#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sc8 s ILE 17 N 0.00 4.94 0.00 1.39 -1.09 0.49 -4.04 121.20 122.88 1sc8 s ILE 17 Ca 0.00 1.77 0.00 0.00 -2.23 0.00 0.00 60.65 60.19 1sc8 s ILE 17 Cb 0.00 -4.19 0.00 0.00 -1.58 0.00 0.00 42.46 36.69 1sc8 s ILE 17 CO 0.00 0.17 0.00 0.61 -1.23 0.00 0.00 174.94 174.49 1sc8 n GLY 18 N 3.05 0.59 7.00 6.18 0.00 -1.26 -2.51 105.19 118.25 1sc8 n GLY 18 Ca 0.03 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.28 1sc8 n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sc8 n GLY 19 N 0.00 -1.05 3.22 -0.02 0.00 -1.26 -4.88 105.19 101.20 1sc8 n GLY 19 Ca 0.00 -1.22 -0.13 0.00 0.00 0.00 0.00 46.02 44.67 1sc8 n GLY 19 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1sc8 s GLU 20 N 0.00 0.97 0.24 1.61 2.02 -0.17 -4.98 118.70 118.38 1sc8 s GLU 20 Ca 0.00 -1.40 -0.24 0.00 0.02 0.00 0.00 54.97 53.35 1sc8 s GLU 20 Cb 0.00 -0.44 -0.09 0.00 0.10 0.00 0.00 34.13 33.71 1sc8 s GLU 20 CO 0.00 0.03 0.82 -0.06 0.02 0.00 0.00 175.26 176.07 1sc8 s PHE 21 N -3.46 3.76 0.33 1.61 0.40 -1.26 -1.39 117.98 117.98 1sc8 s PHE 21 Ca 0.15 1.62 0.06 0.00 -0.60 0.00 0.00 56.93 58.16 1sc8 s PHE 21 Cb 0.04 -2.78 -0.02 0.00 0.51 0.00 0.00 43.02 40.76 1sc8 s PHE 21 CO -0.02 0.36 0.31 -0.08 0.70 0.00 0.00 175.22 176.49 1sc8 s THR 22 N -1.42 0.00 0.34 0.64 -1.32 -0.91 -4.90 115.64 108.07 1sc8 s THR 22 Ca 0.43 -1.93 0.08 0.00 -1.21 0.00 0.00 61.69 59.06 1sc8 s THR 22 Cb -0.20 -2.53 -0.07 0.00 -1.51 0.00 0.00 72.50 68.20 1sc8 s THR 22 CO 0.24 0.00 -0.07 0.42 -2.21 0.00 0.00 174.62 173.00 1sc8 s THR 23 N -3.37 2.05 0.64 5.08 -4.23 -1.26 -4.30 115.64 110.26 1sc8 s THR 23 Ca 0.39 -2.15 0.39 0.00 -1.18 0.00 0.00 61.69 59.14 1sc8 s THR 23 Cb 0.02 -2.67 0.42 0.00 1.34 0.00 0.00 72.50 71.61 1sc8 s THR 23 CO 0.27 -0.18 2.33 -0.29 -0.54 0.00 0.00 174.62 176.21 1sc8 h ILE 24 N 2.04 0.19 -0.34 2.99 6.09 -1.88 -1.75 117.51 124.85 1sc8 h ILE 24 Ca -0.42 0.00 -0.01 0.00 -1.37 0.00 0.00 64.86 63.06 1sc8 h ILE 24 Cb 1.25 1.00 -0.02 0.00 0.47 0.00 0.00 36.82 39.52 1sc8 h ILE 24 CO 0.71 0.00 0.17 -0.33 -3.07 0.00 0.00 178.15 175.64 1sc8 h GLU 25 N 0.00 0.46 0.00 2.19 5.08 -1.88 -1.33 114.58 119.10 1sc8 h GLU 25 Ca 0.00 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1sc8 h GLU 25 Cb 0.00 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.16 1sc8 h GLU 25 CO -0.00 0.35 -0.40 0.09 -1.00 0.00 0.00 179.01 178.05 1sc8 n ASN 26 N -4.44 0.56 -2.91 1.42 3.02 -0.66 -4.16 115.26 108.10 1sc8 n ASN 26 Ca 0.02 0.15 -0.17 0.00 -0.03 0.00 0.00 54.58 54.55 1sc8 n ASN 26 Cb 0.11 -0.06 -0.01 0.00 -0.61 0.00 0.00 39.78 39.20 1sc8 n ASN 26 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1sc8 n GLN 27 N -1.89 1.60 0.24 3.52 1.13 -0.69 -4.98 117.38 116.32 1sc8 n GLN 27 Ca 0.05 -3.67 0.10 0.00 -1.94 0.00 0.00 57.00 51.55 1sc8 n GLN 27 Cb 0.40 -1.69 0.56 0.00 0.11 0.00 0.00 30.24 29.61 1sc8 n GLN 27 CO 0.00 0.00 0.00 -1.00 -1.44 0.00 0.00 177.06 174.62 1sc8 h PRO 28 N 2.95 0.00 -0.01 -1.09 0.13 -1.44 -1.29 132.00 131.26 1sc8 h PRO 28 Ca 0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.19 1sc8 h PRO 28 Cb 0.96 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.09 1sc8 h PRO 28 CO 0.58 0.00 -0.46 -2.67 -0.23 0.00 0.00 178.00 175.22 1sc8 n TRP 29 N -2.44 0.00 -2.27 1.56 2.14 -1.20 -0.92 117.44 114.31 1sc8 n TRP 29 Ca -0.01 0.00 -0.42 0.00 2.07 0.00 0.00 57.50 59.13 1sc8 n TRP 29 Cb 0.35 -0.04 -0.03 0.00 -0.81 0.00 0.00 31.31 30.78 1sc8 n TRP 29 CO 0.00 0.00 0.00 0.12 2.07 0.00 0.00 177.69 179.88 1sc8 s PHE 30 N -2.55 3.08 -0.15 -2.67 2.19 -0.49 -0.61 117.98 116.79 1sc8 s PHE 30 Ca 0.19 0.98 -0.02 0.00 0.33 0.00 0.00 56.93 58.40 1sc8 s PHE 30 Cb 0.18 -3.60 -0.02 0.00 -1.31 0.00 0.00 43.02 38.27 1sc8 s PHE 30 CO 0.59 -2.09 -0.07 0.00 1.83 0.00 0.00 175.22 175.48 1sc8 s ALA 31 N 1.86 2.88 -0.25 11.12 0.00 -0.53 -4.41 121.76 132.43 1sc8 s ALA 31 Ca 0.62 -0.84 -0.13 0.00 0.00 0.00 0.00 51.96 51.62 1sc8 s ALA 31 Cb -0.31 -1.44 -0.04 0.00 0.00 0.00 0.00 23.12 21.32 1sc8 s ALA 31 CO 0.27 0.23 0.26 0.00 0.00 0.00 0.00 175.76 176.53 1sc8 s ALA 32 N 0.34 3.57 -0.18 0.00 0.00 0.08 -1.03 121.76 124.54 1sc8 s ALA 32 Ca -0.06 -0.87 -0.04 0.00 0.00 0.00 0.00 51.96 50.99 1sc8 s ALA 32 Cb -0.15 -2.52 -0.02 0.00 0.00 0.00 0.00 23.12 20.43 1sc8 s ALA 32 CO 0.04 -0.43 -0.03 0.42 0.00 0.00 0.00 175.76 175.76 1sc8 s ILE 33 N 1.56 3.81 0.30 0.00 1.01 -0.56 0.27 121.20 127.59 1sc8 s ILE 33 Ca 0.11 -0.37 0.10 0.00 0.00 0.00 0.00 60.65 60.49 1sc8 s ILE 33 Cb -0.15 -2.70 -0.06 0.00 0.01 0.00 0.00 42.46 39.57 1sc8 s ILE 33 CO 0.08 0.46 -0.14 -0.31 0.00 0.00 0.00 174.94 175.03 1sc8 s TYR 34 N 0.75 2.26 -0.07 3.97 2.02 0.87 -0.06 117.35 127.09 1sc8 s TYR 34 Ca -0.01 -0.44 0.03 0.00 -0.37 0.00 0.00 57.07 56.27 1sc8 s TYR 34 Cb -0.14 -1.13 0.01 0.00 -0.40 0.00 0.00 41.96 40.29 1sc8 s TYR 34 CO 0.02 0.60 -0.15 0.50 -1.57 0.00 0.00 175.55 174.96 1sc8 s ARG 35 N -3.58 1.92 0.43 -0.62 3.52 0.14 -0.48 118.95 120.28 1sc8 s ARG 35 Ca 0.30 -0.52 -0.22 0.00 -0.13 0.00 0.00 55.73 55.17 1sc8 s ARG 35 Cb -0.01 -1.56 -0.10 0.00 -1.56 0.00 0.00 34.95 31.71 1sc8 s ARG 35 CO 0.15 0.09 0.97 1.03 -0.81 0.00 0.00 175.30 176.72 1sc8 s ARG 36 N 0.51 4.20 0.36 5.12 0.52 0.13 -1.75 118.95 128.04 1sc8 s ARG 36 Ca -0.13 1.20 0.06 0.00 -0.52 0.00 0.00 55.73 56.34 1sc8 s ARG 36 Cb -0.15 -2.25 -0.07 0.00 0.52 0.00 0.00 34.95 33.00 1sc8 s ARG 36 CO 0.04 -0.06 0.00 -1.01 0.02 0.00 0.00 175.30 174.29 1sc8 s HIS 37 N -2.06 2.27 -0.49 -0.53 3.76 -0.65 -4.94 115.29 112.64 1sc8 s HIS 37 Ca 0.61 -0.74 -0.24 0.00 -0.15 0.00 0.00 55.06 54.55 1sc8 s HIS 37 Cb -0.12 -1.50 -0.23 0.00 1.11 0.00 0.00 32.58 31.85 1sc8 s HIS 37 CO 0.16 0.31 1.79 0.54 -0.85 0.00 0.00 174.74 176.70 1sc8 n ARG 37 N -0.82 0.97 0.00 1.40 1.74 -1.26 -4.18 116.66 114.51 1sc8 n ARG 37 Ca -0.04 -1.50 0.10 0.00 -0.77 0.00 0.00 57.85 55.63 1sc8 n ARG 37 Cb 0.66 -2.73 0.59 0.00 -1.02 0.00 0.00 32.46 29.96 1sc8 n ARG 37 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1sc8 n GLY 37 N 4.64 -0.63 3.67 -0.13 0.00 -1.26 -5.11 105.19 106.37 1sc8 n GLY 37 Ca 0.47 -0.12 -0.42 0.00 0.00 0.00 0.00 46.02 45.95 1sc8 n GLY 37 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1sc8 s SER 37 N -2.02 7.05 -0.21 1.61 1.04 -1.26 -5.03 113.70 114.88 1sc8 s SER 37 Ca 0.29 1.29 -0.07 0.00 0.48 0.00 0.00 55.95 57.95 1sc8 s SER 37 Cb 0.14 -2.49 -0.04 0.00 0.10 0.00 0.00 66.02 63.73 1sc8 s SER 37 CO 0.23 -0.47 0.07 -0.69 0.98 0.00 0.00 173.24 173.36 1sc8 s VAL 38 N 2.35 4.57 0.14 5.02 1.01 -1.26 -1.63 120.40 130.60 1sc8 s VAL 38 Ca 0.42 -0.10 0.09 0.00 0.00 0.00 0.00 61.98 62.39 1sc8 s VAL 38 Cb -0.17 -3.09 -0.04 0.00 0.00 0.00 0.00 36.38 33.08 1sc8 s VAL 38 CO 0.12 0.40 -0.16 0.42 0.00 0.00 0.00 175.10 175.88 1sc8 s THR 39 N 0.92 2.90 0.31 3.92 -4.23 -0.71 -4.92 115.64 113.84 1sc8 s THR 39 Ca 0.04 -1.57 -0.29 0.00 -1.18 0.00 0.00 61.69 58.69 1sc8 s THR 39 Cb -0.14 -2.36 -0.10 0.00 1.34 0.00 0.00 72.50 71.24 1sc8 s THR 39 CO 0.03 0.03 1.18 -0.47 -0.54 0.00 0.00 174.62 174.85 1sc8 s TYR 40 N -1.32 3.32 0.01 3.99 5.04 -1.26 -0.68 117.35 126.45 1sc8 s TYR 40 Ca 0.20 1.58 -0.04 0.00 -2.44 0.00 0.00 57.07 56.37 1sc8 s TYR 40 Cb -0.10 -3.44 -0.01 0.00 0.35 0.00 0.00 41.96 38.76 1sc8 s TYR 40 CO 0.11 -1.12 -0.08 0.28 -1.34 0.00 0.00 175.55 173.41 1sc8 n VAL 41 N 0.91 1.04 -3.87 3.14 0.31 0.92 -4.85 118.33 115.92 1sc8 n VAL 41 Ca -0.00 0.29 -0.08 0.00 -0.01 0.00 0.00 64.34 64.54 1sc8 n VAL 41 Cb 0.44 -1.68 -0.03 0.00 -0.91 0.00 0.00 33.84 31.66 1sc8 n VAL 41 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1sc8 s GLY 43 N -2.94 1.74 0.33 0.00 0.00 0.09 -1.49 107.32 105.05 1sc8 s GLY 43 Ca 0.13 -1.21 -0.18 0.00 0.00 0.00 0.00 44.72 43.47 1sc8 s GLY 43 CO 0.06 -0.72 0.85 -0.32 0.00 0.00 0.00 173.10 172.98 1sc8 s GLY 44 N -4.62 0.28 -0.03 0.20 0.00 -0.20 -3.76 107.32 99.19 1sc8 s GLY 44 Ca 0.63 -0.61 -0.01 0.00 0.00 0.00 0.00 44.72 44.73 1sc8 s GLY 44 CO 0.45 0.41 0.06 -0.56 0.00 0.00 0.00 173.10 173.47 1sc8 s SER 45 N -3.15 -0.00 -0.43 1.64 0.01 -0.46 -1.45 113.70 109.86 1sc8 s SER 45 Ca 0.17 0.12 -0.28 0.00 1.31 0.00 0.00 55.95 57.26 1sc8 s SER 45 Cb -0.04 0.03 0.02 0.00 0.21 0.00 0.00 66.02 66.24 1sc8 s SER 45 CO 0.10 -0.11 1.07 -0.22 0.41 0.00 0.00 173.24 174.49 1sc8 s LEU 46 N 0.83 3.80 -0.01 2.44 2.96 0.22 -0.47 118.68 128.46 1sc8 s LEU 46 Ca -0.07 0.57 0.19 0.00 -0.22 0.00 0.00 54.13 54.60 1sc8 s LEU 46 Cb -0.09 -3.46 -0.23 0.00 0.50 0.00 0.00 46.19 42.91 1sc8 s LEU 46 CO -0.03 -1.09 0.74 2.30 -1.32 0.00 0.00 176.35 176.95 1sc8 n ILE 47 N 6.45 0.00 -3.47 6.68 -5.35 -0.76 -1.08 119.36 121.84 1sc8 n ILE 47 Ca 0.11 -0.13 -0.10 0.00 -0.27 0.00 0.00 62.75 62.35 1sc8 n ILE 47 Cb 0.48 0.80 -0.02 0.00 -1.74 0.00 0.00 39.64 39.17 1sc8 n ILE 47 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 1sc8 s SER 48 N -3.11 -0.46 0.35 7.28 1.04 -1.19 -4.67 113.70 112.95 1sc8 s SER 48 Ca 0.04 0.02 0.16 0.00 0.48 0.00 0.00 55.95 56.66 1sc8 s SER 48 Cb 0.14 0.48 1.11 0.00 0.10 0.00 0.00 66.02 67.85 1sc8 s SER 48 CO 0.79 -0.76 1.67 -0.65 0.98 0.00 0.00 173.24 175.27 1sc8 h PRO 49 N 2.03 0.31 -0.11 4.02 0.11 -1.94 -1.81 132.00 134.61 1sc8 h PRO 49 Ca -0.27 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1sc8 h PRO 49 Cb 1.27 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1sc8 h PRO 49 CO 0.34 0.21 0.00 0.00 -0.21 0.00 0.00 178.00 178.34 1sc8 s TRP 51 N -1.42 1.19 -0.05 0.00 0.52 -0.68 -0.76 118.94 117.75 1sc8 s TRP 51 Ca 0.24 -0.27 0.06 0.00 0.02 0.00 0.00 56.10 56.15 1sc8 s TRP 51 Cb 0.16 -0.80 -0.01 0.00 -1.15 0.00 0.00 33.47 31.67 1sc8 s TRP 51 CO 0.23 -0.07 -0.24 0.08 0.02 0.00 0.00 176.95 176.97 1sc8 s VAL 52 N -0.10 1.96 -0.05 4.03 1.01 -0.27 -1.82 120.40 125.15 1sc8 s VAL 52 Ca 0.01 -1.03 -0.00 0.00 0.00 0.00 0.00 61.98 60.96 1sc8 s VAL 52 Cb -0.07 -1.65 -0.03 0.00 0.00 0.00 0.00 36.38 34.62 1sc8 s VAL 52 CO 0.00 0.55 -0.00 -0.51 0.00 0.00 0.00 175.10 175.14 1sc8 s ILE 53 N -0.25 4.21 0.00 2.22 2.07 0.38 -0.35 121.20 129.47 1sc8 s ILE 53 Ca -0.00 -0.40 0.00 0.00 -1.41 0.00 0.00 60.65 58.84 1sc8 s ILE 53 Cb -0.12 -2.81 0.00 0.00 0.13 0.00 0.00 42.46 39.66 1sc8 s ILE 53 CO 0.02 0.52 0.00 -0.24 -1.91 0.00 0.00 174.94 173.33 1sc8 n SER 54 N 1.86 0.00 -4.42 4.50 2.88 0.18 -1.36 113.62 117.26 1sc8 n SER 54 Ca -0.17 0.00 -0.33 0.00 -1.33 0.00 0.00 58.87 57.04 1sc8 n SER 54 Cb 0.53 0.00 -0.14 0.00 -0.75 0.00 0.00 64.21 63.85 1sc8 n SER 54 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1sc8 s ALA 55 N -1.57 2.57 0.28 -1.46 0.00 -1.26 -0.72 121.76 119.60 1sc8 s ALA 55 Ca 0.00 -0.97 -0.02 0.00 0.00 0.00 0.00 51.96 50.97 1sc8 s ALA 55 Cb 0.00 -0.98 0.39 0.00 0.00 0.00 0.00 23.12 22.53 1sc8 s ALA 55 CO 0.00 0.46 1.83 1.15 0.00 0.00 0.00 175.76 179.20 1sc8 h THR 56 N 4.72 1.23 0.00 0.00 2.02 -1.75 -2.91 112.91 116.22 1sc8 h THR 56 Ca -0.39 -0.78 0.00 0.00 0.77 0.00 0.00 66.41 66.02 1sc8 h THR 56 Cb 1.17 0.59 0.00 0.00 -1.74 0.00 0.00 68.15 68.17 1sc8 h THR 56 CO 0.51 0.30 0.00 0.00 0.37 0.00 0.00 175.52 176.70 1sc8 n HIS 57 N -4.29 0.10 0.16 3.16 1.44 -1.26 -1.35 115.22 113.18 1sc8 n HIS 57 Ca 0.05 0.05 0.04 0.00 -2.01 0.00 0.00 57.72 55.84 1sc8 n HIS 57 Cb 0.21 -0.57 0.14 0.00 0.12 0.00 0.00 29.99 29.88 1sc8 n HIS 57 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1sc8 n PHE 59 N -3.29 0.00 -0.23 0.00 3.72 -0.46 -4.79 117.46 112.41 1sc8 n PHE 59 Ca 0.01 0.00 0.31 0.00 -0.05 0.00 0.00 57.45 57.73 1sc8 n PHE 59 Cb 0.65 0.00 0.73 0.00 -0.94 0.00 0.00 39.48 39.92 1sc8 n PHE 59 CO 0.00 0.00 0.00 0.97 -0.05 0.00 0.00 176.76 177.68 1sc8 h ILE 60 N 0.00 0.43 0.00 4.37 6.09 -1.52 0.11 117.51 126.99 1sc8 h ILE 60 Ca 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.49 1sc8 h ILE 60 Cb 0.00 0.46 0.00 0.00 0.47 0.00 0.00 36.82 37.75 1sc8 h ILE 60 CO 0.00 0.00 -0.53 0.47 -3.07 0.00 0.00 178.15 175.02 1sc8 n ASP 60 N -4.11 0.63 -3.19 2.19 8.00 -1.26 -4.46 116.55 114.34 1sc8 n ASP 60 Ca 0.21 0.09 -0.23 0.00 0.71 0.00 0.00 54.79 55.58 1sc8 n ASP 60 Cb 1.11 0.08 -0.06 0.00 -0.02 0.00 0.00 41.12 42.23 1sc8 n ASP 60 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1sc8 n TYR 60 N -1.96 -0.88 0.28 1.24 4.02 0.38 -4.99 117.16 115.25 1sc8 n TYR 60 Ca 0.04 -3.27 0.02 0.00 -0.01 0.00 0.00 57.90 54.68 1sc8 n TYR 60 Cb 0.41 0.02 0.12 0.00 -0.02 0.00 0.00 39.34 39.88 1sc8 n TYR 60 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 176.86 173.55 1sc8 n PRO 60 N 1.84 0.14 -2.36 -0.72 -0.02 -1.11 -4.72 135.00 128.05 1sc8 n PRO 60 Ca 0.22 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 61.27 1sc8 n PRO 60 Cb 0.53 -1.47 -0.02 0.00 -0.02 0.00 0.00 33.50 32.52 1sc8 n PRO 60 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 1sc8 s LYS 61 N -2.00 3.54 0.43 -0.52 2.20 -1.26 -4.89 119.74 117.24 1sc8 s LYS 61 Ca 0.06 0.87 0.13 0.00 -0.36 0.00 0.00 55.97 56.67 1sc8 s LYS 61 Cb 0.03 -4.04 0.94 0.00 -1.51 0.00 0.00 37.83 33.25 1sc8 s LYS 61 CO 0.05 -1.61 1.98 1.57 -0.36 0.00 0.00 175.35 176.97 1sc8 h LYS 62 N 10.74 0.09 0.00 4.03 2.10 -1.91 -2.92 116.57 128.70 1sc8 h LYS 62 Ca -0.27 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.36 1sc8 h LYS 62 Cb 1.10 -0.01 0.00 0.00 -0.90 0.00 0.00 32.23 32.42 1sc8 h LYS 62 CO 1.10 0.24 0.00 0.93 -2.00 0.00 0.00 179.45 179.72 1sc8 h GLU 62 N 0.08 0.00 -0.28 0.07 4.39 -1.90 -2.82 114.58 114.12 1sc8 h GLU 62 Ca 0.02 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.72 1sc8 h GLU 62 Cb 0.31 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.96 1sc8 h GLU 62 CO 0.02 0.00 0.00 -0.25 -1.16 0.00 0.00 179.01 177.62 1sc8 n ASP 63 N -2.43 3.00 -4.77 1.42 8.00 -1.10 -4.95 116.55 115.71 1sc8 n ASP 63 Ca -0.01 -1.93 -0.28 0.00 0.71 0.00 0.00 54.79 53.28 1sc8 n ASP 63 Cb 0.10 -0.17 -0.06 0.00 -0.02 0.00 0.00 41.12 40.96 1sc8 n ASP 63 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 1sc8 s TYR 64 N -1.65 3.14 -0.04 1.24 1.51 -1.06 0.20 117.35 120.68 1sc8 s TYR 64 Ca 0.36 0.02 0.01 0.00 -1.01 0.00 0.00 57.07 56.45 1sc8 s TYR 64 Cb 0.21 -1.56 0.02 0.00 -0.11 0.00 0.00 41.96 40.53 1sc8 s TYR 64 CO 0.31 0.52 -0.05 0.42 -1.11 0.00 0.00 175.55 175.64 1sc8 s ILE 65 N -1.55 0.52 -0.11 2.71 1.01 0.37 -4.26 121.20 119.88 1sc8 s ILE 65 Ca 0.30 -0.13 0.00 0.00 0.00 0.00 0.00 60.65 60.82 1sc8 s ILE 65 Cb -0.11 -0.53 -0.02 0.00 0.01 0.00 0.00 42.46 41.80 1sc8 s ILE 65 CO 0.22 0.21 -0.10 -0.69 0.00 0.00 0.00 174.94 174.58 1sc8 s VAL 66 N 0.80 3.38 -0.08 2.92 1.01 -0.71 -0.09 120.40 127.63 1sc8 s VAL 66 Ca -0.11 -0.57 0.04 0.00 0.00 0.00 0.00 61.98 61.35 1sc8 s VAL 66 Cb -0.13 -2.41 -0.01 0.00 0.00 0.00 0.00 36.38 33.83 1sc8 s VAL 66 CO 0.00 0.55 -0.21 -0.31 0.00 0.00 0.00 175.10 175.12 1sc8 s TYR 67 N -0.12 2.56 0.13 5.22 2.02 0.14 -1.03 117.35 126.27 1sc8 s TYR 67 Ca 0.00 -0.71 0.11 0.00 -0.37 0.00 0.00 57.07 56.10 1sc8 s TYR 67 Cb -0.13 -1.67 -0.04 0.00 -0.40 0.00 0.00 41.96 39.72 1sc8 s TYR 67 CO 0.03 -0.21 -0.26 -0.51 -1.57 0.00 0.00 175.55 173.03 1sc8 s LEU 68 N -0.04 2.33 -0.94 -1.29 1.43 -0.86 -0.74 118.68 118.57 1sc8 s LEU 68 Ca -0.06 -0.76 -0.01 0.00 -1.03 0.00 0.00 54.13 52.27 1sc8 s LEU 68 Cb -0.15 -1.19 0.00 0.00 0.03 0.00 0.00 46.19 44.89 1sc8 s LEU 68 CO 0.05 0.16 0.12 0.61 0.23 0.00 0.00 176.35 177.52 1sc8 n GLY 69 N 0.86 -0.06 3.29 -3.19 0.00 -1.23 -1.31 105.19 103.55 1sc8 n GLY 69 Ca -0.18 -0.36 -0.33 0.00 0.00 0.00 0.00 46.02 45.16 1sc8 n GLY 69 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1sc8 s ARG 70 N -4.79 3.25 -0.04 1.61 3.52 -1.26 -3.54 118.95 117.70 1sc8 s ARG 70 Ca 0.06 -0.74 0.21 0.00 -0.13 0.00 0.00 55.73 55.13 1sc8 s ARG 70 Cb -0.03 -2.61 -0.32 0.00 -1.56 0.00 0.00 34.95 30.43 1sc8 s ARG 70 CO 0.07 0.07 0.43 0.43 -0.81 0.00 0.00 175.30 175.50 1sc8 n SER 71 N 3.90 0.17 -4.40 -2.12 7.64 -1.26 -4.66 113.62 112.90 1sc8 n SER 71 Ca -0.19 0.00 -0.29 0.00 1.01 0.00 0.00 58.87 59.40 1sc8 n SER 71 Cb 0.52 1.89 -0.13 0.00 -1.01 0.00 0.00 64.21 65.48 1sc8 n SER 71 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1sc8 s ARG 72 N -3.39 1.58 0.03 1.43 0.52 -1.26 -1.62 118.95 116.24 1sc8 s ARG 72 Ca -0.08 -1.25 -0.28 0.00 -0.52 0.00 0.00 55.73 53.60 1sc8 s ARG 72 Cb 0.13 -1.96 -0.17 0.00 0.52 0.00 0.00 34.95 33.47 1sc8 s ARG 72 CO 0.87 0.47 1.33 1.25 0.02 0.00 0.00 175.30 179.24 1sc8 h LEU 73 N 4.11 -0.63 -3.28 2.53 6.46 -1.02 -3.37 115.31 120.12 1sc8 h LEU 73 Ca -0.50 -0.04 -0.08 0.00 -0.12 0.00 0.00 57.88 57.14 1sc8 h LEU 73 Cb 1.16 0.16 -0.05 0.00 -0.73 0.00 0.00 40.66 41.21 1sc8 h LEU 73 CO 0.41 -0.31 -0.03 0.59 -0.62 0.00 0.00 178.44 178.48 1sc8 n ASN 74 N -5.33 3.12 -3.97 1.25 3.02 -1.26 -5.00 115.26 107.08 1sc8 n ASN 74 Ca -0.12 -3.36 -0.08 0.00 -0.03 0.00 0.00 54.58 50.99 1sc8 n ASN 74 Cb 0.33 -0.58 -0.08 0.00 -0.61 0.00 0.00 39.78 38.84 1sc8 n ASN 74 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1sc8 s SER 75 N -2.29 0.27 0.60 6.41 1.04 -1.26 -5.16 113.70 113.31 1sc8 s SER 75 Ca 0.42 -0.83 -0.10 0.00 0.48 0.00 0.00 55.95 55.92 1sc8 s SER 75 Cb 0.36 0.29 -0.04 0.00 0.10 0.00 0.00 66.02 66.73 1sc8 s SER 75 CO 0.04 -0.69 1.00 0.20 0.98 0.00 0.00 173.24 174.77 1sc8 s ASN 76 N -2.90 6.21 -0.02 7.02 0.01 -1.26 -4.51 114.94 119.49 1sc8 s ASN 76 Ca 0.07 1.34 0.04 0.00 -0.71 0.00 0.00 52.86 53.60 1sc8 s ASN 76 Cb 0.06 -2.42 -0.01 0.00 0.41 0.00 0.00 41.25 39.29 1sc8 s ASN 76 CO -0.09 -0.84 -0.12 -0.89 -1.51 0.00 0.00 177.10 173.64 1sc8 s THR 77 N -3.12 1.00 0.25 1.60 2.01 -1.26 -4.91 115.64 111.21 1sc8 s THR 77 Ca 0.54 -0.52 -0.31 0.00 0.31 0.00 0.00 61.69 61.71 1sc8 s THR 77 Cb -0.11 -0.86 -0.11 0.00 0.01 0.00 0.00 72.50 71.44 1sc8 s THR 77 CO 0.53 0.29 1.58 0.00 -0.69 0.00 0.00 174.62 176.33 1sc8 s GLN 78 N -0.12 4.17 0.00 4.92 -2.07 -1.26 -2.09 119.66 123.20 1sc8 s GLN 78 Ca 0.02 2.49 0.00 0.00 -1.82 0.00 0.00 55.36 56.05 1sc8 s GLN 78 Cb -0.07 -3.07 0.00 0.00 -1.09 0.00 0.00 33.01 28.78 1sc8 s GLN 78 CO 0.00 -0.61 0.00 0.41 -1.32 0.00 0.00 175.29 173.77 1sc8 n GLY 79 N 2.80 3.20 3.52 2.60 0.00 -1.26 -5.01 105.19 111.05 1sc8 n GLY 79 Ca 0.10 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 1sc8 n GLY 79 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1sc8 n GLU 80 N -2.00 -0.27 -4.11 1.61 0.28 -0.89 -4.86 120.64 110.41 1sc8 n GLU 80 Ca 0.00 -0.02 -0.16 0.00 -0.16 0.00 0.00 57.16 56.82 1sc8 n GLU 80 Cb 0.00 -2.06 -0.15 0.00 1.43 0.00 0.00 31.44 30.66 1sc8 n GLU 80 CO 0.00 0.00 0.00 -1.64 -0.16 0.00 0.00 177.13 175.33 1sc8 s MET 81 N -3.93 0.39 -0.13 3.44 -1.94 -0.43 -5.00 119.30 111.71 1sc8 s MET 81 Ca 0.62 -0.14 -0.07 0.00 -1.71 0.00 0.00 55.69 54.39 1sc8 s MET 81 Cb -0.23 -0.40 -0.04 0.00 2.01 0.00 0.00 34.83 36.17 1sc8 s MET 81 CO 0.63 0.07 0.11 0.21 -0.01 0.00 0.00 175.02 176.03 1sc8 s LYS 82 N 0.05 3.48 0.05 2.03 2.20 -1.26 -2.02 119.74 124.27 1sc8 s LYS 82 Ca -0.00 -0.19 0.02 0.00 -0.36 0.00 0.00 55.97 55.44 1sc8 s LYS 82 Cb -0.04 -3.16 -0.03 0.00 -1.51 0.00 0.00 37.83 33.10 1sc8 s LYS 82 CO -0.00 0.69 -0.08 -0.06 -0.36 0.00 0.00 175.35 175.54 1sc8 s PHE 83 N -0.78 0.72 0.26 4.03 0.08 -0.20 -4.57 117.98 117.52 1sc8 s PHE 83 Ca 0.13 -0.56 0.06 0.00 0.12 0.00 0.00 56.93 56.68 1sc8 s PHE 83 Cb -0.12 -0.43 -0.03 0.00 -0.57 0.00 0.00 43.02 41.88 1sc8 s PHE 83 CO 0.03 -0.09 0.35 -1.21 -0.10 0.00 0.00 175.22 174.20 1sc8 s GLU 84 N -1.92 3.30 -0.39 0.44 0.41 -0.35 -1.74 118.70 118.46 1sc8 s GLU 84 Ca -0.07 -0.85 -0.15 0.00 -0.41 0.00 0.00 54.97 53.49 1sc8 s GLU 84 Cb -0.08 -2.83 0.01 0.00 -1.78 0.00 0.00 34.13 29.45 1sc8 s GLU 84 CO -0.00 0.36 0.34 0.08 -0.49 0.00 0.00 175.26 175.55 1sc8 s VAL 85 N -2.04 5.20 0.18 2.63 1.01 -1.26 -2.18 120.40 123.94 1sc8 s VAL 85 Ca 0.36 -0.36 0.04 0.00 0.00 0.00 0.00 61.98 62.01 1sc8 s VAL 85 Cb -0.09 -3.90 -0.13 0.00 0.00 0.00 0.00 36.38 32.26 1sc8 s VAL 85 CO 0.29 -0.25 1.42 -0.08 0.00 0.00 0.00 175.10 176.48 1sc8 h GLU 86 N 8.60 0.17 -2.31 2.72 4.81 -0.90 -3.43 114.58 124.24 1sc8 h GLU 86 Ca -0.28 -0.17 -0.05 0.00 -0.13 0.00 0.00 59.36 58.73 1sc8 h GLU 86 Cb 1.13 0.05 -0.24 0.00 0.63 0.00 0.00 28.75 30.32 1sc8 h GLU 86 CO 0.72 0.90 -0.13 1.21 -0.73 0.00 0.00 179.01 180.98 1sc8 s ASN 87 N -6.90 -0.73 -0.33 1.04 3.04 -1.20 -4.99 114.94 104.87 1sc8 s ASN 87 Ca -0.03 1.21 -0.06 0.00 0.04 0.00 0.00 52.86 54.02 1sc8 s ASN 87 Cb 0.11 1.09 0.03 0.00 -1.54 0.00 0.00 41.25 40.94 1sc8 s ASN 87 CO 0.82 -0.22 0.09 -0.22 -3.04 0.00 0.00 177.10 174.53 1sc8 s LEU 88 N 1.46 4.17 -0.39 3.21 2.96 -1.26 -0.99 118.68 127.83 1sc8 s LEU 88 Ca -0.09 -1.03 -0.12 0.00 -0.22 0.00 0.00 54.13 52.67 1sc8 s LEU 88 Cb -0.06 -1.86 0.04 0.00 0.50 0.00 0.00 46.19 44.80 1sc8 s LEU 88 CO -0.16 -0.29 0.24 -0.63 -1.32 0.00 0.00 176.35 174.19 1sc8 s ILE 89 N 1.42 4.67 0.10 6.68 1.01 0.11 -4.99 121.20 130.19 1sc8 s ILE 89 Ca -0.01 -0.92 -0.01 0.00 0.00 0.00 0.00 60.65 59.71 1sc8 s ILE 89 Cb -0.19 -3.65 -0.04 0.00 0.01 0.00 0.00 42.46 38.59 1sc8 s ILE 89 CO 0.02 -0.30 0.28 -0.76 0.00 0.00 0.00 174.94 174.18 1sc8 s LEU 90 N 1.56 4.32 0.23 2.97 1.43 -1.26 -1.12 118.68 126.81 1sc8 s LEU 90 Ca 0.03 0.37 -0.30 0.00 -1.03 0.00 0.00 54.13 53.20 1sc8 s LEU 90 Cb -0.20 -3.08 -0.09 0.00 0.03 0.00 0.00 46.19 42.85 1sc8 s LEU 90 CO 0.07 0.11 1.05 -2.28 0.23 0.00 0.00 176.35 175.53 1sc8 s HIS 91 N -1.59 3.71 -0.24 0.29 5.65 -1.23 -4.95 115.29 116.93 1sc8 s HIS 91 Ca 0.37 1.74 0.25 0.00 0.25 0.00 0.00 55.06 57.67 1sc8 s HIS 91 Cb -0.13 -3.19 0.62 0.00 -1.18 0.00 0.00 32.58 28.71 1sc8 s HIS 91 CO 0.27 -0.25 1.71 -0.22 -0.65 0.00 0.00 174.74 175.60 1sc8 h LYS 92 N 4.40 0.00 -0.65 2.88 3.64 -1.94 -3.18 116.57 121.71 1sc8 h LYS 92 Ca -0.45 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 58.83 1sc8 h LYS 92 Cb 1.21 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 32.97 1sc8 h LYS 92 CO 0.69 0.05 0.12 -0.25 -2.27 0.00 0.00 179.45 177.79 1sc8 n ASP 93 N -3.12 5.38 -4.76 4.20 8.00 -1.26 -4.97 116.55 120.02 1sc8 n ASP 93 Ca 0.03 -3.07 -0.41 0.00 0.71 0.00 0.00 54.79 52.05 1sc8 n ASP 93 Cb 0.48 -0.71 -0.03 0.00 -0.02 0.00 0.00 41.12 40.84 1sc8 n ASP 93 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1sc8 s TYR 94 N -2.88 3.24 -0.04 1.24 5.04 -1.21 -4.65 117.35 118.09 1sc8 s TYR 94 Ca 0.55 1.40 -0.29 0.00 -2.44 0.00 0.00 57.07 56.30 1sc8 s TYR 94 Cb 0.43 -3.57 0.06 0.00 0.35 0.00 0.00 41.96 39.23 1sc8 s TYR 94 CO 0.15 -1.60 0.63 -1.54 -1.34 0.00 0.00 175.55 171.86 1sc8 s SER 95 N -0.26 -0.60 -0.13 4.32 1.04 -1.14 -4.99 113.70 111.93 1sc8 s SER 95 Ca 0.51 0.62 0.02 0.00 0.48 0.00 0.00 55.95 57.58 1sc8 s SER 95 Cb -0.37 0.51 0.01 0.00 0.10 0.00 0.00 66.02 66.28 1sc8 s SER 95 CO 0.45 -0.60 -0.20 0.00 0.98 0.00 0.00 173.24 173.87 1sc8 s ALA 96 N -1.28 2.10 0.04 5.32 0.00 -1.26 -0.19 121.76 126.49 1sc8 s ALA 96 Ca -0.11 -1.00 0.00 0.00 0.00 0.00 0.00 51.96 50.85 1sc8 s ALA 96 Cb -0.01 -0.95 0.00 0.00 0.00 0.00 0.00 23.12 22.16 1sc8 s ALA 96 CO 0.09 -0.04 0.00 -0.25 0.00 0.00 0.00 175.76 175.56 1sc8 n ASP 97 N 4.10 0.00 -0.18 0.00 9.92 0.47 -4.98 116.55 125.88 1sc8 n ASP 97 Ca -0.20 0.00 -0.01 0.00 -0.53 0.00 0.00 54.79 54.05 1sc8 n ASP 97 Cb 0.51 0.00 0.07 0.00 -0.64 0.00 0.00 41.12 41.06 1sc8 n ASP 97 CO 0.00 0.00 0.00 0.74 0.13 0.00 0.00 177.20 178.07 1sc8 h THR 97 N 0.00 0.51 0.00 -3.53 2.02 -2.02 -3.39 112.91 106.49 1sc8 h THR 97 Ca 0.00 -0.02 0.00 0.00 0.77 0.00 0.00 66.41 67.16 1sc8 h THR 97 Cb 0.00 0.44 0.00 0.00 -1.74 0.00 0.00 68.15 66.85 1sc8 h THR 97 CO 0.00 0.01 -0.61 0.18 0.37 0.00 0.00 175.52 175.47 1sc8 n LEU 97 N -5.31 0.16 -4.77 2.58 4.77 -1.26 -5.09 117.00 108.08 1sc8 n LEU 97 Ca 0.07 0.00 -0.41 0.00 -0.03 0.00 0.00 56.01 55.64 1sc8 n LEU 97 Cb 0.30 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.39 1sc8 n LEU 97 CO 0.11 -0.15 1.06 0.00 -1.33 0.00 0.00 177.39 177.08 1sc8 s ALA 98 N -1.97 3.51 -0.21 -1.18 0.00 -1.26 -4.81 121.76 115.85 1sc8 s ALA 98 Ca 0.00 1.43 -0.00 0.00 0.00 0.00 0.00 51.96 53.39 1sc8 s ALA 98 Cb 0.00 -3.55 0.02 0.00 0.00 0.00 0.00 23.12 19.59 1sc8 s ALA 98 CO 0.00 -0.89 -0.14 -1.01 0.00 0.00 0.00 175.76 173.73 1sc8 s HIS 99 N -1.14 2.91 -0.01 0.00 3.76 -1.26 -0.40 115.29 119.15 1sc8 s HIS 99 Ca 0.52 -1.54 -0.12 0.00 -0.15 0.00 0.00 55.06 53.77 1sc8 s HIS 99 Cb -0.43 -1.98 -0.05 0.00 1.11 0.00 0.00 32.58 31.22 1sc8 s HIS 99 CO 0.58 -0.75 0.34 -1.01 -0.85 0.00 0.00 174.74 173.05 1sc8 s HIS 100 N 1.32 3.67 -1.46 1.40 3.76 0.73 -4.37 115.29 120.34 1sc8 s HIS 100 Ca 0.03 0.83 -0.07 0.00 -0.15 0.00 0.00 55.06 55.71 1sc8 s HIS 100 Cb -0.14 -2.17 0.05 0.00 1.11 0.00 0.00 32.58 31.42 1sc8 s HIS 100 CO -0.09 0.64 0.70 0.09 -0.85 0.00 0.00 174.74 175.23 1sc8 n ASN 101 N 1.65 -2.20 -4.56 1.40 3.02 -1.26 -2.91 115.26 110.41 1sc8 n ASN 101 Ca -0.14 -0.90 -0.43 0.00 -0.03 0.00 0.00 54.58 53.08 1sc8 n ASN 101 Cb 0.53 -3.48 -0.00 0.00 -0.61 0.00 0.00 39.78 36.22 1sc8 n ASN 101 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1sc8 s ASP 102 N -3.91 6.86 -0.11 6.41 2.15 -1.26 -4.56 116.67 122.25 1sc8 s ASP 102 Ca 0.30 -2.50 -0.15 0.00 0.43 0.00 0.00 52.55 50.63 1sc8 s ASP 102 Cb -0.16 -2.54 0.04 0.00 -0.30 0.00 0.00 42.92 39.96 1sc8 s ASP 102 CO 0.86 -1.11 0.38 -0.51 -0.17 0.00 0.00 175.17 174.63 1sc8 s ILE 103 N 3.75 0.02 -0.00 4.11 2.07 -1.26 -4.31 121.20 125.57 1sc8 s ILE 103 Ca 0.51 -0.13 -0.17 0.00 -1.41 0.00 0.00 60.65 59.45 1sc8 s ILE 103 Cb 0.02 -0.59 0.03 0.00 0.13 0.00 0.00 42.46 42.06 1sc8 s ILE 103 CO 0.05 -0.07 0.37 0.00 -1.91 0.00 0.00 174.94 173.38 1sc8 s ALA 104 N -0.28 -0.93 -0.09 1.50 0.00 0.10 -3.49 121.76 118.57 1sc8 s ALA 104 Ca -0.04 0.41 0.03 0.00 0.00 0.00 0.00 51.96 52.36 1sc8 s ALA 104 Cb -0.03 0.14 -0.01 0.00 0.00 0.00 0.00 23.12 23.21 1sc8 s ALA 104 CO 0.02 -0.32 -0.19 -0.51 0.00 0.00 0.00 175.76 174.75 1sc8 s LEU 105 N -1.50 2.38 -0.24 0.00 1.43 -0.27 0.50 118.68 120.97 1sc8 s LEU 105 Ca -0.11 -0.42 0.02 0.00 -1.03 0.00 0.00 54.13 52.59 1sc8 s LEU 105 Cb -0.03 -1.48 0.05 0.00 0.03 0.00 0.00 46.19 44.76 1sc8 s LEU 105 CO 0.03 0.22 -0.12 -0.76 0.23 0.00 0.00 176.35 175.95 1sc8 s LEU 106 N 0.03 3.04 -0.04 1.79 1.02 0.52 0.06 118.68 125.09 1sc8 s LEU 106 Ca -0.07 -1.21 -0.26 0.00 0.02 0.00 0.00 54.13 52.61 1sc8 s LEU 106 Cb -0.15 -1.47 -0.03 0.00 0.02 0.00 0.00 46.19 44.56 1sc8 s LEU 106 CO 0.05 -0.16 0.82 -0.75 0.02 0.00 0.00 176.35 176.33 1sc8 s LYS 107 N 1.19 4.49 0.22 1.70 2.20 -0.16 -1.12 119.74 128.26 1sc8 s LYS 107 Ca -0.06 1.10 0.09 0.00 -0.36 0.00 0.00 55.97 56.75 1sc8 s LYS 107 Cb -0.18 -3.45 -0.04 0.00 -1.51 0.00 0.00 37.83 32.64 1sc8 s LYS 107 CO -0.07 0.01 -0.07 0.96 -0.36 0.00 0.00 175.35 175.82 1sc8 s ILE 108 N 0.91 3.22 -0.27 5.43 -4.36 0.06 -0.18 121.20 126.00 1sc8 s ILE 108 Ca 0.43 -1.83 -0.23 0.00 -0.26 0.00 0.00 60.65 58.77 1sc8 s ILE 108 Cb -0.19 -2.65 0.08 0.00 1.25 0.00 0.00 42.46 40.95 1sc8 s ILE 108 CO 0.22 -0.24 0.74 0.00 0.24 0.00 0.00 174.94 175.90 1sc8 s ARG 109 N -3.21 0.78 1.00 0.37 1.70 -0.93 -4.63 118.95 114.03 1sc8 s ARG 109 Ca 0.28 1.02 -0.15 0.00 -0.47 0.00 0.00 55.73 56.41 1sc8 s ARG 109 Cb -0.07 0.33 0.19 0.00 -0.57 0.00 0.00 34.95 34.83 1sc8 s ARG 109 CO 0.17 -0.11 1.18 -1.54 -1.08 0.00 0.00 175.30 173.92 1sc8 s SER 110 N 0.67 2.71 0.59 -2.89 1.04 0.11 -1.21 113.70 114.72 1sc8 s SER 110 Ca -0.02 0.70 0.34 0.00 0.48 0.00 0.00 55.95 57.45 1sc8 s SER 110 Cb -0.05 -1.05 1.87 0.00 0.10 0.00 0.00 66.02 66.90 1sc8 s SER 110 CO -0.04 -3.02 2.22 0.11 0.98 0.00 0.00 173.24 173.48 1sc8 h LYS 110 N -1.83 0.00 -0.01 4.02 1.57 -1.89 0.11 116.57 118.54 1sc8 h LYS 110 Ca -0.47 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.31 1sc8 h LYS 110 Cb 1.30 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.61 1sc8 h LYS 110 CO 0.48 0.03 -0.02 0.39 -0.57 0.00 0.00 179.45 179.77 1sc8 n GLU 110 N -3.48 1.36 -0.92 3.15 4.71 -1.26 -4.91 120.64 119.28 1sc8 n GLU 110 Ca -0.02 -0.59 0.00 0.00 -0.01 0.00 0.00 57.16 56.53 1sc8 n GLU 110 Cb 0.14 -1.49 0.00 0.00 -1.01 0.00 0.00 31.44 29.09 1sc8 n GLU 110 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1sc8 n GLY 110 N 1.13 0.50 3.80 0.62 0.00 0.38 -5.07 105.19 106.55 1sc8 n GLY 110 Ca 0.20 -0.90 -0.22 0.00 0.00 0.00 0.00 46.02 45.10 1sc8 n GLY 110 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1sc8 s ARG 110 N -1.86 2.76 0.00 1.61 0.52 -1.26 -4.77 118.95 115.95 1sc8 s ARG 110 Ca 0.00 -1.18 0.00 0.00 -0.52 0.00 0.00 55.73 54.03 1sc8 s ARG 110 Cb 0.00 -2.47 0.00 0.00 0.52 0.00 0.00 34.95 33.00 1sc8 s ARG 110 CO 0.00 0.33 0.00 0.00 0.02 0.00 0.00 175.30 175.65 1sc8 s ALA 112 N -2.51 2.95 -0.20 0.00 0.00 -0.30 -4.83 121.76 116.86 1sc8 s ALA 112 Ca 0.00 1.10 -0.04 0.00 0.00 0.00 0.00 51.96 53.03 1sc8 s ALA 112 Cb 0.00 -3.46 -0.01 0.00 0.00 0.00 0.00 23.12 19.65 1sc8 s ALA 112 CO 0.00 -0.93 -0.04 -0.65 0.00 0.00 0.00 175.76 174.14 1sc8 s GLN 113 N -2.73 3.45 0.23 0.00 -1.52 -1.26 -4.84 119.66 112.99 1sc8 s GLN 113 Ca 0.66 -0.60 -0.32 0.00 -1.95 0.00 0.00 55.36 53.15 1sc8 s GLN 113 Cb -0.34 -2.98 -0.13 0.00 -0.22 0.00 0.00 33.01 29.35 1sc8 s GLN 113 CO 0.41 -0.08 1.58 -2.30 -0.25 0.00 0.00 175.29 174.64 1sc8 n PRO 114 N 4.46 2.41 -1.13 2.91 -0.02 -1.26 -4.83 135.00 137.54 1sc8 n PRO 114 Ca -0.18 0.87 0.00 0.00 -2.02 0.00 0.00 63.50 62.17 1sc8 n PRO 114 Cb 0.51 -2.63 0.00 0.00 -0.02 0.00 0.00 33.50 31.36 1sc8 n PRO 114 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1sc8 n SER 115 N 2.90 0.00 0.17 2.55 3.41 -0.69 -4.97 113.62 116.99 1sc8 n SER 115 Ca 0.13 -0.62 0.07 0.00 -0.26 0.00 0.00 58.87 58.19 1sc8 n SER 115 Cb 0.33 0.00 0.09 0.00 -0.26 0.00 0.00 64.21 64.37 1sc8 n SER 115 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1sc8 h ARG 116 N 0.00 0.00 -0.19 4.33 2.43 -1.99 -3.26 114.38 115.70 1sc8 h ARG 116 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1sc8 h ARG 116 Cb 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 1sc8 h ARG 116 CO 0.00 0.23 0.00 0.25 -1.51 0.00 0.00 179.97 178.94 1sc8 n THR 117 N -3.12 0.33 -3.53 0.20 -2.24 -1.26 -4.78 114.28 99.87 1sc8 n THR 117 Ca 0.02 -0.66 -0.21 0.00 -2.27 0.00 0.00 64.05 60.93 1sc8 n THR 117 Cb 0.63 1.08 -0.14 0.00 -2.10 0.00 0.00 70.33 69.80 1sc8 n THR 117 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1sc8 s ILE 118 N -1.31 -0.23 0.10 2.28 1.01 -1.23 -3.50 121.20 118.31 1sc8 s ILE 118 Ca 0.26 -0.16 -0.05 0.00 0.00 0.00 0.00 60.65 60.69 1sc8 s ILE 118 Cb 0.16 -0.66 -0.02 0.00 0.01 0.00 0.00 42.46 41.95 1sc8 s ILE 118 CO 0.23 -0.26 0.11 -1.10 0.00 0.00 0.00 174.94 173.93 1sc8 s GLN 119 N 2.25 0.84 0.47 2.79 -0.21 -0.10 -1.70 119.66 124.01 1sc8 s GLN 119 Ca 0.05 -1.16 -0.06 0.00 0.02 0.00 0.00 55.36 54.21 1sc8 s GLN 119 Cb -0.16 0.29 -0.04 0.00 1.00 0.00 0.00 33.01 34.10 1sc8 s GLN 119 CO -0.12 -0.24 0.79 0.95 -2.12 0.00 0.00 175.29 174.54 1sc8 s THR 120 N -3.93 4.89 0.00 -0.19 -4.23 -1.26 -3.25 115.64 107.66 1sc8 s THR 120 Ca 0.11 0.28 0.05 0.00 -1.18 0.00 0.00 61.69 60.95 1sc8 s THR 120 Cb 0.06 -3.85 -0.03 0.00 1.34 0.00 0.00 72.50 70.02 1sc8 s THR 120 CO -0.07 -0.81 -0.14 -0.51 -0.54 0.00 0.00 174.62 172.55 1sc8 s ILE 121 N -2.70 3.08 0.31 2.99 1.10 -0.24 -4.85 121.20 120.89 1sc8 s ILE 121 Ca 0.48 -0.93 -0.27 0.00 -0.51 0.00 0.00 60.65 59.42 1sc8 s ILE 121 Cb -0.10 -2.28 -0.09 0.00 0.15 0.00 0.00 42.46 40.13 1sc8 s ILE 121 CO 0.43 0.44 1.02 -0.44 -2.11 0.00 0.00 174.94 174.28 1sc8 s SER 122 N -1.19 7.23 0.44 4.50 0.01 -1.25 -4.59 113.70 118.83 1sc8 s SER 122 Ca 0.14 2.06 -0.10 0.00 1.31 0.00 0.00 55.95 59.36 1sc8 s SER 122 Cb -0.11 -2.60 -0.06 0.00 0.21 0.00 0.00 66.02 63.46 1sc8 s SER 122 CO 0.04 -0.16 0.80 -0.76 0.41 0.00 0.00 173.24 173.57 1sc8 s LEU 123 N -1.82 3.75 0.00 2.44 1.43 -1.26 -1.13 118.68 122.09 1sc8 s LEU 123 Ca 0.48 1.15 -0.13 0.00 -1.03 0.00 0.00 54.13 54.60 1sc8 s LEU 123 Cb -0.26 -4.05 0.18 0.00 0.03 0.00 0.00 46.19 42.09 1sc8 s LEU 123 CO 0.32 -0.46 0.91 -2.65 0.23 0.00 0.00 176.35 174.69 1sc8 n PRO 124 N -1.54 -1.45 -4.08 1.29 -0.02 -1.26 -4.84 135.00 123.09 1sc8 n PRO 124 Ca 0.03 -1.41 -0.23 0.00 -2.02 0.00 0.00 63.50 59.86 1sc8 n PRO 124 Cb 0.54 -1.05 -0.04 0.00 -0.02 0.00 0.00 33.50 32.93 1sc8 n PRO 124 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 1sc8 s SER 125 N -4.23 5.65 -0.02 2.55 0.01 -1.26 -4.98 113.70 111.42 1sc8 s SER 125 Ca 0.53 -0.16 -0.39 0.00 1.31 0.00 0.00 55.95 57.24 1sc8 s SER 125 Cb -0.03 -1.49 -0.18 0.00 0.21 0.00 0.00 66.02 64.53 1sc8 s SER 125 CO 0.38 -0.01 1.27 0.23 0.41 0.00 0.00 173.24 175.52 1sc8 n MET 126 N -0.93 0.54 -3.89 12.44 2.81 -1.26 -2.22 117.12 124.60 1sc8 n MET 126 Ca -0.08 0.20 -0.24 0.00 -1.81 0.00 0.00 57.70 55.77 1sc8 n MET 126 Cb 0.57 -1.77 0.01 0.00 -0.71 0.00 0.00 33.22 31.32 1sc8 n MET 126 CO 0.00 0.00 0.00 0.66 1.51 0.00 0.00 175.97 178.14 1sc8 n TYR 127 N 2.37 -0.70 -3.37 2.03 4.02 -1.25 -4.89 117.16 115.37 1sc8 n TYR 127 Ca 0.21 0.03 -0.26 0.00 -0.01 0.00 0.00 57.90 57.87 1sc8 n TYR 127 Cb 0.12 -1.40 -0.10 0.00 -0.02 0.00 0.00 39.34 37.94 1sc8 n TYR 127 CO 0.00 0.00 0.00 1.21 -1.01 0.00 0.00 176.86 177.06 1sc8 s ASN 128 N -4.19 1.34 0.34 7.72 2.47 -0.94 -5.13 114.94 116.54 1sc8 s ASN 128 Ca 0.24 -2.97 0.07 0.00 0.42 0.00 0.00 52.86 50.63 1sc8 s ASN 128 Cb -0.14 -0.33 -0.02 0.00 -1.45 0.00 0.00 41.25 39.31 1sc8 s ASN 128 CO 0.50 -0.17 0.34 -1.81 -3.72 0.00 0.00 177.10 172.24 1sc8 s ASP 129 N 0.14 5.46 0.88 -4.21 1.01 -1.26 -4.44 116.67 114.25 1sc8 s ASP 129 Ca 0.32 -0.42 -0.11 0.00 0.71 0.00 0.00 52.55 53.05 1sc8 s ASP 129 Cb 0.03 -1.03 0.12 0.00 1.01 0.00 0.00 42.92 43.05 1sc8 s ASP 129 CO -0.18 -0.38 1.11 -2.84 0.21 0.00 0.00 175.17 173.09 1sc8 s PRO 130 N -4.04 1.32 0.45 8.23 0.02 -1.26 -4.97 135.00 134.75 1sc8 s PRO 130 Ca 0.42 1.28 -0.23 0.00 0.02 0.00 0.00 61.00 62.49 1sc8 s PRO 130 Cb -0.07 -1.78 -0.08 0.00 0.02 0.00 0.00 34.50 32.60 1sc8 s PRO 130 CO 0.28 -2.34 1.16 -0.65 -0.33 0.00 0.00 177.00 175.12 1sc8 s GLN 131 N -4.76 3.80 0.48 5.54 -1.52 -1.26 -4.96 119.66 116.99 1sc8 s GLN 131 Ca 0.65 1.76 -0.24 0.00 -1.95 0.00 0.00 55.36 55.57 1sc8 s GLN 131 Cb -0.20 -2.43 -0.07 0.00 -0.22 0.00 0.00 33.01 30.08 1sc8 s GLN 131 CO 0.58 -0.51 1.40 -0.06 -0.25 0.00 0.00 175.29 176.45 1sc8 s PHE 132 N -1.55 2.41 0.00 0.91 2.99 -1.26 -2.01 117.98 119.48 1sc8 s PHE 132 Ca 0.63 1.30 0.00 0.00 0.00 0.00 0.00 56.93 58.86 1sc8 s PHE 132 Cb -0.28 -3.87 0.00 0.00 0.00 0.00 0.00 43.02 38.87 1sc8 s PHE 132 CO 0.34 -2.89 0.00 0.41 -0.00 0.00 0.00 175.22 173.08 1sc8 n GLY 133 N 0.63 0.59 3.76 4.36 0.00 0.33 -4.97 105.19 109.89 1sc8 n GLY 133 Ca 0.07 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 1sc8 n GLY 133 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1sc8 s THR 134 N -2.27 3.83 0.14 2.61 2.01 -0.85 -4.69 115.64 116.43 1sc8 s THR 134 Ca 0.00 1.77 -0.28 0.00 0.31 0.00 0.00 61.69 63.50 1sc8 s THR 134 Cb 0.00 -4.10 -0.07 0.00 0.01 0.00 0.00 72.50 68.34 1sc8 s THR 134 CO 0.00 0.37 0.86 -0.44 -0.69 0.00 0.00 174.62 174.73 1sc8 s SER 135 N -1.14 7.45 0.12 3.53 0.01 -1.26 -1.87 113.70 120.54 1sc8 s SER 135 Ca 0.45 1.72 -0.01 0.00 1.31 0.00 0.00 55.95 59.42 1sc8 s SER 135 Cb -0.27 -2.54 -0.04 0.00 0.21 0.00 0.00 66.02 63.37 1sc8 s SER 135 CO 0.34 0.08 0.04 0.00 0.41 0.00 0.00 173.24 174.11 1sc8 s GLU 137 N -4.02 1.95 0.03 0.00 -1.05 0.65 -1.02 118.70 115.24 1sc8 s GLU 137 Ca 0.22 -1.48 0.02 0.00 -0.15 0.00 0.00 54.97 53.57 1sc8 s GLU 137 Cb 0.07 -2.01 -0.02 0.00 -0.44 0.00 0.00 34.13 31.73 1sc8 s GLU 137 CO 0.00 0.38 -0.07 0.96 0.95 0.00 0.00 175.26 177.48 1sc8 s ILE 138 N -2.11 0.50 0.06 1.83 -4.36 -0.86 -0.32 121.20 115.94 1sc8 s ILE 138 Ca 0.28 -0.86 0.05 0.00 -0.26 0.00 0.00 60.65 59.85 1sc8 s ILE 138 Cb -0.07 -0.54 -0.03 0.00 1.25 0.00 0.00 42.46 43.08 1sc8 s ILE 138 CO 0.16 -0.26 -0.13 -0.89 0.24 0.00 0.00 174.94 174.06 1sc8 s THR 139 N -1.06 1.01 -0.14 8.37 2.01 -1.24 -1.96 115.64 122.63 1sc8 s THR 139 Ca -0.07 -1.23 -0.34 0.00 0.31 0.00 0.00 61.69 60.36 1sc8 s THR 139 Cb -0.08 -0.98 0.15 0.00 0.01 0.00 0.00 72.50 71.60 1sc8 s THR 139 CO 0.00 -0.23 1.41 -0.83 -0.69 0.00 0.00 174.62 174.28 1sc8 s GLY 140 N -1.65 -0.43 -0.05 4.40 0.00 -0.78 -4.47 107.32 104.34 1sc8 s GLY 140 Ca -0.03 1.17 0.15 0.00 0.00 0.00 0.00 44.72 46.01 1sc8 s GLY 140 CO 0.02 0.28 1.41 0.69 0.00 0.00 0.00 173.10 175.50 1sc8 n PHE 141 N -0.38 0.84 -1.18 1.90 3.72 -1.26 -2.29 117.46 118.81 1sc8 n PHE 141 Ca -0.06 -0.59 -0.29 0.00 -0.05 0.00 0.00 57.45 56.46 1sc8 n PHE 141 Cb 0.62 -0.12 0.18 0.00 -0.94 0.00 0.00 39.48 39.23 1sc8 n PHE 141 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1sc8 s GLY 142 N -1.14 1.56 0.49 1.37 0.00 -1.21 -3.86 107.32 104.53 1sc8 s GLY 142 Ca 0.36 -0.47 -0.20 0.00 0.00 0.00 0.00 44.72 44.41 1sc8 s GLY 142 CO 0.19 0.18 0.47 0.28 0.00 0.00 0.00 173.10 174.22 1sc8 n LYS 143 N -4.25 0.50 -0.01 2.90 5.02 -0.62 -1.64 118.16 120.06 1sc8 n LYS 143 Ca 0.06 0.19 0.07 0.00 -2.02 0.00 0.00 58.31 56.61 1sc8 n LYS 143 Cb 0.58 -1.53 -0.15 0.00 -0.02 0.00 0.00 35.03 33.91 1sc8 n LYS 143 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1sc8 n GLU 144 N 0.45 0.66 -3.86 1.97 1.02 -1.26 -0.38 120.64 119.24 1sc8 n GLU 144 Ca 0.11 -0.13 -0.12 0.00 -0.02 0.00 0.00 57.16 57.01 1sc8 n GLU 144 Cb 0.43 -1.56 -0.12 0.00 -0.02 0.00 0.00 31.44 30.18 1sc8 n GLU 144 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 1sc8 s ASN 145 N -4.80 -0.05 0.46 1.62 -0.87 -1.26 -4.23 114.94 105.81 1sc8 s ASN 145 Ca -0.08 0.05 0.14 0.00 -1.57 0.00 0.00 52.86 51.41 1sc8 s ASN 145 Cb 0.12 0.21 1.08 0.00 -0.02 0.00 0.00 41.25 42.65 1sc8 s ASN 145 CO 0.88 -0.15 2.04 0.28 -2.57 0.00 0.00 177.10 177.59 1sc8 h SER 146 N 5.43 0.26 1.00 -1.22 0.02 -1.91 -2.05 113.55 115.08 1sc8 h SER 146 Ca -0.27 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.68 1sc8 h SER 146 Cb 1.20 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.68 1sc8 h SER 146 CO 0.43 0.18 0.00 0.35 -1.14 0.00 0.00 176.83 176.64 1sc8 n THR 147 N -4.48 0.03 -1.58 -2.27 -2.24 -1.26 -4.88 114.28 97.61 1sc8 n THR 147 Ca 0.05 -0.00 -0.33 0.00 -2.27 0.00 0.00 64.05 61.50 1sc8 n THR 147 Cb 0.25 -0.51 0.07 0.00 -2.10 0.00 0.00 70.33 68.03 1sc8 n THR 147 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1sc8 s ASP 148 N -3.03 4.80 0.00 3.42 1.01 -0.77 -4.94 116.67 117.16 1sc8 s ASP 148 Ca 0.14 2.01 0.00 0.00 0.71 0.00 0.00 52.55 55.40 1sc8 s ASP 148 Cb 0.19 -2.55 0.00 0.00 1.01 0.00 0.00 42.92 41.57 1sc8 s ASP 148 CO 0.53 -1.84 0.34 0.00 0.21 0.00 0.00 175.17 174.41 1sc8 n TYR 149 N -2.75 0.00 -4.46 4.23 4.11 -1.26 -5.00 117.16 112.03 1sc8 n TYR 149 Ca 0.10 0.00 -0.24 0.00 -0.00 0.00 0.00 57.90 57.76 1sc8 n TYR 149 Cb 0.52 0.00 -0.10 0.00 -0.00 0.00 0.00 39.34 39.76 1sc8 n TYR 149 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.86 176.35 1sc8 s LEU 150 N -0.60 2.60 0.07 -3.48 1.43 -1.26 -5.15 118.68 112.29 1sc8 s LEU 150 Ca 0.00 -1.00 0.01 0.00 -1.03 0.00 0.00 54.13 52.11 1sc8 s LEU 150 Cb 0.00 -1.13 -0.04 0.00 0.03 0.00 0.00 46.19 45.05 1sc8 s LEU 150 CO 0.00 0.05 0.19 -0.31 0.23 0.00 0.00 176.35 176.50 1sc8 s TYR 151 N -2.42 3.44 0.58 0.29 2.02 -1.26 -4.72 117.35 115.28 1sc8 s TYR 151 Ca 0.29 0.20 -0.20 0.00 -0.37 0.00 0.00 57.07 56.99 1sc8 s TYR 151 Cb -0.05 -1.72 -0.04 0.00 -0.40 0.00 0.00 41.96 39.75 1sc8 s TYR 151 CO 0.15 0.57 1.32 -1.25 -1.57 0.00 0.00 175.55 174.77 1sc8 s PRO 152 N -2.54 2.97 0.29 -1.71 0.04 -1.25 -4.91 135.00 127.89 1sc8 s PRO 152 Ca 0.34 2.14 0.14 0.00 0.04 0.00 0.00 61.00 63.66 1sc8 s PRO 152 Cb -0.13 -2.11 0.33 0.00 0.04 0.00 0.00 34.50 32.63 1sc8 s PRO 152 CO 0.27 -1.29 1.57 1.49 0.04 0.00 0.00 177.00 179.07 1sc8 h GLU 153 N 1.16 0.00 -6.20 4.56 4.57 -1.98 -3.43 114.58 113.25 1sc8 h GLU 153 Ca -0.51 0.00 -0.67 0.00 -1.18 0.00 0.00 59.36 57.01 1sc8 h GLU 153 Cb 1.31 0.00 -0.14 0.00 -0.16 0.00 0.00 28.75 29.76 1sc8 h GLU 153 CO 0.56 0.55 -0.66 -1.14 -1.18 0.00 0.00 179.01 177.14 1sc8 s GLN 154 N -3.30 2.71 0.60 1.92 2.00 -1.26 -0.42 119.66 121.91 1sc8 s GLN 154 Ca 0.01 -0.66 -0.20 0.00 -2.00 0.00 0.00 55.36 52.52 1sc8 s GLN 154 Cb 0.10 -2.62 -0.03 0.00 0.80 0.00 0.00 33.01 31.27 1sc8 s GLN 154 CO 0.74 0.61 1.33 -1.17 -0.50 0.00 0.00 175.29 176.29 1sc8 s LEU 155 N -1.60 3.69 0.19 3.68 2.96 -0.64 -4.90 118.68 122.07 1sc8 s LEU 155 Ca 0.20 2.69 0.01 0.00 -0.22 0.00 0.00 54.13 56.81 1sc8 s LEU 155 Cb -0.11 -4.47 -0.05 0.00 0.50 0.00 0.00 46.19 42.06 1sc8 s LEU 155 CO 0.10 -1.83 0.03 -0.54 -1.32 0.00 0.00 176.35 172.80 1sc8 s LYS 156 N -3.18 1.19 0.15 1.98 1.02 -0.97 -2.14 119.74 117.79 1sc8 s LYS 156 Ca 0.78 -1.59 -0.16 0.00 0.02 0.00 0.00 55.97 55.02 1sc8 s LYS 156 Cb -0.39 -0.24 0.03 0.00 -0.52 0.00 0.00 37.83 36.71 1sc8 s LYS 156 CO 0.43 -0.18 0.42 0.00 -0.92 0.00 0.00 175.35 175.10 1sc8 s MET 157 N -3.96 1.16 0.35 1.68 0.23 -0.48 -1.86 119.30 116.42 1sc8 s MET 157 Ca 0.28 -0.79 -0.13 0.00 -1.03 0.00 0.00 55.69 54.01 1sc8 s MET 157 Cb 0.07 0.47 0.03 0.00 -1.53 0.00 0.00 34.83 33.87 1sc8 s MET 157 CO 0.07 -0.46 0.68 -0.08 -2.03 0.00 0.00 175.02 173.20 1sc8 s THR 158 N -3.84 0.00 -0.04 3.16 -1.32 -0.83 -1.00 115.64 111.77 1sc8 s THR 158 Ca 0.06 -1.17 0.05 0.00 -1.21 0.00 0.00 61.69 59.41 1sc8 s THR 158 Cb 0.01 -2.64 -0.00 0.00 -1.51 0.00 0.00 72.50 68.36 1sc8 s THR 158 CO -0.08 0.00 -0.18 -0.69 -2.21 0.00 0.00 174.62 171.45 1sc8 s VAL 159 N -2.87 1.52 0.23 5.08 1.01 -1.26 -2.02 120.40 122.09 1sc8 s VAL 159 Ca 0.19 -0.77 0.00 0.00 0.00 0.00 0.00 61.98 61.40 1sc8 s VAL 159 Cb -0.04 -1.30 -0.05 0.00 0.00 0.00 0.00 36.38 35.00 1sc8 s VAL 159 CO 0.13 0.43 0.12 0.68 0.00 0.00 0.00 175.10 176.45 1sc8 s VAL 160 N -0.02 0.27 0.05 2.92 -7.23 -0.19 -4.75 120.40 111.45 1sc8 s VAL 160 Ca -0.03 -2.00 0.06 0.00 -1.81 0.00 0.00 61.98 58.20 1sc8 s VAL 160 Cb -0.12 -2.57 -0.04 0.00 0.56 0.00 0.00 36.38 34.22 1sc8 s VAL 160 CO 0.02 0.00 -0.12 -0.54 -0.31 0.00 0.00 175.10 174.15 1sc8 s LYS 161 N -4.09 2.21 0.14 4.82 1.02 -0.40 -0.71 119.74 122.73 1sc8 s LYS 161 Ca 0.38 -0.93 -0.30 0.00 0.02 0.00 0.00 55.97 55.14 1sc8 s LYS 161 Cb 0.07 -2.31 -0.07 0.00 -0.52 0.00 0.00 37.83 35.00 1sc8 s LYS 161 CO 0.13 0.55 1.14 -0.51 -0.92 0.00 0.00 175.35 175.74 1sc8 s LEU 162 N -1.69 4.44 -0.04 3.17 1.02 -0.78 -1.15 118.68 123.64 1sc8 s LEU 162 Ca 0.17 2.07 -0.01 0.00 0.02 0.00 0.00 54.13 56.39 1sc8 s LEU 162 Cb -0.11 -3.60 -0.04 0.00 0.02 0.00 0.00 46.19 42.47 1sc8 s LEU 162 CO 0.09 -0.33 0.04 -0.63 0.02 0.00 0.00 176.35 175.54 1sc8 s ILE 163 N 0.25 4.54 0.70 -0.59 1.01 0.73 -0.51 121.20 127.33 1sc8 s ILE 163 Ca 0.53 -0.33 -0.15 0.00 0.00 0.00 0.00 60.65 60.70 1sc8 s ILE 163 Cb -0.30 -3.00 0.03 0.00 0.01 0.00 0.00 42.46 39.20 1sc8 s ILE 163 CO 0.33 0.47 1.18 -0.94 0.00 0.00 0.00 174.94 175.98 1sc8 s SER 164 N -1.33 4.50 0.36 3.58 1.04 -1.26 -4.32 113.70 116.27 1sc8 s SER 164 Ca 0.18 2.25 0.06 0.00 0.48 0.00 0.00 55.95 58.92 1sc8 s SER 164 Cb -0.12 -2.58 0.67 0.00 0.10 0.00 0.00 66.02 64.10 1sc8 s SER 164 CO 0.08 -2.05 1.90 -0.74 0.98 0.00 0.00 173.24 173.41 1sc8 h HIS 165 N -0.16 0.47 -0.23 5.02 2.76 -1.96 -2.08 115.15 118.98 1sc8 h HIS 165 Ca -0.47 -0.04 -0.00 0.00 -2.20 0.00 0.00 60.37 57.65 1sc8 h HIS 165 Cb 1.28 -0.14 -0.01 0.00 1.55 0.00 0.00 27.41 30.09 1sc8 h HIS 165 CO 0.49 0.47 0.13 -0.09 -1.30 0.00 0.00 177.93 177.64 1sc8 h ARG 166 N 0.44 0.32 -0.45 5.26 2.43 -1.98 -1.99 114.38 118.41 1sc8 h ARG 166 Ca 0.10 -0.03 -0.06 0.00 -0.81 0.00 0.00 59.98 59.17 1sc8 h ARG 166 Cb 0.30 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.77 1sc8 h ARG 166 CO 0.01 0.28 0.04 1.49 -1.51 0.00 0.00 179.97 180.27 1sc8 h GLU 167 N 0.27 0.78 0.00 0.20 4.81 -1.86 -2.88 114.58 115.90 1sc8 h GLU 167 Ca 0.08 -0.23 -0.00 0.00 -0.13 0.00 0.00 59.36 59.08 1sc8 h GLU 167 Cb 0.04 -0.08 -0.00 0.00 0.63 0.00 0.00 28.75 29.34 1sc8 h GLU 167 CO -0.01 0.82 -0.01 0.00 -0.73 0.00 0.00 179.01 179.08 1sc8 n GLN 169 N -3.10 1.62 -1.81 0.00 7.27 -0.76 -2.04 117.38 118.56 1sc8 n GLN 169 Ca -0.00 -0.91 -0.35 0.00 0.07 0.00 0.00 57.00 55.80 1sc8 n GLN 169 Cb 0.24 -1.44 0.05 0.00 2.41 0.00 0.00 30.24 31.51 1sc8 n GLN 169 CO 0.00 0.00 0.00 -0.65 0.07 0.00 0.00 177.06 176.48 1sc8 s GLN 170 N -1.92 2.70 0.24 3.69 -1.52 -0.82 -3.60 119.66 118.43 1sc8 s GLN 170 Ca 0.36 1.75 -0.05 0.00 -1.95 0.00 0.00 55.36 55.47 1sc8 s GLN 170 Cb 0.19 -1.90 0.43 0.00 -0.22 0.00 0.00 33.01 31.51 1sc8 s GLN 170 CO 0.30 -1.40 1.72 -1.35 -0.25 0.00 0.00 175.29 174.31 1sc8 h PRO 170 N 0.43 0.37 0.00 2.91 0.11 -1.91 -0.82 132.00 133.09 1sc8 h PRO 170 Ca -0.49 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1sc8 h PRO 170 Cb 1.29 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1sc8 h PRO 170 CO 0.53 0.25 0.00 0.72 -0.21 0.00 0.00 178.00 179.29 1sc8 n HIS 170 N -5.05 0.55 0.00 0.65 8.25 -1.26 -4.44 115.22 113.93 1sc8 n HIS 170 Ca 0.13 0.19 0.00 0.00 -0.26 0.00 0.00 57.72 57.78 1sc8 n HIS 170 Cb 0.41 -0.81 0.00 0.00 1.12 0.00 0.00 29.99 30.71 1sc8 n HIS 170 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1sc8 n TYR 171 N -1.98 0.00 0.09 4.41 4.02 -0.36 -4.81 117.16 118.53 1sc8 n TYR 171 Ca 0.04 0.00 0.01 0.00 -0.01 0.00 0.00 57.90 57.94 1sc8 n TYR 171 Cb 0.30 0.00 0.01 0.00 -0.02 0.00 0.00 39.34 39.63 1sc8 n TYR 171 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 1sc8 n TYR 172 N 0.00 0.00 -4.57 -0.72 4.01 -0.86 -4.92 117.16 110.09 1sc8 n TYR 172 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 1sc8 n TYR 172 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.03 1sc8 n TYR 172 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1sc8 n GLY 173 N 0.25 2.31 0.00 2.72 0.00 -0.89 -2.14 105.19 107.44 1sc8 n GLY 173 Ca 0.01 -0.43 0.09 0.00 0.00 0.00 0.00 46.02 45.69 1sc8 n GLY 173 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1sc8 n SER 174 N -0.42 0.00 -0.03 1.61 7.64 -1.26 -3.57 113.62 117.59 1sc8 n SER 174 Ca 0.00 -1.29 -0.03 0.00 1.01 0.00 0.00 58.87 58.56 1sc8 n SER 174 Cb 0.00 0.00 0.21 0.00 -1.01 0.00 0.00 64.21 63.41 1sc8 n SER 174 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 1sc8 h GLU 175 N 0.00 0.60 -5.95 1.43 4.39 -1.82 -3.42 114.58 109.81 1sc8 h GLU 175 Ca 0.00 -0.18 -0.57 0.00 0.34 0.00 0.00 59.36 58.95 1sc8 h GLU 175 Cb 0.00 -0.06 -0.06 0.00 -0.10 0.00 0.00 28.75 28.53 1sc8 h GLU 175 CO 0.00 0.70 -0.02 0.14 -1.16 0.00 0.00 179.01 178.68 1sc8 s VAL 176 N -4.77 5.05 0.38 3.13 -7.23 -1.23 -4.75 120.40 110.98 1sc8 s VAL 176 Ca -0.08 1.22 0.03 0.00 -1.81 0.00 0.00 61.98 61.35 1sc8 s VAL 176 Cb 0.14 -3.93 0.03 0.00 0.56 0.00 0.00 36.38 33.18 1sc8 s VAL 176 CO 0.79 0.33 0.26 0.35 -0.31 0.00 0.00 175.10 176.52 1sc8 n THR 177 N 3.41 0.00 0.80 5.32 -2.24 -1.26 -4.95 114.28 115.36 1sc8 n THR 177 Ca -0.05 -1.53 0.11 0.00 -2.27 0.00 0.00 64.05 60.31 1sc8 n THR 177 Cb 0.51 -0.12 0.50 0.00 -2.10 0.00 0.00 70.33 69.12 1sc8 n THR 177 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1sc8 n THR 178 N -1.35 0.39 1.63 4.28 -2.24 -1.26 -2.40 114.28 113.33 1sc8 n THR 178 Ca -0.03 0.09 0.14 0.00 -2.27 0.00 0.00 64.05 61.99 1sc8 n THR 178 Cb 0.44 -0.69 0.63 0.00 -2.10 0.00 0.00 70.33 68.60 1sc8 n THR 178 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1sc8 n LYS 179 N -1.51 1.47 -4.43 -0.78 5.02 -1.26 -4.86 118.16 111.81 1sc8 n LYS 179 Ca 0.06 -0.69 -0.25 0.00 -2.02 0.00 0.00 58.31 55.41 1sc8 n LYS 179 Cb 0.28 -1.47 -0.11 0.00 -0.02 0.00 0.00 35.03 33.70 1sc8 n LYS 179 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 1sc8 s MET 180 N -1.99 1.56 -0.02 1.97 -1.94 -1.01 -0.89 119.30 116.98 1sc8 s MET 180 Ca 0.40 -1.63 0.04 0.00 -1.71 0.00 0.00 55.69 52.79 1sc8 s MET 180 Cb 0.21 -1.73 -0.01 0.00 2.01 0.00 0.00 34.83 35.31 1sc8 s MET 180 CO 0.34 0.34 -0.15 -0.51 -0.01 0.00 0.00 175.02 175.03 1sc8 s LEU 181 N -3.09 1.95 -0.08 -0.03 1.43 0.14 -4.78 118.68 114.22 1sc8 s LEU 181 Ca 0.25 -0.29 -0.02 0.00 -1.03 0.00 0.00 54.13 53.04 1sc8 s LEU 181 Cb -0.06 -0.81 -0.03 0.00 0.03 0.00 0.00 46.19 45.32 1sc8 s LEU 181 CO 0.12 0.16 0.03 0.00 0.23 0.00 0.00 176.35 176.88 1sc8 s ALA 183 N -0.94 -0.71 0.05 0.00 0.00 -0.67 -0.19 121.76 119.30 1sc8 s ALA 183 Ca 0.14 0.44 -0.28 0.00 0.00 0.00 0.00 51.96 52.26 1sc8 s ALA 183 Cb -0.11 -0.11 0.09 0.00 0.00 0.00 0.00 23.12 22.99 1sc8 s ALA 183 CO 0.04 -0.22 1.02 0.00 0.00 0.00 0.00 175.76 176.60 1sc8 s ALA 184 N -0.85 -1.84 -0.00 0.00 0.00 -0.30 -0.74 121.76 118.02 1sc8 s ALA 184 Ca -0.09 0.61 -0.28 0.00 0.00 0.00 0.00 51.96 52.20 1sc8 s ALA 184 Cb -0.05 0.46 -0.04 0.00 0.00 0.00 0.00 23.12 23.50 1sc8 s ALA 184 CO 0.03 -0.91 0.88 0.34 0.00 0.00 0.00 175.76 176.10 1sc8 s ASP 185 N -2.75 7.26 0.66 0.00 2.15 -1.26 -1.28 116.67 121.46 1sc8 s ASP 185 Ca 0.10 1.52 0.38 0.00 0.43 0.00 0.00 52.55 54.98 1sc8 s ASP 185 Cb -0.00 -2.52 2.05 0.00 -0.30 0.00 0.00 42.92 42.15 1sc8 s ASP 185 CO -0.03 -0.17 2.16 1.55 -0.17 0.00 0.00 175.17 178.51 1sc8 h PRO 185 N 6.56 0.00 -0.02 4.34 0.13 -1.94 0.18 132.00 141.24 1sc8 h PRO 185 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 1sc8 h PRO 185 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1sc8 h PRO 185 CO 0.74 0.00 -0.15 1.04 -0.23 0.00 0.00 178.00 179.40 1sc8 n GLN 185 N -3.03 1.84 -3.16 0.86 6.02 -1.26 -4.98 117.38 113.67 1sc8 n GLN 185 Ca -0.02 -1.54 -0.23 0.00 -0.01 0.00 0.00 57.00 55.20 1sc8 n GLN 185 Cb 0.22 -1.43 0.04 0.00 1.02 0.00 0.00 30.24 30.09 1sc8 n GLN 185 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 177.06 176.96 1sc8 n TRP 186 N 0.82 -2.15 -0.13 1.08 7.02 0.62 -4.91 117.44 119.79 1sc8 n TRP 186 Ca 0.12 0.62 -0.18 0.00 -1.02 0.00 0.00 57.50 57.04 1sc8 n TRP 186 Cb 0.52 -4.56 -0.12 0.00 -2.42 0.00 0.00 31.31 24.72 1sc8 n TRP 186 CO 0.00 0.00 0.00 1.63 -2.02 0.00 0.00 177.69 177.30 1sc8 n LYS 187 N -4.23 0.65 -4.25 -0.99 4.76 -1.26 -4.70 118.16 108.15 1sc8 n LYS 187 Ca -0.08 0.15 -0.29 0.00 -2.87 0.00 0.00 58.31 55.22 1sc8 n LYS 187 Cb 0.61 -1.53 -0.10 0.00 -1.84 0.00 0.00 35.03 32.17 1sc8 n LYS 187 CO 0.00 0.00 0.00 -0.08 -1.37 0.00 0.00 177.40 175.95 1sc8 s THR 188 N -2.52 3.30 -0.03 -0.18 -1.32 -1.26 -4.53 115.64 109.10 1sc8 s THR 188 Ca -0.35 -1.40 -0.31 0.00 -1.21 0.00 0.00 61.69 58.43 1sc8 s THR 188 Cb 0.09 -2.58 0.12 0.00 -1.51 0.00 0.00 72.50 68.62 1sc8 s THR 188 CO 0.61 0.04 1.26 -0.62 -2.21 0.00 0.00 174.62 173.70 1sc8 s ASP 189 N -2.41 -0.07 0.61 8.08 2.15 -1.04 -4.00 116.67 119.98 1sc8 s ASP 189 Ca 0.22 -0.13 -0.07 0.00 0.43 0.00 0.00 52.55 53.00 1sc8 s ASP 189 Cb -0.10 0.18 0.00 0.00 -0.30 0.00 0.00 42.92 42.70 1sc8 s ASP 189 CO 0.14 -0.32 0.94 -0.94 -0.17 0.00 0.00 175.17 174.82 1sc8 s SER 190 N -2.88 5.64 0.29 -0.34 1.04 -1.26 -0.38 113.70 115.82 1sc8 s SER 190 Ca 0.13 0.85 -0.04 0.00 0.48 0.00 0.00 55.95 57.37 1sc8 s SER 190 Cb 0.04 -1.83 0.02 0.00 0.10 0.00 0.00 66.02 64.34 1sc8 s SER 190 CO -0.04 -1.07 0.45 0.00 0.98 0.00 0.00 173.24 173.56 1sc8 n GLN 192 N -0.46 1.61 0.00 0.00 7.27 -1.26 -0.97 117.38 123.58 1sc8 n GLN 192 Ca -0.01 0.59 0.00 0.00 0.07 0.00 0.00 57.00 57.64 1sc8 n GLN 192 Cb 0.47 -2.31 0.00 0.00 2.41 0.00 0.00 30.24 30.81 1sc8 n GLN 192 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1sc8 n GLY 193 N 3.47 0.41 0.58 1.69 0.00 -1.26 -1.58 105.19 108.50 1sc8 n GLY 193 Ca 0.20 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.34 1sc8 n GLY 193 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1sc8 n ASP 194 N 0.00 2.14 -4.64 1.61 8.00 -0.14 -3.35 116.55 120.17 1sc8 n ASP 194 Ca 0.00 -1.57 -0.41 0.00 0.71 0.00 0.00 54.79 53.52 1sc8 n ASP 194 Cb 0.00 0.33 0.01 0.00 -0.02 0.00 0.00 41.12 41.43 1sc8 n ASP 194 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1sc8 n SER 195 N 0.23 1.66 0.00 -2.24 7.64 -1.26 -2.03 113.62 117.62 1sc8 n SER 195 Ca 0.11 1.07 0.00 0.00 1.01 0.00 0.00 58.87 61.06 1sc8 n SER 195 Cb 0.48 -1.39 0.00 0.00 -1.01 0.00 0.00 64.21 62.29 1sc8 n SER 195 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1sc8 n GLY 196 N 1.07 2.76 3.75 0.23 0.00 -0.14 -0.73 105.19 112.12 1sc8 n GLY 196 Ca 0.09 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.81 1sc8 n GLY 196 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1sc8 s GLY 197 N -1.79 1.58 0.10 -0.02 0.00 -0.86 -3.04 107.32 103.30 1sc8 s GLY 197 Ca 0.00 -0.37 -0.17 0.00 0.00 0.00 0.00 44.72 44.18 1sc8 s GLY 197 CO 0.00 0.18 0.56 2.56 0.00 0.00 0.00 173.10 176.40 1sc8 s PRO 198 N -5.12 4.10 -0.41 2.90 0.04 -1.26 -1.57 135.00 133.68 1sc8 s PRO 198 Ca 0.64 0.63 -0.08 0.00 0.04 0.00 0.00 61.00 62.23 1sc8 s PRO 198 Cb -0.16 -3.10 0.08 0.00 0.04 0.00 0.00 34.50 31.36 1sc8 s PRO 198 CO 0.55 0.57 0.24 -1.17 0.04 0.00 0.00 177.00 177.23 1sc8 s LEU 199 N -1.47 5.12 -0.17 -3.56 2.96 0.21 -3.68 118.68 118.09 1sc8 s LEU 199 Ca 0.33 -1.59 -0.08 0.00 -0.22 0.00 0.00 54.13 52.56 1sc8 s LEU 199 Cb -0.17 -1.95 -0.04 0.00 0.50 0.00 0.00 46.19 44.52 1sc8 s LEU 199 CO 0.19 -0.53 0.10 -0.69 -1.32 0.00 0.00 176.35 174.10 1sc8 s VAL 200 N 1.37 5.16 0.01 1.68 1.01 0.56 -1.30 120.40 128.89 1sc8 s VAL 200 Ca 0.03 0.09 0.04 0.00 0.00 0.00 0.00 61.98 62.15 1sc8 s VAL 200 Cb -0.23 -3.31 -0.02 0.00 0.00 0.00 0.00 36.38 32.83 1sc8 s VAL 200 CO 0.01 0.50 -0.12 0.00 0.00 0.00 0.00 175.10 175.48 1sc8 s SER 202 N -0.72 6.43 -0.24 0.00 0.15 -1.26 -0.60 113.70 117.45 1sc8 s SER 202 Ca 0.02 -0.08 -0.03 0.00 0.70 0.00 0.00 55.95 56.56 1sc8 s SER 202 Cb -0.06 -2.44 0.01 0.00 -1.71 0.00 0.00 66.02 61.82 1sc8 s SER 202 CO 0.00 -1.09 -0.04 -0.22 1.20 0.00 0.00 173.24 173.09 1sc8 s LEU 203 N 3.75 3.12 -1.27 3.45 0.20 0.40 -4.65 118.68 123.69 1sc8 s LEU 203 Ca 0.34 -0.67 -0.03 0.00 0.69 0.00 0.00 54.13 54.45 1sc8 s LEU 203 Cb -0.11 -1.71 -0.01 0.00 -0.43 0.00 0.00 46.19 43.93 1sc8 s LEU 203 CO 0.23 -0.09 0.70 0.00 -0.29 0.00 0.00 176.35 176.90 1sc8 n GLN 204 N 4.74 -4.08 -3.34 1.98 6.02 -1.26 -2.18 117.38 119.26 1sc8 n GLN 204 Ca -0.17 0.60 -0.22 0.00 -0.01 0.00 0.00 57.00 57.20 1sc8 n GLN 204 Cb 0.49 -5.02 0.06 0.00 1.02 0.00 0.00 30.24 26.79 1sc8 n GLN 204 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1sc8 n GLY 205 N -1.60 -0.45 3.39 1.08 0.00 -1.26 -5.01 105.19 101.34 1sc8 n GLY 205 Ca -0.26 0.16 -0.10 0.00 0.00 0.00 0.00 46.02 45.82 1sc8 n GLY 205 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1sc8 s ARG 206 N -6.03 0.50 0.03 1.61 3.52 -0.93 -5.13 118.95 112.53 1sc8 s ARG 206 Ca 0.46 0.89 -0.30 0.00 -0.13 0.00 0.00 55.73 56.65 1sc8 s ARG 206 Cb -0.20 0.06 -0.07 0.00 -1.56 0.00 0.00 34.95 33.18 1sc8 s ARG 206 CO 0.57 -0.14 1.52 -1.64 -0.81 0.00 0.00 175.30 174.80 1sc8 s MET 207 N 1.31 4.24 -0.02 5.12 -1.94 -1.26 -0.45 119.30 126.29 1sc8 s MET 207 Ca -0.08 2.14 0.04 0.00 -1.71 0.00 0.00 55.69 56.07 1sc8 s MET 207 Cb -0.07 -3.59 -0.00 0.00 2.01 0.00 0.00 34.83 33.18 1sc8 s MET 207 CO -0.13 -0.65 -0.13 0.99 -0.01 0.00 0.00 175.02 175.09 1sc8 s THR 208 N 2.53 1.05 -1.09 2.05 2.01 0.23 -3.86 115.64 118.57 1sc8 s THR 208 Ca 0.69 -0.54 -0.22 0.00 0.31 0.00 0.00 61.69 61.93 1sc8 s THR 208 Cb -0.35 -0.89 0.02 0.00 0.01 0.00 0.00 72.50 71.29 1sc8 s THR 208 CO 0.29 0.30 1.66 -0.22 -0.69 0.00 0.00 174.62 175.97 1sc8 s LEU 209 N -0.09 3.48 0.18 4.42 0.20 -0.29 -1.73 118.68 124.85 1sc8 s LEU 209 Ca 0.01 -1.58 0.04 0.00 0.69 0.00 0.00 54.13 53.28 1sc8 s LEU 209 Cb -0.07 -2.57 0.03 0.00 -0.43 0.00 0.00 46.19 43.15 1sc8 s LEU 209 CO 0.00 -1.81 1.41 0.74 -0.29 0.00 0.00 176.35 176.40 1sc8 h THR 210 N 6.51 1.50 -3.46 3.68 2.02 -1.52 -3.40 112.91 118.23 1sc8 h THR 210 Ca 0.25 -2.58 -0.03 0.00 0.77 0.00 0.00 66.41 64.82 1sc8 h THR 210 Cb 0.97 2.42 -0.07 0.00 -1.74 0.00 0.00 68.15 69.72 1sc8 h THR 210 CO 1.38 0.75 -0.01 -0.83 0.37 0.00 0.00 175.52 177.18 1sc8 s GLY 211 N -4.50 0.40 -0.08 2.16 0.00 -0.98 -2.59 107.32 101.73 1sc8 s GLY 211 Ca -0.03 -0.75 0.04 0.00 0.00 0.00 0.00 44.72 43.98 1sc8 s GLY 211 CO 0.82 -0.48 -0.20 -0.42 0.00 0.00 0.00 173.10 172.82 1sc8 s ILE 212 N -3.86 1.73 0.08 0.90 1.01 -1.00 -0.62 121.20 119.44 1sc8 s ILE 212 Ca 0.19 -0.84 -0.30 0.00 0.00 0.00 0.00 60.65 59.70 1sc8 s ILE 212 Cb -0.02 -1.51 -0.10 0.00 0.01 0.00 0.00 42.46 40.84 1sc8 s ILE 212 CO 0.09 0.49 1.91 -0.69 0.00 0.00 0.00 174.94 176.74 1sc8 s VAL 213 N 0.38 2.79 0.08 2.92 1.01 -0.61 -1.32 120.40 125.65 1sc8 s VAL 213 Ca -0.15 0.02 0.00 0.00 0.00 0.00 0.00 61.98 61.85 1sc8 s VAL 213 Cb -0.17 -3.01 0.00 0.00 0.00 0.00 0.00 36.38 33.20 1sc8 s VAL 213 CO 0.07 -0.00 0.00 -0.24 0.00 0.00 0.00 175.10 174.92 1sc8 n SER 214 N 6.72 0.52 -3.38 3.32 2.88 -1.01 -0.97 113.62 121.69 1sc8 n SER 214 Ca 0.19 0.13 -0.11 0.00 -1.33 0.00 0.00 58.87 57.74 1sc8 n SER 214 Cb 0.40 -0.11 -0.03 0.00 -0.75 0.00 0.00 64.21 63.72 1sc8 n SER 214 CO 0.00 0.00 0.00 -1.66 -1.23 0.00 0.00 175.04 172.15 1sc8 s TRP 215 N -1.60 0.60 0.00 0.66 1.48 -0.95 -4.93 118.94 114.19 1sc8 s TRP 215 Ca 0.00 -0.98 0.00 0.00 -1.06 0.00 0.00 56.10 54.06 1sc8 s TRP 215 Cb 0.00 0.25 0.00 0.00 -1.16 0.00 0.00 33.47 32.56 1sc8 s TRP 215 CO 0.00 -1.22 0.00 0.41 -4.06 0.00 0.00 176.95 172.08 1sc8 n GLY 216 N -0.51 1.71 3.62 3.67 0.00 -1.26 0.09 105.19 112.51 1sc8 n GLY 216 Ca -0.02 -0.56 -0.42 0.00 0.00 0.00 0.00 46.02 45.02 1sc8 n GLY 216 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1sc8 s ARG 217 N -2.00 4.03 2.94 1.61 6.06 -1.26 -4.88 118.95 125.44 1sc8 s ARG 217 Ca 0.00 0.67 0.00 0.00 -2.50 0.00 0.00 55.73 53.90 1sc8 s ARG 217 Cb 0.00 -3.70 0.00 0.00 0.06 0.00 0.00 34.95 31.31 1sc8 s ARG 217 CO 0.00 -0.62 0.00 0.41 -2.50 0.00 0.00 175.30 172.59 1sc8 n GLY 219 N 4.09 0.58 2.71 8.12 0.00 -1.26 -4.60 105.19 114.82 1sc8 n GLY 219 Ca 0.04 -0.89 -0.20 0.00 0.00 0.00 0.00 46.02 44.97 1sc8 n GLY 219 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sc8 n ALA 221 N 5.30 -0.38 -2.11 0.00 0.00 -1.26 -4.89 120.51 117.18 1sc8 n ALA 221 Ca -0.05 0.11 -0.36 0.00 0.00 0.00 0.00 53.44 53.14 1sc8 n ALA 221 Cb 0.50 -1.54 -0.06 0.00 0.00 0.00 0.00 19.45 18.34 1sc8 n ALA 221 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1sc8 s LEU 222 N -3.68 4.34 0.24 0.00 1.43 -1.26 -4.72 118.68 115.03 1sc8 s LEU 222 Ca 0.00 1.41 -0.31 0.00 -1.03 0.00 0.00 54.13 54.19 1sc8 s LEU 222 Cb 0.00 -3.57 -0.12 0.00 0.03 0.00 0.00 46.19 42.53 1sc8 s LEU 222 CO 0.00 0.04 1.67 1.17 0.23 0.00 0.00 176.35 179.46 1sc8 n LYS 223 N 0.73 2.74 -1.67 1.70 4.81 -1.26 -2.15 118.16 123.06 1sc8 n LYS 223 Ca -0.02 0.98 -0.18 0.00 -0.87 0.00 0.00 58.31 58.22 1sc8 n LYS 223 Cb 0.51 -2.80 -0.07 0.00 0.02 0.00 0.00 35.03 32.69 1sc8 n LYS 223 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1sc8 n ASP 223 N 3.26 -5.20 -3.36 3.14 8.00 -1.26 -4.92 116.55 116.22 1sc8 n ASP 223 Ca 0.13 0.37 -0.26 0.00 0.71 0.00 0.00 54.79 55.74 1sc8 n ASP 223 Cb 0.35 -4.29 -0.08 0.00 -0.02 0.00 0.00 41.12 37.08 1sc8 n ASP 223 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1sc8 n LYS 224 N -2.52 1.63 -0.64 -1.24 4.76 -0.91 -4.23 118.16 115.01 1sc8 n LYS 224 Ca -0.19 -4.00 -0.31 0.00 -2.87 0.00 0.00 58.31 50.95 1sc8 n LYS 224 Cb 0.61 -1.81 0.18 0.00 -1.84 0.00 0.00 35.03 32.17 1sc8 n LYS 224 CO 0.00 0.00 0.00 -2.30 -1.37 0.00 0.00 177.40 173.73 1sc8 n PRO 225 N 1.24 -0.88 -2.81 1.97 -0.02 -1.26 -4.45 135.00 128.80 1sc8 n PRO 225 Ca 0.26 -0.20 -0.37 0.00 -2.02 0.00 0.00 63.50 61.17 1sc8 n PRO 225 Cb 0.46 -2.28 -0.06 0.00 -0.02 0.00 0.00 33.50 31.59 1sc8 n PRO 225 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1sc8 s GLY 226 N -2.53 2.76 -0.14 -1.23 0.00 0.08 -4.60 107.32 101.67 1sc8 s GLY 226 Ca 0.66 0.49 -0.02 0.00 0.00 0.00 0.00 44.72 45.85 1sc8 s GLY 226 CO 0.60 0.91 -0.07 0.14 0.00 0.00 0.00 173.10 174.69 1sc8 s VAL 227 N -1.65 3.65 0.01 1.40 1.01 0.11 -1.67 120.40 123.26 1sc8 s VAL 227 Ca 0.50 -0.45 0.08 0.00 0.00 0.00 0.00 61.98 62.11 1sc8 s VAL 227 Cb -0.18 -2.57 -0.02 0.00 0.00 0.00 0.00 36.38 33.61 1sc8 s VAL 227 CO 0.23 0.51 -0.25 -0.31 0.00 0.00 0.00 175.10 175.28 1sc8 s TYR 228 N 0.25 2.24 0.10 5.22 1.51 0.24 -2.25 117.35 124.65 1sc8 s TYR 228 Ca -0.05 -0.42 -0.31 0.00 -1.01 0.00 0.00 57.07 55.29 1sc8 s TYR 228 Cb -0.14 -1.40 -0.08 0.00 -0.11 0.00 0.00 41.96 40.23 1sc8 s TYR 228 CO 0.04 0.03 1.52 0.99 -1.11 0.00 0.00 175.55 177.01 1sc8 s THR 229 N -0.67 3.11 -0.89 -0.71 2.01 -0.44 0.28 115.64 118.33 1sc8 s THR 229 Ca 0.10 0.69 -0.25 0.00 0.31 0.00 0.00 61.69 62.55 1sc8 s THR 229 Cb -0.10 -3.44 0.03 0.00 0.01 0.00 0.00 72.50 69.00 1sc8 s THR 229 CO 0.00 0.03 1.45 -0.60 -0.69 0.00 0.00 174.62 174.81 1sc8 s ARG 230 N 1.80 3.32 0.29 4.92 3.52 -0.07 -2.39 118.95 130.34 1sc8 s ARG 230 Ca 0.69 -0.66 0.03 0.00 -0.13 0.00 0.00 55.73 55.66 1sc8 s ARG 230 Cb -0.39 -4.88 0.70 0.00 -1.56 0.00 0.00 34.95 28.82 1sc8 s ARG 230 CO 0.30 -2.31 1.69 0.28 -0.81 0.00 0.00 175.30 174.46 1sc8 h VAL 231 N 6.57 0.48 -0.04 7.11 2.07 -1.79 -1.56 116.25 129.09 1sc8 h VAL 231 Ca 0.00 -0.13 0.01 0.00 0.82 0.00 0.00 66.70 67.40 1sc8 h VAL 231 Cb 1.03 0.06 -0.00 0.00 -1.52 0.00 0.00 31.29 30.86 1sc8 h VAL 231 CO 1.35 0.07 0.15 0.77 0.02 0.00 0.00 177.57 179.93 1sc8 h SER 232 N 0.38 0.00 0.01 0.57 4.64 -1.87 -0.06 113.55 117.23 1sc8 h SER 232 Ca 0.54 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.86 1sc8 h SER 232 Cb 1.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.11 1sc8 h SER 232 CO -0.53 0.00 -0.04 1.41 -0.87 0.00 0.00 176.83 176.80 1sc8 n HIS 233 N -3.20 0.00 -0.01 4.77 8.25 -0.59 -3.82 115.22 120.62 1sc8 n HIS 233 Ca -0.02 0.00 0.02 0.00 -0.26 0.00 0.00 57.72 57.46 1sc8 n HIS 233 Cb 0.23 -0.02 0.05 0.00 1.12 0.00 0.00 29.99 31.37 1sc8 n HIS 233 CO 0.00 0.00 0.00 1.19 0.64 0.00 0.00 176.34 178.17 1sc8 n PHE 234 N 0.23 0.13 -0.23 4.41 3.01 -0.04 -4.74 117.46 120.24 1sc8 n PHE 234 Ca 0.17 -0.39 0.03 0.00 1.01 0.00 0.00 57.45 58.28 1sc8 n PHE 234 Cb 0.39 -0.03 0.15 0.00 -0.01 0.00 0.00 39.48 39.97 1sc8 n PHE 234 CO 0.00 0.00 0.00 -0.07 1.01 0.00 0.00 176.76 177.70 1sc8 h LEU 235 N 0.75 -0.07 -0.57 4.37 3.38 -1.70 0.94 115.31 122.42 1sc8 h LEU 235 Ca 0.00 0.14 0.05 0.00 0.09 0.00 0.00 57.88 58.16 1sc8 h LEU 235 Cb 0.49 0.21 -0.05 0.00 0.09 0.00 0.00 40.66 41.41 1sc8 h LEU 235 CO 0.00 -0.05 0.31 -0.65 0.09 0.00 0.00 178.44 178.13 1sc8 h PRO 236 N 0.22 0.57 -0.68 1.13 0.11 -1.91 -0.79 132.00 130.66 1sc8 h PRO 236 Ca 0.37 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 66.40 1sc8 h PRO 236 Cb 0.62 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 31.57 1sc8 h PRO 236 CO -0.50 0.38 0.22 2.35 -0.21 0.00 0.00 178.00 180.24 1sc8 h TRP 237 N 0.59 1.09 0.03 0.65 7.01 -1.48 -2.50 115.95 121.35 1sc8 h TRP 237 Ca 0.25 -0.11 -0.00 0.00 2.11 0.00 0.00 58.89 61.14 1sc8 h TRP 237 Cb 0.13 -0.32 0.00 0.00 -2.10 0.00 0.00 29.16 26.87 1sc8 h TRP 237 CO -0.09 0.87 -0.02 0.82 -2.79 0.00 0.00 178.44 177.24 1sc8 h ILE 238 N 0.99 1.05 -0.58 2.65 2.04 -0.24 -3.08 117.51 120.35 1sc8 h ILE 238 Ca 0.22 -0.26 -0.04 0.00 1.00 0.00 0.00 64.86 65.78 1sc8 h ILE 238 Cb 0.28 1.23 -0.03 0.00 -0.74 0.00 0.00 36.82 37.57 1sc8 h ILE 238 CO -0.01 0.07 0.22 0.03 0.00 0.00 0.00 178.15 178.46 1sc8 h ARG 239 N -0.16 0.87 0.00 2.37 3.08 -1.12 -2.53 114.38 116.89 1sc8 h ARG 239 Ca -0.00 -0.16 -0.02 0.00 0.07 0.00 0.00 59.98 59.87 1sc8 h ARG 239 Cb 0.14 -0.14 -0.00 0.00 0.08 0.00 0.00 29.97 30.05 1sc8 h ARG 239 CO 0.01 0.75 -0.08 0.66 -1.07 0.00 0.00 179.97 180.24 1sc8 h SER 240 N 0.80 0.00 0.26 7.04 4.64 -1.47 -2.79 113.55 122.02 1sc8 h SER 240 Ca 0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 1sc8 h SER 240 Cb 0.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 1sc8 h SER 240 CO -0.01 0.08 -1.34 1.41 -0.87 0.00 0.00 176.83 176.10 1sc8 n HIS 241 N -3.51 0.19 0.74 4.77 8.25 -1.13 -4.27 115.22 120.25 1sc8 n HIS 241 Ca -0.02 0.05 0.12 0.00 -0.26 0.00 0.00 57.72 57.62 1sc8 n HIS 241 Cb 0.22 -0.42 0.16 0.00 1.12 0.00 0.00 29.99 31.07 1sc8 n HIS 241 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1sc8 n THR 242 N -2.03 0.21 0.00 1.59 -2.24 -0.97 -4.67 114.28 106.17 1sc8 n THR 242 Ca 0.00 -0.59 -0.00 0.00 -2.27 0.00 0.00 64.05 61.19 1sc8 n THR 242 Cb 0.47 1.25 -0.00 0.00 -2.10 0.00 0.00 70.33 69.95 1sc8 n THR 242 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1sc8 h LYS 243 N 4.54 -0.01 0.00 -0.78 1.57 -1.71 -3.51 116.57 116.67 1sc8 h LYS 243 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1sc8 h LYS 243 Cb 0.98 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.29 1sc8 h LYS 243 CO 0.00 -0.01 0.00 -1.91 -0.57 0.00 0.00 179.45 176.96