.00 0.00 0.77 0.55 -1.23 0.00 0.00 177.57 177.66 2chs n VAL 114 N -2.62 3.42 -0.68 7.19 3.14 -1.20 -5.05 118.33 122.53 2chs n VAL 114 Ca -0.02 -3.04 0.00 0.00 -2.96 0.00 0.00 64.34 58.32 2chs n VAL 114 Cb 0.36 -1.27 0.00 0.00 -1.06 0.00 0.00 33.84 31.87 2chs n VAL 114 CO 0.00 0.00 0.00 0.18 -6.46 0.00 0.00 176.83 170.55