#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cht s ILE 3 N 0.00 2.82 0.11 1.12 1.09 -1.26 -1.09 121.20 123.99 2cht s ILE 3 Ca 0.00 -0.78 0.04 0.00 -1.10 0.00 0.00 60.65 58.81 2cht s ILE 3 Cb 0.00 -2.12 -0.04 0.00 -1.06 0.00 0.00 42.46 39.24 2cht s ILE 3 CO 0.00 0.56 -0.10 -0.13 -0.10 0.00 0.00 174.94 175.17 2cht s ARG 4 N -0.22 0.90 -0.03 2.79 1.81 0.95 -4.92 118.95 120.22 2cht s ARG 4 Ca 0.00 -1.23 -0.03 0.00 -1.72 0.00 0.00 55.73 52.75 2cht s ARG 4 Cb -0.13 -0.56 -0.04 0.00 -0.45 0.00 0.00 34.95 33.76 2cht s ARG 4 CO 0.03 0.08 0.14 0.20 -0.68 0.00 0.00 175.30 175.08 2cht s GLY 5 N -2.60 2.13 -0.28 -3.53 0.00 -1.26 0.12 107.32 101.89 2cht s GLY 5 Ca 0.08 -0.76 0.02 0.00 0.00 0.00 0.00 44.72 44.06 2cht s GLY 5 CO 0.00 -0.61 -0.07 -0.42 0.00 0.00 0.00 173.10 172.00 2cht s ILE 6 N -1.22 2.33 0.65 0.90 1.01 0.15 -4.96 121.20 120.08 2cht s ILE 6 Ca 0.23 -1.69 -0.13 0.00 0.00 0.00 0.00 60.65 59.06 2cht s ILE 6 Cb -0.12 -2.42 -0.01 0.00 0.01 0.00 0.00 42.46 39.92 2cht s ILE 6 CO 0.14 -0.12 1.06 -0.13 0.00 0.00 0.00 174.94 175.88 2cht s ARG 7 N 1.10 3.10 0.06 2.79 1.81 -1.26 -1.55 118.95 124.99 2cht s ARG 7 Ca -0.06 1.04 -0.26 0.00 -1.72 0.00 0.00 55.73 54.73 2cht s ARG 7 Cb -0.20 -2.01 0.08 0.00 -0.45 0.00 0.00 34.95 32.38 2cht s ARG 7 CO -0.05 -0.98 0.72 0.20 -0.68 0.00 0.00 175.30 174.52 2cht s GLY 8 N -3.42 -0.54 0.02 -3.53 0.00 -1.16 -2.44 107.32 96.25 2cht s GLY 8 Ca 0.60 0.87 -0.28 0.00 0.00 0.00 0.00 44.72 45.91 2cht s GLY 8 CO 0.48 0.39 0.67 0.00 0.00 0.00 0.00 173.10 174.64 2cht s ALA 9 N -3.01 -1.72 0.24 3.20 0.00 -0.02 -1.36 121.76 119.09 2cht s ALA 9 Ca 0.00 1.03 -0.22 0.00 0.00 0.00 0.00 51.96 52.77 2cht s ALA 9 Cb -0.01 0.29 0.03 0.00 0.00 0.00 0.00 23.12 23.44 2cht s ALA 9 CO -0.07 -0.52 0.77 -0.08 0.00 0.00 0.00 175.76 175.86 2cht s THR 10 N -2.14 0.00 0.14 0.00 -1.32 -0.59 -0.77 115.64 110.95 2cht s THR 10 Ca -0.06 -0.88 0.05 0.00 -1.21 0.00 0.00 61.69 59.59 2cht s THR 10 Cb -0.00 -1.96 -0.04 0.00 -1.51 0.00 0.00 72.50 68.98 2cht s THR 10 CO 0.01 0.00 -0.11 0.42 -2.21 0.00 0.00 174.62 172.73 2cht s THR 11 N -3.76 1.21 0.19 5.08 -4.23 -1.26 -1.20 115.64 111.67 2cht s THR 11 Ca 0.11 -1.91 0.11 0.00 -1.18 0.00 0.00 61.69 58.82 2cht s THR 11 Cb -0.05 -1.70 -0.04 0.00 1.34 0.00 0.00 72.50 72.05 2cht s THR 11 CO 0.05 -0.62 -0.21 0.68 -0.54 0.00 0.00 174.62 173.98 2cht s VAL 12 N -2.85 2.53 -0.03 2.29 -7.23 0.10 -4.88 120.40 110.34 2cht s VAL 12 Ca 0.13 -1.95 -0.22 0.00 -1.81 0.00 0.00 61.98 58.13 2cht s VAL 12 Cb -0.00 -2.22 -0.24 0.00 0.56 0.00 0.00 36.38 34.48 2cht s VAL 12 CO 0.02 -0.11 1.06 -0.08 -0.31 0.00 0.00 175.10 175.67 2cht h GLU 13 N 3.15 0.28 -5.24 4.82 4.57 -1.96 -3.46 114.58 116.75 2cht h GLU 13 Ca -0.46 -0.30 -0.38 0.00 -1.18 0.00 0.00 59.36 57.03 2cht h GLU 13 Cb 1.21 0.09 -0.19 0.00 -0.16 0.00 0.00 28.75 29.69 2cht h GLU 13 CO 0.49 1.01 -0.76 1.03 -1.18 0.00 0.00 179.01 179.60 2cht s ARG 14 N -3.15 0.88 -1.14 1.92 0.52 -1.26 -5.07 118.95 111.66 2cht s ARG 14 Ca -0.15 -1.10 -0.20 0.00 -0.52 0.00 0.00 55.73 53.77 2cht s ARG 14 Cb 0.02 -0.75 0.07 0.00 0.52 0.00 0.00 34.95 34.81 2cht s ARG 14 CO 0.78 0.15 1.54 0.34 0.02 0.00 0.00 175.30 178.12 2cht s ASP 15 N -2.16 6.68 0.26 0.23 2.15 -1.26 -4.68 116.67 117.89 2cht s ASP 15 Ca 0.03 -1.99 0.06 0.00 0.43 0.00 0.00 52.55 51.09 2cht s ASP 15 Cb -0.06 -2.55 -0.06 0.00 -0.30 0.00 0.00 42.92 39.95 2cht s ASP 15 CO 0.02 -1.29 -0.06 0.42 -0.17 0.00 0.00 175.17 174.08 2cht s THR 16 N 4.29 1.57 0.09 1.71 -4.23 -1.26 -4.82 115.64 113.00 2cht s THR 16 Ca 0.48 -2.12 -0.25 0.00 -1.18 0.00 0.00 61.69 58.62 2cht s THR 16 Cb 0.01 -2.37 -0.15 0.00 1.34 0.00 0.00 72.50 71.33 2cht s THR 16 CO -0.02 -0.35 1.72 -0.08 -0.54 0.00 0.00 174.62 175.35 2cht h GLU 17 N 2.35 -0.17 -0.65 3.99 4.81 -1.93 -2.98 114.58 119.99 2cht h GLU 17 Ca -0.39 0.01 0.13 0.00 -0.13 0.00 0.00 59.36 58.97 2cht h GLU 17 Cb 1.23 0.04 -0.13 0.00 0.63 0.00 0.00 28.75 30.52 2cht h GLU 17 CO 0.66 -0.11 -0.24 1.49 -0.73 0.00 0.00 179.01 180.08 2cht h GLU 18 N -0.18 -0.06 -0.28 1.92 4.81 -1.96 -1.29 114.58 117.54 2cht h GLU 18 Ca -0.01 0.00 -0.08 0.00 -0.13 0.00 0.00 59.36 59.14 2cht h GLU 18 Cb 0.14 0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.53 2cht h GLU 18 CO 0.02 -0.04 -0.14 0.93 -0.73 0.00 0.00 179.01 179.05 2cht h GLU 19 N -0.07 0.59 -0.28 1.92 5.08 -1.85 -1.71 114.58 118.25 2cht h GLU 19 Ca 0.29 -0.26 0.01 0.00 -1.00 0.00 0.00 59.36 58.40 2cht h GLU 19 Cb 0.53 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.74 2cht h GLU 19 CO -0.70 0.83 0.17 0.82 -1.00 0.00 0.00 179.01 179.13 2cht h ILE 20 N 0.33 1.05 -0.44 3.13 2.04 -1.11 0.27 117.51 122.78 2cht h ILE 20 Ca 0.06 -0.12 -0.03 0.00 1.00 0.00 0.00 64.86 65.77 2cht h ILE 20 Cb 0.65 0.66 -0.02 0.00 -0.74 0.00 0.00 36.82 37.38 2cht h ILE 20 CO 0.04 0.06 0.15 -0.07 0.00 0.00 0.00 178.15 178.33 2cht h LEU 21 N 0.35 0.62 -0.17 1.44 3.38 -1.34 -0.29 115.31 119.30 2cht h LEU 21 Ca 0.11 -0.19 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 2cht h LEU 21 Cb -0.02 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 2cht h LEU 21 CO -0.04 0.65 0.08 -0.61 0.09 0.00 0.00 178.44 178.61 2cht h GLN 22 N 0.56 0.25 0.00 1.13 4.15 -0.88 -0.53 115.11 119.79 2cht h GLN 22 Ca 0.14 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.53 2cht h GLN 22 Cb 0.24 -0.04 0.00 0.00 0.21 0.00 0.00 27.48 27.89 2cht h GLN 22 CO -0.01 0.29 0.00 0.87 -1.93 0.00 0.00 178.83 178.05 2cht h LYS 23 N 0.15 0.00 0.04 1.69 1.79 -0.86 -2.47 116.57 116.91 2cht h LYS 23 Ca 0.06 0.00 -0.22 0.00 -2.18 0.00 0.00 60.65 58.31 2cht h LYS 23 Cb 0.12 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.76 2cht h LYS 23 CO -0.01 0.00 -1.01 1.15 -1.08 0.00 0.00 179.45 178.50 2cht h THR 24 N 0.00 1.55 -0.42 -0.16 2.02 -0.68 -2.55 112.91 112.67 2cht h THR 24 Ca 0.00 -2.93 -0.11 0.00 0.77 0.00 0.00 66.41 64.14 2cht h THR 24 Cb 0.90 2.69 -0.01 0.00 -1.74 0.00 0.00 68.15 69.99 2cht h THR 24 CO 0.00 0.85 -0.16 0.50 0.37 0.00 0.00 175.52 177.08 2cht h LYS 25 N 0.07 0.84 0.56 6.66 3.64 -0.88 -1.04 116.57 126.43 2cht h LYS 25 Ca -0.06 -0.35 -0.02 0.00 -1.27 0.00 0.00 60.65 58.94 2cht h LYS 25 Cb 1.70 -0.03 0.00 0.00 -0.41 0.00 0.00 32.23 33.48 2cht h LYS 25 CO 0.15 0.98 -0.29 1.96 -2.27 0.00 0.00 179.45 179.98 2cht h GLN 26 N 0.66 -0.76 -0.40 1.90 4.20 -1.47 -0.86 115.11 118.38 2cht h GLN 26 Ca 0.10 0.05 0.08 0.00 0.06 0.00 0.00 58.65 58.94 2cht h GLN 26 Cb 0.71 0.17 -0.09 0.00 0.30 0.00 0.00 27.48 28.57 2cht h GLN 26 CO 0.05 -0.51 -0.30 1.25 -0.67 0.00 0.00 178.83 178.66 2cht h LEU 27 N -0.79 -1.00 -0.35 1.46 5.85 -1.31 -0.33 115.31 118.85 2cht h LEU 27 Ca -0.07 0.18 0.04 0.00 0.84 0.00 0.00 57.88 58.87 2cht h LEU 27 Cb 0.62 0.48 -0.04 0.00 0.37 0.00 0.00 40.66 42.09 2cht h LEU 27 CO 0.10 -0.30 0.12 -0.07 -0.34 0.00 0.00 178.44 177.95 2cht h LEU 28 N -0.23 0.13 -1.07 2.25 3.38 -1.08 -1.80 115.31 116.88 2cht h LEU 28 Ca 0.18 0.04 -0.03 0.00 0.09 0.00 0.00 57.88 58.16 2cht h LEU 28 Cb 0.52 0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.26 2cht h LEU 28 CO -0.53 0.11 0.32 -0.33 0.09 0.00 0.00 178.44 178.10 2cht h GLU 29 N 0.27 0.98 -0.14 1.13 5.08 -0.19 -0.09 114.58 121.61 2cht h GLU 29 Ca 0.16 -0.14 -0.08 0.00 -1.00 0.00 0.00 59.36 58.30 2cht h GLU 29 Cb 0.14 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 2cht h GLU 29 CO -0.17 0.76 -0.29 -0.22 -1.00 0.00 0.00 179.01 178.10 2cht h LYS 30 N 0.97 0.27 0.15 2.33 1.63 -0.62 -1.47 116.57 119.82 2cht h LYS 30 Ca 0.24 -0.10 -0.01 0.00 -0.85 0.00 0.00 60.65 59.93 2cht h LYS 30 Cb 0.11 -0.02 0.00 0.00 -0.60 0.00 0.00 32.23 31.73 2cht h LYS 30 CO -0.03 0.54 -0.07 0.82 -3.45 0.00 0.00 179.45 177.26 2cht h ILE 31 N 0.24 1.00 -0.74 2.00 2.04 -0.30 -1.14 117.51 120.61 2cht h ILE 31 Ca 0.03 -0.84 0.08 0.00 1.00 0.00 0.00 64.86 65.13 2cht h ILE 31 Cb 0.64 1.51 -0.07 0.00 -0.74 0.00 0.00 36.82 38.16 2cht h ILE 31 CO 0.05 0.19 0.40 0.40 0.00 0.00 0.00 178.15 179.19 2cht h ILE 32 N -0.62 0.91 0.72 -0.67 2.04 -0.95 0.51 117.51 119.45 2cht h ILE 32 Ca -0.02 -0.24 -0.04 0.00 1.00 0.00 0.00 64.86 65.56 2cht h ILE 32 Cb 0.47 0.15 0.01 0.00 -0.74 0.00 0.00 36.82 36.70 2cht h ILE 32 CO 0.03 0.13 -0.35 -0.08 0.00 0.00 0.00 178.15 177.89 2cht h GLU 33 N 0.70 -0.93 -0.05 2.37 4.81 -1.32 0.63 114.58 120.80 2cht h GLU 33 Ca 0.35 0.06 0.01 0.00 -0.13 0.00 0.00 59.36 59.66 2cht h GLU 33 Cb 0.30 0.21 -0.00 0.00 0.63 0.00 0.00 28.75 29.89 2cht h GLU 33 CO -0.23 -0.62 0.23 0.93 -0.73 0.00 0.00 179.01 178.58 2cht h GLU 34 N -1.22 0.00 0.00 1.92 3.07 -0.60 -2.46 114.58 115.28 2cht h GLU 34 Ca -0.10 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.76 2cht h GLU 34 Cb 0.74 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.65 2cht h GLU 34 CO 0.16 0.00 0.00 0.09 -1.40 0.00 0.00 179.01 177.86 2cht n ASN 35 N -3.10 0.53 -3.96 1.42 3.02 0.12 -4.72 115.26 108.56 2cht n ASN 35 Ca -0.01 -0.89 -0.31 0.00 -0.03 0.00 0.00 54.58 53.34 2cht n ASN 35 Cb 0.30 0.10 0.02 0.00 -0.61 0.00 0.00 39.78 39.58 2cht n ASN 35 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 2cht n HIS 36 N -0.10 -2.17 -2.09 3.10 8.25 0.22 -4.93 115.22 117.49 2cht n HIS 36 Ca 0.00 0.88 -0.42 0.00 -0.26 0.00 0.00 57.72 57.92 2cht n HIS 36 Cb 0.08 -3.83 -0.03 0.00 1.12 0.00 0.00 29.99 27.33 2cht n HIS 36 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 2cht s THR 37 N -3.34 3.10 -0.13 1.59 2.01 -0.95 -5.03 115.64 112.88 2cht s THR 37 Ca 0.62 0.78 -0.07 0.00 0.31 0.00 0.00 61.69 63.33 2cht s THR 37 Cb -0.32 -3.50 -0.04 0.00 0.01 0.00 0.00 72.50 68.65 2cht s THR 37 CO 0.85 0.06 0.13 -0.54 -0.69 0.00 0.00 174.62 174.43 2cht s LYS 38 N 1.17 3.50 0.63 4.92 -0.14 -1.26 -4.95 119.74 123.61 2cht s LYS 38 Ca 0.66 -0.16 0.35 0.00 -1.36 0.00 0.00 55.97 55.46 2cht s LYS 38 Cb -0.39 -3.20 1.96 0.00 -1.68 0.00 0.00 37.83 34.53 2cht s LYS 38 CO 0.30 0.72 2.21 -1.00 -0.76 0.00 0.00 175.35 176.82 2cht h PRO 39 N 5.19 0.00 -0.00 -1.68 0.13 -1.94 0.91 132.00 134.60 2cht h PRO 39 Ca -0.53 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.60 2cht h PRO 39 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2cht h PRO 39 CO 0.60 0.00 -0.05 -0.85 -0.23 0.00 0.00 178.00 177.46 2cht n GLU 40 N -3.45 0.98 -0.06 0.86 0.00 -1.26 -3.03 120.64 114.68 2cht n GLU 40 Ca -0.02 -0.32 0.12 0.00 0.00 0.00 0.00 57.16 56.94 2cht n GLU 40 Cb 0.19 -1.49 0.16 0.00 0.00 0.00 0.00 31.44 30.29 2cht n GLU 40 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 2cht n ASP 41 N -0.73 3.07 -4.60 -1.84 8.00 0.31 -4.88 116.55 115.88 2cht n ASP 41 Ca 0.18 -1.97 -0.41 0.00 0.71 0.00 0.00 54.79 53.30 2cht n ASP 41 Cb 0.25 -0.08 -0.07 0.00 -0.02 0.00 0.00 41.12 41.20 2cht n ASP 41 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2cht s VAL 42 N -1.84 4.99 0.08 2.53 1.01 -1.17 -0.66 120.40 125.34 2cht s VAL 42 Ca 0.32 0.81 -0.21 0.00 0.00 0.00 0.00 61.98 62.89 2cht s VAL 42 Cb 0.21 -3.93 -0.12 0.00 0.00 0.00 0.00 36.38 32.54 2cht s VAL 42 CO 0.31 -0.07 1.61 0.58 0.00 0.00 0.00 175.10 177.53 2cht h VAL 43 N 5.50 1.15 -1.91 2.92 2.07 -0.21 -3.46 116.25 122.32 2cht h VAL 43 Ca -0.28 -0.45 0.41 0.00 0.82 0.00 0.00 66.70 67.20 2cht h VAL 43 Cb 1.13 1.22 -0.09 0.00 -1.52 0.00 0.00 31.29 32.03 2cht h VAL 43 CO 0.77 0.14 1.02 0.00 0.02 0.00 0.00 177.57 179.51 2cht s GLN 44 N -5.54 0.03 -0.05 1.57 -2.07 -1.16 -4.53 119.66 107.90 2cht s GLN 44 Ca -0.14 -0.02 -0.02 0.00 -1.82 0.00 0.00 55.36 53.36 2cht s GLN 44 Cb 0.06 0.01 0.03 0.00 -1.09 0.00 0.00 33.01 32.02 2cht s GLN 44 CO 0.69 -0.01 0.11 1.41 -1.32 0.00 0.00 175.29 176.17 2cht s MET 45 N -2.00 0.07 0.16 9.60 1.75 0.59 -0.91 119.30 128.55 2cht s MET 45 Ca 0.31 0.27 0.07 0.00 -1.25 0.00 0.00 55.69 55.08 2cht s MET 45 Cb 0.01 -0.13 -0.04 0.00 2.84 0.00 0.00 34.83 37.51 2cht s MET 45 CO -0.03 -0.12 0.01 -0.51 -0.65 0.00 0.00 175.02 173.72 2cht s LEU 46 N 0.84 3.39 -0.10 4.11 1.43 -0.51 -2.41 118.68 125.43 2cht s LEU 46 Ca -0.07 -0.33 -0.04 0.00 -1.03 0.00 0.00 54.13 52.66 2cht s LEU 46 Cb -0.09 -2.05 0.05 0.00 0.03 0.00 0.00 46.19 44.13 2cht s LEU 46 CO -0.04 0.10 0.21 -0.76 0.23 0.00 0.00 176.35 176.09 2cht s LEU 47 N -2.86 0.22 0.45 1.79 1.43 -0.66 -1.81 118.68 117.24 2cht s LEU 47 Ca 0.27 0.45 0.08 0.00 -1.03 0.00 0.00 54.13 53.90 2cht s LEU 47 Cb -0.10 0.56 0.00 0.00 0.03 0.00 0.00 46.19 46.68 2cht s LEU 47 CO 0.19 -0.19 0.44 -0.94 0.23 0.00 0.00 176.35 176.08 2cht s SER 48 N 1.71 5.07 -0.05 2.29 1.04 -0.20 -0.47 113.70 123.09 2cht s SER 48 Ca -0.04 -0.79 -0.13 0.00 0.48 0.00 0.00 55.95 55.47 2cht s SER 48 Cb -0.11 -0.37 0.02 0.00 0.10 0.00 0.00 66.02 65.66 2cht s SER 48 CO -0.07 -0.79 0.30 0.00 0.98 0.00 0.00 173.24 173.65 2cht s ALA 49 N -2.52 -0.74 0.90 5.32 0.00 -1.08 -2.71 121.76 120.93 2cht s ALA 49 Ca 0.48 0.50 -0.10 0.00 0.00 0.00 0.00 51.96 52.84 2cht s ALA 49 Cb -0.04 -0.15 0.14 0.00 0.00 0.00 0.00 23.12 23.07 2cht s ALA 49 CO 0.29 -0.21 1.14 0.95 0.00 0.00 0.00 175.76 177.92 2cht s THR 50 N -0.77 2.24 -1.86 0.00 -4.23 -0.91 -1.15 115.64 108.97 2cht s THR 50 Ca -0.09 0.08 0.00 0.00 -1.18 0.00 0.00 61.69 60.50 2cht s THR 50 Cb -0.04 -2.17 0.00 0.00 1.34 0.00 0.00 72.50 71.63 2cht s THR 50 CO 0.03 -0.10 0.52 -0.81 -0.54 0.00 0.00 174.62 173.71 2cht n PRO 51 N -4.15 0.56 0.00 3.99 -0.04 -1.26 -2.70 135.00 131.39 2cht n PRO 51 Ca 0.11 0.00 0.07 0.00 -0.04 0.00 0.00 63.50 63.64 2cht n PRO 51 Cb 0.52 -1.04 0.05 0.00 -0.04 0.00 0.00 33.50 33.00 2cht n PRO 51 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 2cht n ASP 52 N -0.40 2.12 -4.52 3.54 5.68 -1.26 -4.90 116.55 116.82 2cht n ASP 52 Ca 0.00 -1.56 -0.34 0.00 -0.50 0.00 0.00 54.79 52.39 2cht n ASP 52 Cb 0.02 0.06 -0.12 0.00 -1.14 0.00 0.00 41.12 39.94 2cht n ASP 52 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 2cht s LEU 53 N -1.29 3.17 0.00 -2.12 1.43 -1.10 -4.91 118.68 113.87 2cht s LEU 53 Ca 0.16 -0.11 0.00 0.00 -1.03 0.00 0.00 54.13 53.16 2cht s LEU 53 Cb 0.12 -1.73 0.00 0.00 0.03 0.00 0.00 46.19 44.61 2cht s LEU 53 CO 0.20 0.24 0.01 1.41 0.23 0.00 0.00 176.35 178.44 2cht n HIS 54 N 3.05 0.00 0.04 0.29 8.25 -1.26 -4.93 115.22 120.66 2cht n HIS 54 Ca -0.18 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.09 2cht n HIS 54 Cb 0.53 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.54 2cht n HIS 54 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2cht h ALA 55 N 0.00 0.15 -2.94 -1.41 0.00 -1.88 -3.47 119.26 109.71 2cht h ALA 55 Ca 0.00 -0.69 0.02 0.00 0.00 0.00 0.00 54.91 54.24 2cht h ALA 55 Cb 0.51 0.05 -0.07 0.00 0.00 0.00 0.00 17.79 18.28 2cht h ALA 55 CO 0.00 0.69 0.11 0.54 0.00 0.00 0.00 179.25 180.59 2cht s VAL 56 N -3.35 0.00 -0.25 0.00 0.11 -1.26 -4.71 120.40 110.94 2cht s VAL 56 Ca -0.10 -1.07 -0.17 0.00 -2.93 0.00 0.00 61.98 57.72 2cht s VAL 56 Cb 0.07 -1.99 -0.03 0.00 -1.53 0.00 0.00 36.38 32.90 2cht s VAL 56 CO 0.92 -0.01 0.46 -0.36 -3.33 0.00 0.00 175.10 172.77 2cht s PHE 57 N -3.94 3.28 0.34 1.54 0.08 -1.26 -4.96 117.98 113.06 2cht s PHE 57 Ca 0.14 0.57 0.14 0.00 0.12 0.00 0.00 56.93 57.90 2cht s PHE 57 Cb -0.04 -2.65 1.09 0.00 -0.57 0.00 0.00 43.02 40.85 2cht s PHE 57 CO 0.06 -0.22 1.65 -1.35 -0.10 0.00 0.00 175.22 175.26 2cht h PRO 58 N 7.95 0.26 -0.33 0.24 0.11 -1.94 0.40 132.00 138.69 2cht h PRO 58 Ca -0.31 -0.02 0.10 0.00 0.11 0.00 0.00 66.00 65.88 2cht h PRO 58 Cb 1.15 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 2cht h PRO 58 CO 0.69 0.17 0.57 0.00 -0.21 0.00 0.00 178.00 179.23 2cht h ALA 59 N 1.87 1.98 0.00 -0.75 0.00 -1.95 0.44 119.26 120.85 2cht h ALA 59 Ca 0.73 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.59 2cht h ALA 59 Cb 1.69 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.50 2cht h ALA 59 CO -0.64 -0.74 -0.21 -0.22 0.00 0.00 0.00 179.25 177.44 2cht h LYS 60 N 0.00 0.00 0.00 0.00 3.64 -1.32 -2.21 116.57 116.67 2cht h LYS 60 Ca 0.16 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.52 2cht h LYS 60 Cb 1.30 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 33.12 2cht h LYS 60 CO -0.00 0.21 -0.09 0.00 -2.27 0.00 0.00 179.45 177.30 2cht h ALA 61 N 1.79 1.04 -0.91 5.00 0.00 -1.10 -3.13 119.26 121.94 2cht h ALA 61 Ca -0.00 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.81 2cht h ALA 61 Cb 0.41 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.15 2cht h ALA 61 CO 0.03 0.12 0.50 0.28 0.00 0.00 0.00 179.25 180.18 2cht h VAL 62 N 0.00 1.26 0.00 0.00 2.07 -1.54 -2.32 116.25 115.72 2cht h VAL 62 Ca -0.00 -0.63 0.00 0.00 0.82 0.00 0.00 66.70 66.88 2cht h VAL 62 Cb 0.56 0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.36 2cht h VAL 62 CO 0.01 0.29 0.00 0.54 0.02 0.00 0.00 177.57 178.43 2cht n ARG 63 N -4.33 0.08 0.16 1.57 1.74 -1.18 -1.71 116.66 112.98 2cht n ARG 63 Ca 0.10 0.15 0.02 0.00 -0.77 0.00 0.00 57.85 57.35 2cht n ARG 63 Cb 0.09 -1.50 0.23 0.00 -1.02 0.00 0.00 32.46 30.27 2cht n ARG 63 CO 0.00 0.00 0.00 0.93 -1.52 0.00 0.00 177.63 177.04 2cht h GLU 64 N 0.00 0.00 -6.28 5.56 5.08 -1.57 -3.42 114.58 113.95 2cht h GLU 64 Ca 0.00 0.00 -0.56 0.00 -1.00 0.00 0.00 59.36 57.80 2cht h GLU 64 Cb 0.29 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.50 2cht h GLU 64 CO 0.00 0.50 0.54 -0.51 -1.00 0.00 0.00 179.01 178.54 2cht s LEU 65 N -7.23 4.26 0.38 1.33 1.43 -0.69 -5.00 118.68 113.15 2cht s LEU 65 Ca -0.00 1.55 -0.26 0.00 -1.03 0.00 0.00 54.13 54.39 2cht s LEU 65 Cb 0.11 -3.56 -0.09 0.00 0.03 0.00 0.00 46.19 42.69 2cht s LEU 65 CO 0.73 -0.42 1.18 -0.44 0.23 0.00 0.00 176.35 177.63 2cht s SER 66 N 1.09 6.61 0.00 2.29 0.01 -1.26 -2.69 113.70 119.75 2cht s SER 66 Ca 0.49 2.39 0.00 0.00 1.31 0.00 0.00 55.95 60.14 2cht s SER 66 Cb -0.19 -2.62 0.00 0.00 0.21 0.00 0.00 66.02 63.42 2cht s SER 66 CO 0.19 -0.61 0.00 0.61 0.41 0.00 0.00 173.24 173.84 2cht n GLY 67 N 0.71 2.84 0.41 3.44 0.00 -1.26 -4.88 105.19 106.45 2cht n GLY 67 Ca 0.03 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.07 2cht n GLY 67 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2cht n TRP 68 N -0.00 0.24 0.29 1.61 7.02 -1.09 -3.94 117.44 121.56 2cht n TRP 68 Ca 0.00 -0.10 0.14 0.00 -1.02 0.00 0.00 57.50 56.52 2cht n TRP 68 Cb 0.00 -0.06 0.85 0.00 -2.42 0.00 0.00 31.31 29.68 2cht n TRP 68 CO 0.00 0.00 0.00 0.37 -2.02 0.00 0.00 177.69 176.04 2cht h GLN 69 N 0.73 0.00 -0.02 -0.99 4.15 -1.87 -2.76 115.11 114.35 2cht h GLN 69 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 2cht h GLN 69 Cb 0.37 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.06 2cht h GLN 69 CO 0.03 0.02 -0.02 0.66 -1.93 0.00 0.00 178.83 177.59 2cht n TYR 70 N -3.94 0.00 -2.39 3.99 4.01 -1.25 -4.95 117.16 112.63 2cht n TYR 70 Ca -0.03 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.29 2cht n TYR 70 Cb 0.10 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.10 2cht n TYR 70 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 2cht s VAL 71 N -1.47 4.00 0.18 -0.72 1.01 -1.04 -4.97 120.40 117.38 2cht s VAL 71 Ca 0.20 1.41 -0.32 0.00 0.00 0.00 0.00 61.98 63.27 2cht s VAL 71 Cb 0.14 -3.90 -0.11 0.00 0.00 0.00 0.00 36.38 32.51 2cht s VAL 71 CO 0.23 0.07 1.66 -2.84 0.00 0.00 0.00 175.10 174.21 2cht s PRO 72 N 1.52 4.17 0.00 2.72 0.02 -1.26 -4.93 135.00 137.24 2cht s PRO 72 Ca 0.59 2.50 -0.06 0.00 0.02 0.00 0.00 61.00 64.05 2cht s PRO 72 Cb -0.29 -3.13 -0.00 0.00 0.02 0.00 0.00 34.50 31.09 2cht s PRO 72 CO 0.27 -0.69 0.10 0.14 -0.33 0.00 0.00 177.00 176.49 2cht s VAL 73 N 1.23 0.09 0.08 3.83 -7.23 -1.26 -0.30 120.40 116.84 2cht s VAL 73 Ca 0.73 -0.71 -0.26 0.00 -1.81 0.00 0.00 61.98 59.94 2cht s VAL 73 Cb -0.47 -0.39 0.07 0.00 0.56 0.00 0.00 36.38 36.15 2cht s VAL 73 CO 0.32 -0.39 0.62 0.28 -0.31 0.00 0.00 175.10 175.62 2cht s THR 74 N -1.34 0.00 0.28 5.32 -1.32 -1.01 -4.99 115.64 112.59 2cht s THR 74 Ca -0.14 -0.03 0.07 0.00 -1.21 0.00 0.00 61.69 60.37 2cht s THR 74 Cb -0.08 -1.00 -0.03 0.00 -1.51 0.00 0.00 72.50 69.88 2cht s THR 74 CO 0.01 -0.02 0.31 0.00 -2.21 0.00 0.00 174.62 172.71 2cht s MET 76 N -3.97 1.53 -0.17 0.00 1.00 0.38 -4.88 119.30 113.18 2cht s MET 76 Ca 0.37 -1.65 -0.05 0.00 0.00 0.00 0.00 55.69 54.36 2cht s MET 76 Cb -0.08 0.36 -0.03 0.00 0.00 0.00 0.00 34.83 35.08 2cht s MET 76 CO 0.27 -0.58 0.00 -1.14 0.00 0.00 0.00 175.02 173.58 2cht s GLN 77 N -3.76 3.75 0.42 2.03 0.74 -1.26 -2.62 119.66 118.95 2cht s GLN 77 Ca 0.34 -0.47 -0.23 0.00 0.05 0.00 0.00 55.36 55.06 2cht s GLN 77 Cb 0.03 -3.04 -0.09 0.00 1.10 0.00 0.00 33.01 31.01 2cht s GLN 77 CO 0.16 0.20 1.01 -2.00 -0.55 0.00 0.00 175.29 174.11 2cht s GLU 78 N 0.50 4.14 -0.02 1.67 2.56 -0.30 -4.88 118.70 122.37 2cht s GLU 78 Ca -0.01 1.35 -0.30 0.00 0.00 0.00 0.00 54.97 56.01 2cht s GLU 78 Cb -0.14 -2.37 -0.05 0.00 2.00 0.00 0.00 34.13 33.57 2cht s GLU 78 CO 0.02 -0.13 1.35 0.00 -0.56 0.00 0.00 175.26 175.94 2cht s MET 79 N -2.79 4.30 -0.51 4.30 0.23 -1.26 -4.44 119.30 119.13 2cht s MET 79 Ca 0.60 1.88 -0.27 0.00 -1.03 0.00 0.00 55.69 56.87 2cht s MET 79 Cb -0.17 -3.58 -0.02 0.00 -1.53 0.00 0.00 34.83 29.53 2cht s MET 79 CO 0.21 -0.55 1.82 0.34 -2.03 0.00 0.00 175.02 174.81 2cht s ASP 80 N 1.80 5.52 -0.07 -1.18 2.15 -1.26 -4.97 116.67 118.65 2cht s ASP 80 Ca 0.61 0.66 0.03 0.00 0.43 0.00 0.00 52.55 54.29 2cht s ASP 80 Cb -0.29 -2.53 -0.02 0.00 -0.30 0.00 0.00 42.92 39.78 2cht s ASP 80 CO 0.25 -2.12 -0.16 -0.69 -0.17 0.00 0.00 175.17 172.28 2cht s VAL 81 N 8.22 2.88 0.05 1.11 1.01 -1.26 -5.05 120.40 127.36 2cht s VAL 81 Ca 0.71 -0.77 -0.31 0.00 0.00 0.00 0.00 61.98 61.61 2cht s VAL 81 Cb -0.16 -2.13 -0.07 0.00 0.00 0.00 0.00 36.38 34.02 2cht s VAL 81 CO 0.25 0.57 1.53 -0.89 0.00 0.00 0.00 175.10 176.56 2cht s THR 82 N -0.40 3.30 0.00 3.92 2.01 -1.26 -0.58 115.64 122.63 2cht s THR 82 Ca 0.04 0.76 0.00 0.00 0.31 0.00 0.00 61.69 62.80 2cht s THR 82 Cb -0.12 -3.49 0.00 0.00 0.01 0.00 0.00 72.50 68.90 2cht s THR 82 CO 0.02 0.01 0.00 0.61 -0.69 0.00 0.00 174.62 174.57 2cht n GLY 83 N 3.80 0.53 3.77 4.40 0.00 -1.26 -5.04 105.19 111.39 2cht n GLY 83 Ca 0.14 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.78 2cht n GLY 83 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2cht s GLY 84 N -1.69 2.90 -0.07 -0.02 0.00 0.25 -4.98 107.32 103.72 2cht s GLY 84 Ca 0.00 0.61 -0.30 0.00 0.00 0.00 0.00 44.72 45.04 2cht s GLY 84 CO 0.00 1.10 1.33 -2.27 0.00 0.00 0.00 173.10 173.27 2cht s LEU 85 N -1.84 4.27 0.54 0.66 2.96 -1.26 -4.92 118.68 119.09 2cht s LEU 85 Ca 0.48 1.93 -0.18 0.00 -0.22 0.00 0.00 54.13 56.14 2cht s LEU 85 Cb -0.22 -3.55 -0.06 0.00 0.50 0.00 0.00 46.19 42.86 2cht s LEU 85 CO 0.28 -0.71 1.04 -0.54 -1.32 0.00 0.00 176.35 175.10 2cht s LYS 86 N 2.81 3.57 -1.36 1.98 -0.14 -1.26 -3.91 119.74 121.43 2cht s LYS 86 Ca 0.60 1.25 -0.03 0.00 -1.36 0.00 0.00 55.97 56.43 2cht s LYS 86 Cb -0.27 -2.07 0.02 0.00 -1.68 0.00 0.00 37.83 33.83 2cht s LYS 86 CO 0.22 -0.61 0.78 1.63 -0.76 0.00 0.00 175.35 176.61 2cht n LYS 87 N -1.55 -5.13 -4.26 1.68 5.02 -1.26 -4.83 118.16 107.83 2cht n LYS 87 Ca 0.09 0.62 -0.34 0.00 -2.02 0.00 0.00 58.31 56.66 2cht n LYS 87 Cb 0.53 -5.27 -0.13 0.00 -0.02 0.00 0.00 35.03 30.14 2cht n LYS 87 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2cht s ILE 89 N 0.86 5.36 -0.13 0.00 1.09 -0.34 -2.15 121.20 125.89 2cht s ILE 89 Ca -0.01 0.17 -0.01 0.00 -1.10 0.00 0.00 60.65 59.70 2cht s ILE 89 Cb -0.15 -3.41 0.03 0.00 -1.06 0.00 0.00 42.46 37.87 2cht s ILE 89 CO 0.01 0.49 -0.07 -0.13 -0.10 0.00 0.00 174.94 175.15 2cht s ARG 90 N -0.02 1.47 0.31 2.79 0.52 -1.10 -1.54 118.95 121.38 2cht s ARG 90 Ca 0.09 -0.32 0.06 0.00 -0.52 0.00 0.00 55.73 55.04 2cht s ARG 90 Cb -0.11 -1.70 -0.01 0.00 0.52 0.00 0.00 34.95 33.64 2cht s ARG 90 CO -0.00 -0.32 0.45 0.54 0.02 0.00 0.00 175.30 175.99 2cht s VAL 91 N 1.70 4.38 -0.27 3.52 0.11 -0.47 -1.03 120.40 128.34 2cht s VAL 91 Ca 0.04 -0.97 -0.01 0.00 -2.93 0.00 0.00 61.98 58.10 2cht s VAL 91 Cb -0.13 -3.53 0.13 0.00 -1.53 0.00 0.00 36.38 31.32 2cht s VAL 91 CO -0.08 -0.21 0.33 -0.32 -3.33 0.00 0.00 175.10 171.49 2cht s MET 92 N -4.14 0.33 -0.25 1.54 1.75 -0.75 -2.99 119.30 114.79 2cht s MET 92 Ca 0.42 0.12 -0.13 0.00 -1.25 0.00 0.00 55.69 54.86 2cht s MET 92 Cb -0.09 -0.62 -0.05 0.00 2.84 0.00 0.00 34.83 36.91 2cht s MET 92 CO 0.31 -0.89 0.25 1.41 -0.65 0.00 0.00 175.02 175.46 2cht s MET 93 N 2.44 4.05 -0.34 4.11 1.75 -0.60 -1.42 119.30 129.30 2cht s MET 93 Ca 0.10 -0.13 -0.12 0.00 -1.25 0.00 0.00 55.69 54.29 2cht s MET 93 Cb -0.14 -3.59 -0.01 0.00 2.84 0.00 0.00 34.83 33.94 2cht s MET 93 CO -0.25 -0.08 0.21 0.99 -0.65 0.00 0.00 175.02 175.24 2cht s THR 94 N 1.45 4.96 0.24 10.11 2.01 -0.09 0.34 115.64 134.66 2cht s THR 94 Ca 0.11 -0.40 0.09 0.00 0.31 0.00 0.00 61.69 61.80 2cht s THR 94 Cb -0.15 -3.59 -0.05 0.00 0.01 0.00 0.00 72.50 68.73 2cht s THR 94 CO 0.08 -0.04 -0.16 0.68 -0.69 0.00 0.00 174.62 174.49 2cht s VAL 95 N 1.66 2.02 -0.46 3.82 -7.23 0.12 0.57 120.40 120.90 2cht s VAL 95 Ca 0.05 -2.28 -0.21 0.00 -1.81 0.00 0.00 61.98 57.73 2cht s VAL 95 Cb -0.18 -2.17 0.03 0.00 0.56 0.00 0.00 36.38 34.62 2cht s VAL 95 CO 0.09 -0.50 0.69 -1.58 -0.31 0.00 0.00 175.10 173.49 2cht s GLN 96 N -3.60 3.28 0.05 4.82 0.74 0.16 -0.03 119.66 125.09 2cht s GLN 96 Ca 0.26 -0.39 -0.13 0.00 0.05 0.00 0.00 55.36 55.14 2cht s GLN 96 Cb -0.02 -3.98 0.02 0.00 1.10 0.00 0.00 33.01 30.13 2cht s GLN 96 CO 0.10 -1.10 0.30 -0.08 -0.55 0.00 0.00 175.29 173.96 2cht s THR 97 N 2.98 0.09 -1.83 -0.34 -1.32 -0.25 -4.91 115.64 110.05 2cht s THR 97 Ca 0.23 -0.71 0.18 0.00 -1.21 0.00 0.00 61.69 60.18 2cht s THR 97 Cb -0.14 -0.99 0.39 0.00 -1.51 0.00 0.00 72.50 70.25 2cht s THR 97 CO 0.19 -0.39 1.31 0.47 -2.21 0.00 0.00 174.62 173.98 2cht n ASP 98 N 0.47 3.21 -4.69 8.08 8.00 -1.26 0.08 116.55 130.43 2cht n ASP 98 Ca -0.18 -1.92 -0.42 0.00 0.71 0.00 0.00 54.79 52.97 2cht n ASP 98 Cb 0.60 -0.25 -0.03 0.00 -0.02 0.00 0.00 41.12 41.42 2cht n ASP 98 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2cht s VAL 99 N -1.20 3.48 0.99 2.53 1.01 -1.26 -4.95 120.40 121.00 2cht s VAL 99 Ca 0.33 0.92 -0.11 0.00 0.00 0.00 0.00 61.98 63.11 2cht s VAL 99 Cb 0.19 -3.59 0.18 0.00 0.00 0.00 0.00 36.38 33.16 2cht s VAL 99 CO 0.25 0.01 1.09 -2.16 0.00 0.00 0.00 175.10 174.29 2cht s PRO 100 N 2.27 0.50 0.20 2.72 0.04 -1.26 -4.85 135.00 134.60 2cht s PRO 100 Ca 0.66 1.11 -0.12 0.00 0.04 0.00 0.00 61.00 62.70 2cht s PRO 100 Cb -0.34 -1.70 0.24 0.00 0.04 0.00 0.00 34.50 32.73 2cht s PRO 100 CO 0.28 -2.85 1.71 0.37 0.04 0.00 0.00 177.00 176.55 2cht h GLN 101 N -2.00 0.22 0.00 4.56 4.15 -1.99 0.55 115.11 120.60 2cht h GLN 101 Ca -0.51 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 58.90 2cht h GLN 101 Cb 1.29 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.93 2cht h GLN 101 CO 0.48 0.15 0.00 -0.40 -1.93 0.00 0.00 178.83 177.13 2cht n ASP 102 N -5.14 0.00 -0.90 -0.69 5.68 -1.26 -3.00 116.55 111.24 2cht n ASP 102 Ca 0.07 -0.47 0.07 0.00 -0.50 0.00 0.00 54.79 53.96 2cht n ASP 102 Cb 0.28 -0.13 0.22 0.00 -1.14 0.00 0.00 41.12 40.35 2cht n ASP 102 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2cht n GLN 103 N -1.13 3.00 -2.94 0.11 6.02 0.18 -4.94 117.38 117.67 2cht n GLN 103 Ca 0.16 -2.39 -0.40 0.00 -0.01 0.00 0.00 57.00 54.35 2cht n GLN 103 Cb 0.14 -1.51 -0.05 0.00 1.02 0.00 0.00 30.24 29.85 2cht n GLN 103 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2cht s ILE 104 N -1.49 4.83 -0.42 5.09 -1.09 -1.16 -4.89 121.20 122.06 2cht s ILE 104 Ca 0.34 1.68 -0.24 0.00 -2.23 0.00 0.00 60.65 60.19 2cht s ILE 104 Cb 0.21 -4.14 0.02 0.00 -1.58 0.00 0.00 42.46 36.97 2cht s ILE 104 CO 0.17 0.30 0.82 -0.13 -1.23 0.00 0.00 174.94 174.87 2cht s ARG 105 N 0.36 3.55 -0.25 2.79 1.81 -1.26 -5.02 118.95 120.93 2cht s ARG 105 Ca 0.41 0.11 -0.13 0.00 -1.72 0.00 0.00 55.73 54.39 2cht s ARG 105 Cb -0.20 -3.89 -0.04 0.00 -0.45 0.00 0.00 34.95 30.36 2cht s ARG 105 CO 0.23 -1.06 0.29 -1.01 -0.68 0.00 0.00 175.30 173.07 2cht s HIS 106 N 3.35 3.28 -0.43 -0.53 3.76 -1.26 -4.81 115.29 118.65 2cht s HIS 106 Ca 0.32 0.34 -0.16 0.00 -0.15 0.00 0.00 55.06 55.41 2cht s HIS 106 Cb -0.12 -2.45 0.03 0.00 1.11 0.00 0.00 32.58 31.15 2cht s HIS 106 CO 0.22 -0.11 0.39 0.08 -0.85 0.00 0.00 174.74 174.47 2cht s VAL 107 N 1.63 5.16 -0.72 -0.90 1.01 -1.02 -4.93 120.40 120.62 2cht s VAL 107 Ca 0.12 -0.54 -0.07 0.00 0.00 0.00 0.00 61.98 61.49 2cht s VAL 107 Cb -0.15 -4.02 0.19 0.00 0.00 0.00 0.00 36.38 32.40 2cht s VAL 107 CO 0.09 -0.41 0.59 -0.31 0.00 0.00 0.00 175.10 175.05 2cht s TYR 108 N 1.93 3.57 0.87 5.22 1.51 -1.26 -0.84 117.35 128.35 2cht s TYR 108 Ca 0.09 -2.48 -0.10 0.00 -1.01 0.00 0.00 57.07 53.57 2cht s TYR 108 Cb -0.19 -3.43 0.18 0.00 -0.11 0.00 0.00 41.96 38.41 2cht s TYR 108 CO 0.11 -0.89 1.20 -0.51 -1.11 0.00 0.00 175.55 174.35 2cht s LEU 109 N -0.09 2.83 0.00 -1.29 1.43 0.05 -3.13 118.68 118.47 2cht s LEU 109 Ca 0.18 -0.05 0.00 0.00 -1.03 0.00 0.00 54.13 53.23 2cht s LEU 109 Cb -0.16 -2.07 0.00 0.00 0.03 0.00 0.00 46.19 44.00 2cht s LEU 109 CO -0.06 -2.43 0.00 -0.62 0.23 0.00 0.00 176.35 173.47 2cht n GLU 110 N -3.41 0.00 0.28 1.70 -0.58 -1.26 -1.22 120.64 116.15 2cht n GLU 110 Ca 0.16 0.00 0.17 0.00 -0.42 0.00 0.00 57.16 57.07 2cht n GLU 110 Cb 0.60 0.00 0.70 0.00 -0.57 0.00 0.00 31.44 32.17 2cht n GLU 110 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 2cht h LYS 111 N 0.00 0.00 0.00 3.49 1.57 -1.93 -3.15 116.57 116.55 2cht h LYS 111 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2cht h LYS 111 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2cht h LYS 111 CO 0.00 0.02 0.00 0.00 -0.57 0.00 0.00 179.45 178.90 2cht n ALA 112 N -2.11 1.37 -0.33 3.86 0.00 -0.35 -3.11 120.51 119.84 2cht n ALA 112 Ca 0.00 0.11 0.27 0.00 0.00 0.00 0.00 53.44 53.82 2cht n ALA 112 Cb 0.30 -1.31 0.53 0.00 0.00 0.00 0.00 19.45 18.97 2cht n ALA 112 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 177.50 177.11 2cht h VAL 113 N 0.00 0.18 0.00 0.00 -1.51 -1.46 0.13 116.25 113.58 2cht h VAL 113 Ca 0.00 -0.07 0.00 0.00 -1.23 0.00 0.00 66.70 65.40 2cht h VAL 113 Cb 0.19 -0.03 0.00 0.00 -2.13 0.00 0.00 31.29 29.32 2cht h VAL 113 CO 0.00 0.03 0.00 0.55 -1.23 0.00 0.00 177.57 176.92 2cht n VAL 114 N -5.12 0.34 -0.01 7.19 3.14 -1.18 -3.44 118.33 119.24 2cht n VAL 114 Ca 0.34 0.09 -0.16 0.00 -2.96 0.00 0.00 64.34 61.65 2cht n VAL 114 Cb 1.12 -0.78 -0.12 0.00 -1.06 0.00 0.00 33.84 33.00 2cht n VAL 114 CO 0.00 0.00 0.00 -0.07 -6.46 0.00 0.00 176.83 170.30 2cht h LEU 115 N 0.00 0.29 -6.29 6.55 3.38 -1.00 -3.42 115.31 114.82 2cht h LEU 115 Ca 0.00 -0.83 -0.11 0.00 0.09 0.00 0.00 57.88 57.04 2cht h LEU 115 Cb 0.13 -0.09 -0.27 0.00 0.09 0.00 0.00 40.66 40.52 2cht h LEU 115 CO 0.00 1.08 -0.46 -0.13 0.09 0.00 0.00 178.44 179.03 2cht s ARG 116 N -2.93 0.43 -1.13 1.13 1.81 -1.24 -4.99 118.95 112.02 2cht s ARG 116 Ca -0.15 0.47 -0.12 0.00 -1.72 0.00 0.00 55.73 54.21 2cht s ARG 116 Cb 0.01 -0.18 -0.07 0.00 -0.45 0.00 0.00 34.95 34.26 2cht s ARG 116 CO 0.76 -0.81 2.26 -0.35 -0.68 0.00 0.00 175.30 176.49 2cht n PRO 117 N 5.38 2.42 0.00 3.54 -0.04 -1.22 -4.80 135.00 140.27 2cht n PRO 117 Ca -0.01 -1.93 0.00 0.00 -0.04 0.00 0.00 63.50 61.52 2cht n PRO 117 Cb 0.50 -2.80 0.00 0.00 -0.04 0.00 0.00 33.50 31.16 2cht n PRO 117 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21