#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1unl n GLN 2 N 0.00 -0.28 -0.25 2.12 6.02 -1.26 0.05 117.38 123.79 1unl n GLN 2 Ca 0.00 1.34 -0.06 0.00 -0.01 0.00 0.00 57.00 58.27 1unl n GLN 2 Cb 0.00 -1.98 0.05 0.00 1.02 0.00 0.00 30.24 29.32 1unl n GLN 2 CO 0.00 0.00 0.00 -0.22 -1.01 0.00 0.00 177.06 175.83 1unl h LYS 3 N 0.00 0.97 -5.31 -1.09 3.64 -1.99 -3.45 116.57 109.35 1unl h LYS 3 Ca 0.24 -0.13 -0.64 0.00 -1.27 0.00 0.00 60.65 58.85 1unl h LYS 3 Cb 0.46 -0.18 -0.22 0.00 -0.41 0.00 0.00 32.23 31.87 1unl h LYS 3 CO -0.85 0.75 -0.68 0.71 -2.27 0.00 0.00 179.45 177.10 1unl s TYR 4 N -5.78 3.00 0.08 1.91 1.51 0.11 -1.31 117.35 116.86 1unl s TYR 4 Ca -0.13 -0.34 -0.27 0.00 -1.01 0.00 0.00 57.07 55.32 1unl s TYR 4 Cb 0.14 -1.94 -0.06 0.00 -0.11 0.00 0.00 41.96 39.99 1unl s TYR 4 CO 0.79 -0.05 0.84 -2.00 -1.11 0.00 0.00 175.55 174.02 1unl s GLU 5 N 0.35 4.57 0.61 -0.62 2.12 0.14 -2.02 118.70 123.85 1unl s GLU 5 Ca -0.05 1.21 -0.17 0.00 0.36 0.00 0.00 54.97 56.31 1unl s GLU 5 Cb -0.14 -3.36 -0.02 0.00 0.26 0.00 0.00 34.13 30.86 1unl s GLU 5 CO 0.03 0.28 1.16 0.15 -0.54 0.00 0.00 175.26 176.34 1unl s LYS 6 N -0.11 2.93 0.16 4.30 -0.14 -1.26 -1.16 119.74 124.47 1unl s LYS 6 Ca 0.41 1.64 0.00 0.00 -1.36 0.00 0.00 55.97 56.66 1unl s LYS 6 Cb -0.22 -1.94 0.00 0.00 -1.68 0.00 0.00 37.83 33.99 1unl s LYS 6 CO 0.26 -1.19 0.00 1.28 -0.76 0.00 0.00 175.35 174.93 1unl n LEU 7 N -1.87 0.36 -3.57 3.17 7.99 -0.87 -4.82 117.00 117.39 1unl n LEU 7 Ca 0.12 0.27 -0.16 0.00 -0.01 0.00 0.00 56.01 56.23 1unl n LEU 7 Cb 0.51 0.05 -0.06 0.00 -0.11 0.00 0.00 43.42 43.80 1unl n LEU 7 CO 0.45 -0.68 0.48 -1.83 -1.51 0.00 0.00 177.39 174.30 1unl s GLU 8 N -2.00 0.92 -1.38 3.23 -1.05 -1.19 -5.02 118.70 112.21 1unl s GLU 8 Ca 0.00 0.52 -0.15 0.00 -0.15 0.00 0.00 54.97 55.19 1unl s GLU 8 Cb 0.00 0.44 0.06 0.00 -0.44 0.00 0.00 34.13 34.19 1unl s GLU 8 CO 0.00 -0.23 1.98 1.63 0.95 0.00 0.00 175.26 179.59 1unl n LYS 9 N 1.57 3.05 -2.69 -4.83 4.01 -1.26 -1.38 118.16 116.63 1unl n LYS 9 Ca -0.16 -2.97 -0.42 0.00 -0.51 0.00 0.00 58.31 54.24 1unl n LYS 9 Cb 0.56 -3.35 -0.03 0.00 -0.51 0.00 0.00 35.03 31.70 1unl n LYS 9 CO 0.00 0.00 0.00 -1.50 -1.11 0.00 0.00 177.40 174.79 1unl s ILE 10 N 3.43 4.80 -0.59 -0.18 1.10 -1.22 -4.01 121.20 124.54 1unl s ILE 10 Ca 0.49 2.03 -0.06 0.00 -0.51 0.00 0.00 60.65 62.60 1unl s ILE 10 Cb 0.09 -4.30 0.06 0.00 0.15 0.00 0.00 42.46 38.46 1unl s ILE 10 CO -0.01 0.09 0.16 0.61 -2.11 0.00 0.00 174.94 173.68 1unl n GLY 11 N 2.99 -0.11 3.56 1.50 0.00 -1.26 -4.47 105.19 107.40 1unl n GLY 11 Ca 0.07 0.03 -0.39 0.00 0.00 0.00 0.00 46.02 45.73 1unl n GLY 11 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1unl n GLU 12 N -1.74 1.33 -2.70 1.61 0.28 -1.22 -4.68 120.64 113.52 1unl n GLU 12 Ca 0.01 0.19 -0.07 0.00 -0.16 0.00 0.00 57.16 57.14 1unl n GLU 12 Cb 0.16 -3.29 0.12 0.00 1.43 0.00 0.00 31.44 29.86 1unl n GLU 12 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1unl n GLY 13 N 5.97 1.33 0.86 -1.84 0.00 -1.26 -4.75 105.19 105.50 1unl n GLY 13 Ca 0.36 -0.12 -0.06 0.00 0.00 0.00 0.00 46.02 46.19 1unl n GLY 13 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1unl n THR 14 N -0.64 0.00 -0.32 2.61 -1.04 -1.26 -5.01 114.28 108.61 1unl n THR 14 Ca -0.04 -0.62 0.22 0.00 -2.04 0.00 0.00 64.05 61.57 1unl n THR 14 Cb 0.85 0.24 0.44 0.00 -1.82 0.00 0.00 70.33 70.04 1unl n THR 14 CO 0.00 0.00 0.00 0.10 -0.64 0.00 0.00 175.07 174.53 1unl h TYR 15 N 1.20 0.74 -2.72 -1.42 -0.00 -2.00 -3.41 116.97 109.36 1unl h TYR 15 Ca -0.08 0.04 -0.52 0.00 0.00 0.00 0.00 58.73 58.17 1unl h TYR 15 Cb 0.31 -0.16 -0.15 0.00 0.00 0.00 0.00 36.73 36.73 1unl h TYR 15 CO 0.00 -0.24 -0.75 0.20 -0.00 0.00 0.00 178.16 177.37 1unl s GLY 16 N -4.18 1.59 -0.07 0.10 0.00 -1.26 -5.03 107.32 98.47 1unl s GLY 16 Ca -0.10 -1.71 -0.25 0.00 0.00 0.00 0.00 44.72 42.65 1unl s GLY 16 CO 0.78 -1.80 0.79 -0.51 0.00 0.00 0.00 173.10 172.37 1unl s THR 17 N -2.64 4.98 -0.27 0.90 -4.23 -0.85 -4.50 115.64 109.03 1unl s THR 17 Ca 0.24 1.63 -0.11 0.00 -1.18 0.00 0.00 61.69 62.26 1unl s THR 17 Cb -0.03 -4.12 -0.05 0.00 1.34 0.00 0.00 72.50 69.64 1unl s THR 17 CO 0.10 0.19 0.20 -0.69 -0.54 0.00 0.00 174.62 173.88 1unl s VAL 18 N 1.07 5.31 -0.04 2.29 1.01 -1.26 -1.24 120.40 127.53 1unl s VAL 18 Ca 0.41 0.22 0.05 0.00 0.00 0.00 0.00 61.98 62.66 1unl s VAL 18 Cb -0.18 -3.54 -0.02 0.00 0.00 0.00 0.00 36.38 32.63 1unl s VAL 18 CO 0.20 0.27 -0.20 -0.36 0.00 0.00 0.00 175.10 175.00 1unl s PHE 19 N 1.59 2.53 0.44 5.22 0.40 -0.25 -3.39 117.98 124.53 1unl s PHE 19 Ca 0.08 -0.35 -0.23 0.00 -0.60 0.00 0.00 56.93 55.83 1unl s PHE 19 Cb -0.15 -1.59 -0.08 0.00 0.51 0.00 0.00 43.02 41.71 1unl s PHE 19 CO 0.09 0.04 1.08 0.21 0.70 0.00 0.00 175.22 177.34 1unl s LYS 20 N -0.57 3.92 0.29 0.44 2.20 -0.48 -0.61 119.74 124.93 1unl s LYS 20 Ca 0.08 1.56 -0.20 0.00 -0.36 0.00 0.00 55.97 57.05 1unl s LYS 20 Cb -0.11 -2.37 0.03 0.00 -1.51 0.00 0.00 37.83 33.88 1unl s LYS 20 CO 0.00 -0.36 0.77 0.00 -0.36 0.00 0.00 175.35 175.40 1unl s ALA 21 N -1.71 -1.16 -0.04 3.13 0.00 0.06 -2.05 121.76 119.99 1unl s ALA 21 Ca 0.62 -0.37 -0.00 0.00 0.00 0.00 0.00 51.96 52.21 1unl s ALA 21 Cb -0.23 0.79 0.03 0.00 0.00 0.00 0.00 23.12 23.71 1unl s ALA 21 CO 0.28 -1.03 0.01 0.21 0.00 0.00 0.00 175.76 175.23 1unl s LYS 22 N -3.44 0.31 0.77 0.00 2.20 -0.31 -0.94 119.74 118.33 1unl s LYS 22 Ca 0.12 0.12 -0.15 0.00 -0.36 0.00 0.00 55.97 55.70 1unl s LYS 22 Cb -0.05 -0.57 0.01 0.00 -1.51 0.00 0.00 37.83 35.70 1unl s LYS 22 CO 0.08 -0.19 0.75 -1.71 -0.36 0.00 0.00 175.35 173.92 1unl n ASN 23 N 4.47 -0.48 -1.52 1.43 2.85 -0.54 0.26 115.26 121.73 1unl n ASN 23 Ca -0.20 0.57 -0.13 0.00 -0.11 0.00 0.00 54.58 54.71 1unl n ASN 23 Cb 0.50 -1.32 0.12 0.00 1.24 0.00 0.00 39.78 40.32 1unl n ASN 23 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 1unl n ARG 24 N -1.63 2.55 0.06 1.20 1.74 -0.43 -3.37 116.66 116.79 1unl n ARG 24 Ca 0.11 -3.59 0.00 0.00 -0.77 0.00 0.00 57.85 53.60 1unl n ARG 24 Cb 0.50 -2.01 0.00 0.00 -1.02 0.00 0.00 32.46 29.93 1unl n ARG 24 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1unl n GLU 25 N -0.95 0.00 0.08 5.56 1.02 -1.26 -4.83 120.64 120.26 1unl n GLU 25 Ca 0.38 0.00 0.12 0.00 -0.02 0.00 0.00 57.16 57.64 1unl n GLU 25 Cb 0.91 0.00 0.17 0.00 -0.02 0.00 0.00 31.44 32.50 1unl n GLU 25 CO 0.00 0.00 0.00 1.79 1.18 0.00 0.00 177.13 180.10 1unl h THR 26 N 0.00 0.00 -2.57 2.62 1.35 -1.99 -3.48 112.91 108.85 1unl h THR 26 Ca 0.00 -0.58 -0.38 0.00 -0.55 0.00 0.00 66.41 64.90 1unl h THR 26 Cb 0.00 1.21 -0.06 0.00 -1.73 0.00 0.00 68.15 67.57 1unl h THR 26 CO 0.00 0.00 -0.45 1.41 -0.25 0.00 0.00 175.52 176.23 1unl n HIS 27 N -2.25 -0.80 -2.32 4.73 8.25 -1.22 -4.96 115.22 116.65 1unl n HIS 27 Ca 0.03 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.11 1unl n HIS 27 Cb 0.46 -3.59 -0.02 0.00 1.12 0.00 0.00 29.99 27.96 1unl n HIS 27 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1unl s GLU 28 N -4.63 3.99 0.04 -0.41 2.02 -1.26 -4.66 118.70 113.79 1unl s GLU 28 Ca 0.00 1.77 -0.30 0.00 0.02 0.00 0.00 54.97 56.46 1unl s GLU 28 Cb 0.00 -2.58 -0.04 0.00 0.10 0.00 0.00 34.13 31.61 1unl s GLU 28 CO 0.00 -0.36 1.03 0.42 0.02 0.00 0.00 175.26 176.38 1unl s ILE 29 N -1.49 4.58 0.18 -1.63 1.01 -1.26 -1.47 121.20 121.12 1unl s ILE 29 Ca 0.59 1.90 -0.04 0.00 0.00 0.00 0.00 60.65 63.10 1unl s ILE 29 Cb -0.29 -4.22 -0.03 0.00 0.01 0.00 0.00 42.46 37.94 1unl s ILE 29 CO 0.36 0.17 0.18 0.68 0.00 0.00 0.00 174.94 176.33 1unl s VAL 30 N 0.84 0.04 -0.15 2.92 -7.23 -0.12 -4.28 120.40 112.43 1unl s VAL 30 Ca 0.53 -1.80 -0.05 0.00 -1.81 0.00 0.00 61.98 58.85 1unl s VAL 30 Cb -0.24 -2.22 -0.03 0.00 0.56 0.00 0.00 36.38 34.45 1unl s VAL 30 CO 0.29 -0.18 0.02 0.00 -0.31 0.00 0.00 175.10 174.92 1unl s ALA 31 N -4.08 3.28 -0.13 1.32 0.00 -0.73 -0.76 121.76 120.66 1unl s ALA 31 Ca 0.29 -0.78 -0.04 0.00 0.00 0.00 0.00 51.96 51.43 1unl s ALA 31 Cb 0.06 -1.71 -0.03 0.00 0.00 0.00 0.00 23.12 21.43 1unl s ALA 31 CO 0.07 0.31 0.02 -0.51 0.00 0.00 0.00 175.76 175.65 1unl s LEU 32 N -0.00 3.65 -0.41 0.00 1.43 0.22 -0.27 118.68 123.29 1unl s LEU 32 Ca 0.04 0.09 -0.04 0.00 -1.03 0.00 0.00 54.13 53.19 1unl s LEU 32 Cb -0.13 -1.88 0.11 0.00 0.03 0.00 0.00 46.19 44.32 1unl s LEU 32 CO 0.02 0.27 0.21 -0.75 0.23 0.00 0.00 176.35 176.33 1unl s LYS 33 N -0.22 2.10 0.16 1.70 2.20 -0.51 -1.09 119.74 124.08 1unl s LYS 33 Ca 0.06 -1.77 -0.25 0.00 -0.36 0.00 0.00 55.97 53.66 1unl s LYS 33 Cb -0.12 -3.61 -0.08 0.00 -1.51 0.00 0.00 37.83 32.51 1unl s LYS 33 CO 0.02 -1.06 0.76 1.03 -0.36 0.00 0.00 175.35 175.74 1unl s ARG 34 N 1.18 4.53 -0.04 4.03 1.81 -0.37 -1.93 118.95 128.16 1unl s ARG 34 Ca 0.07 1.12 -0.02 0.00 -1.72 0.00 0.00 55.73 55.18 1unl s ARG 34 Cb -0.23 -3.23 0.03 0.00 -0.45 0.00 0.00 34.95 31.07 1unl s ARG 34 CO -0.03 0.56 0.05 0.08 -0.68 0.00 0.00 175.30 175.28 1unl s VAL 35 N -1.17 -0.04 0.20 3.52 1.01 -0.33 -2.01 120.40 121.57 1unl s VAL 35 Ca 0.36 0.37 -0.30 0.00 0.00 0.00 0.00 61.98 62.41 1unl s VAL 35 Cb -0.22 -0.20 -0.08 0.00 0.00 0.00 0.00 36.38 35.88 1unl s VAL 35 CO 0.25 0.18 1.06 -0.13 0.00 0.00 0.00 175.10 176.47 1unl s ARG 36 N 2.06 4.66 0.06 2.72 3.00 -1.26 -1.46 118.95 128.73 1unl s ARG 36 Ca 0.04 1.67 0.22 0.00 0.00 0.00 0.00 55.73 57.66 1unl s ARG 36 Cb -0.12 -3.27 -0.08 0.00 0.00 0.00 0.00 34.95 31.48 1unl s ARG 36 CO -0.03 0.19 0.88 1.28 0.00 0.00 0.00 175.30 177.62 1unl n LEU 37 N 2.01 0.52 -1.11 2.53 4.77 -0.94 -4.45 117.00 120.33 1unl n LEU 37 Ca 0.01 0.03 0.05 0.00 -0.03 0.00 0.00 56.01 56.07 1unl n LEU 37 Cb 0.46 -0.06 0.11 0.00 -2.33 0.00 0.00 43.42 41.60 1unl n LEU 37 CO 0.53 -0.00 0.19 -0.90 -1.33 0.00 0.00 177.39 175.88 1unl n ASP 38 N -2.16 1.35 -0.25 -1.43 5.75 -1.26 -4.84 116.55 113.71 1unl n ASP 38 Ca 0.00 -2.87 0.00 0.00 -0.01 0.00 0.00 54.79 51.92 1unl n ASP 38 Cb 0.49 -0.40 0.00 0.00 -1.03 0.00 0.00 41.12 40.17 1unl n ASP 38 CO 0.00 0.00 0.00 -0.67 -0.11 0.00 0.00 177.20 176.42 1unl n ASP 39 N -0.24 0.00 0.00 -1.12 2.03 -1.26 -5.04 116.55 110.92 1unl n ASP 39 Ca 0.12 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.43 1unl n ASP 39 Cb 0.94 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 41.34 1unl n ASP 39 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 1unl n ASP 40 N 0.00 0.00 -4.58 1.67 5.68 -1.26 -4.42 116.55 113.65 1unl n ASP 40 Ca 0.00 0.00 -0.20 0.00 -0.50 0.00 0.00 54.79 54.09 1unl n ASP 40 Cb 0.00 0.00 -0.09 0.00 -1.14 0.00 0.00 41.12 39.89 1unl n ASP 40 CO 0.00 0.00 0.00 -1.81 -1.33 0.00 0.00 177.20 174.06 1unl s ASP 41 N -2.02 4.13 -0.78 -1.12 1.01 -1.26 -4.72 116.67 111.92 1unl s ASP 41 Ca 0.00 -1.12 -0.25 0.00 0.71 0.00 0.00 52.55 51.89 1unl s ASP 41 Cb 0.00 -2.59 -0.03 0.00 1.01 0.00 0.00 42.92 41.31 1unl s ASP 41 CO 0.00 -3.98 1.88 -1.61 0.21 0.00 0.00 175.17 171.67 1unl s GLU 42 N 7.70 2.62 0.00 8.23 2.02 -1.26 -1.53 118.70 136.48 1unl s GLU 42 Ca 0.77 0.07 0.00 0.00 0.02 0.00 0.00 54.97 55.83 1unl s GLU 42 Cb -0.04 -4.76 0.00 0.00 0.10 0.00 0.00 34.13 29.42 1unl s GLU 42 CO 0.14 -3.05 0.00 0.41 0.02 0.00 0.00 175.26 172.78 1unl n GLY 43 N 6.33 0.52 0.16 -1.39 0.00 -1.26 -4.99 105.19 104.56 1unl n GLY 43 Ca 0.31 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.22 1unl n GLY 43 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1unl h VAL 44 N 0.00 1.22 -0.98 1.61 2.07 -1.60 -2.88 116.25 115.69 1unl h VAL 44 Ca 0.00 -0.75 0.21 0.00 0.82 0.00 0.00 66.70 66.98 1unl h VAL 44 Cb 0.00 1.17 -0.09 0.00 -1.52 0.00 0.00 31.29 30.84 1unl h VAL 44 CO 0.00 0.24 0.62 -0.65 0.02 0.00 0.00 177.57 177.80 1unl h PRO 45 N 0.29 0.57 -0.96 1.57 0.11 -1.83 -1.33 132.00 130.43 1unl h PRO 45 Ca 0.09 -0.03 0.19 0.00 0.11 0.00 0.00 66.00 66.36 1unl h PRO 45 Cb 0.31 -0.13 -0.11 0.00 0.11 0.00 0.00 31.00 31.18 1unl h PRO 45 CO 0.00 0.38 0.55 1.03 -0.21 0.00 0.00 178.00 179.75 1unl h SER 46 N 0.59 0.67 0.91 -2.05 0.87 -1.91 0.24 113.55 112.88 1unl h SER 46 Ca 0.55 0.11 -0.21 0.00 -1.23 0.00 0.00 61.79 61.01 1unl h SER 46 Cb 1.10 -0.00 -0.03 0.00 -0.44 0.00 0.00 62.40 63.02 1unl h SER 46 CO -0.31 0.21 -1.15 0.28 -0.53 0.00 0.00 176.83 175.33 1unl h SER 47 N 0.67 0.00 -0.35 6.23 0.02 -1.38 -3.11 113.55 115.64 1unl h SER 47 Ca 0.56 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 61.51 1unl h SER 47 Cb 0.91 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.44 1unl h SER 47 CO -0.41 0.88 0.21 0.00 -1.14 0.00 0.00 176.83 176.37 1unl h ALA 48 N 1.12 0.45 -0.63 3.77 0.00 -0.57 -1.15 119.26 122.24 1unl h ALA 48 Ca -0.10 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.70 1unl h ALA 48 Cb 1.76 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 19.38 1unl h ALA 48 CO 0.10 -0.05 0.16 -0.07 0.00 0.00 0.00 179.25 179.39 1unl h LEU 49 N 0.45 0.96 -1.00 0.00 3.38 -0.69 -0.80 115.31 117.61 1unl h LEU 49 Ca 0.13 -0.23 -0.06 0.00 0.09 0.00 0.00 57.88 57.80 1unl h LEU 49 Cb 0.02 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.49 1unl h LEU 49 CO -0.02 0.94 0.07 -0.09 0.09 0.00 0.00 178.44 179.42 1unl h ARG 50 N 0.93 0.79 -0.28 1.13 2.43 -1.47 -1.05 114.38 116.86 1unl h ARG 50 Ca 0.20 -0.18 -0.15 0.00 -0.81 0.00 0.00 59.98 59.04 1unl h ARG 50 Cb 0.35 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.79 1unl h ARG 50 CO 0.00 0.75 -0.43 1.49 -1.51 0.00 0.00 179.97 180.27 1unl h GLU 51 N 0.75 0.71 -0.03 0.20 4.81 -0.83 -2.29 114.58 117.89 1unl h GLU 51 Ca 0.16 -0.38 -0.00 0.00 -0.13 0.00 0.00 59.36 59.00 1unl h GLU 51 Cb 0.36 0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.76 1unl h GLU 51 CO 0.01 1.00 0.01 0.82 -0.73 0.00 0.00 179.01 180.12 1unl h ILE 52 N 0.57 1.11 -0.88 2.32 2.04 -0.88 -1.89 117.51 119.89 1unl h ILE 52 Ca 0.04 -0.33 0.08 0.00 1.00 0.00 0.00 64.86 65.66 1unl h ILE 52 Cb 0.98 1.28 -0.07 0.00 -0.74 0.00 0.00 36.82 38.27 1unl h ILE 52 CO 0.09 0.09 0.54 0.00 0.00 0.00 0.00 178.15 178.87 1unl h LEU 54 N 0.92 0.84 -0.66 0.00 3.38 -1.41 -3.34 115.31 115.05 1unl h LEU 54 Ca 0.41 -0.92 -0.10 0.00 0.09 0.00 0.00 57.88 57.35 1unl h LEU 54 Cb 0.30 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 1unl h LEU 54 CO -0.22 1.70 -0.49 0.25 0.09 0.00 0.00 178.44 179.77 1unl h LEU 55 N 0.12 0.00 -2.32 1.67 5.85 -1.14 -1.40 115.31 118.09 1unl h LEU 55 Ca -0.25 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.46 1unl h LEU 55 Cb 2.15 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 43.18 1unl h LEU 55 CO 0.27 0.49 -0.04 0.11 -0.34 0.00 0.00 178.44 178.93 1unl h LYS 56 N 0.00 0.00 -0.26 1.25 1.57 -1.39 -2.89 116.57 114.85 1unl h LYS 56 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1unl h LYS 56 Cb 1.09 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.40 1unl h LYS 56 CO 0.06 0.04 0.00 0.39 -0.57 0.00 0.00 179.45 179.37 1unl n GLU 57 N -3.69 2.04 -3.81 3.15 -0.58 -0.59 -4.82 120.64 112.35 1unl n GLU 57 Ca -0.03 -1.84 -0.28 0.00 -0.42 0.00 0.00 57.16 54.59 1unl n GLU 57 Cb 0.14 -1.32 -0.12 0.00 -0.57 0.00 0.00 31.44 29.57 1unl n GLU 57 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1unl s LEU 58 N -1.08 4.02 -0.33 -4.62 1.43 -0.83 -5.06 118.68 112.20 1unl s LEU 58 Ca 0.24 -3.51 -0.11 0.00 -1.03 0.00 0.00 54.13 49.73 1unl s LEU 58 Cb 0.14 -1.39 -0.01 0.00 0.03 0.00 0.00 46.19 44.96 1unl s LEU 58 CO 0.19 -0.13 0.19 -0.54 0.23 0.00 0.00 176.35 176.29 1unl s LYS 59 N -0.90 3.31 -0.06 1.70 -0.14 -1.26 -4.89 119.74 117.50 1unl s LYS 59 Ca 0.24 -0.75 -0.30 0.00 -1.36 0.00 0.00 55.97 53.81 1unl s LYS 59 Cb -0.08 -3.67 0.09 0.00 -1.68 0.00 0.00 37.83 32.50 1unl s LYS 59 CO -0.13 -0.47 0.79 -1.58 -0.76 0.00 0.00 175.35 173.20 1unl s HIS 60 N 1.64 -0.53 -0.40 3.18 2.46 -1.26 -5.05 115.29 115.33 1unl s HIS 60 Ca 0.05 0.82 0.26 0.00 0.47 0.00 0.00 55.06 56.66 1unl s HIS 60 Cb -0.17 0.45 1.01 0.00 -0.13 0.00 0.00 32.58 33.73 1unl s HIS 60 CO 0.08 -0.54 1.77 1.57 -2.47 0.00 0.00 174.74 175.15 1unl h LYS 61 N 2.69 0.00 -0.33 2.88 2.10 -1.97 -2.60 116.57 119.34 1unl h LYS 61 Ca -0.24 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.41 1unl h LYS 61 Cb 1.17 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.50 1unl h LYS 61 CO 0.36 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 177.90 1unl n ASN 62 N -2.45 3.73 -4.33 7.07 3.02 -1.26 -4.79 115.26 116.25 1unl n ASN 62 Ca 0.02 -2.67 -0.29 0.00 -0.03 0.00 0.00 54.58 51.62 1unl n ASN 62 Cb 0.29 -0.46 -0.14 0.00 -0.61 0.00 0.00 39.78 38.86 1unl n ASN 62 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1unl s ILE 63 N -2.20 2.05 0.27 2.41 1.01 -0.98 -0.80 121.20 122.96 1unl s ILE 63 Ca 0.37 -1.39 -0.29 0.00 0.00 0.00 0.00 60.65 59.34 1unl s ILE 63 Cb 0.28 -1.76 -0.09 0.00 0.01 0.00 0.00 42.46 40.89 1unl s ILE 63 CO 0.12 0.30 1.15 0.54 0.00 0.00 0.00 174.94 177.05 1unl s VAL 64 N -0.83 3.40 -0.21 2.92 0.11 -0.16 -4.67 120.40 120.94 1unl s VAL 64 Ca 0.11 1.36 -0.15 0.00 -2.93 0.00 0.00 61.98 60.37 1unl s VAL 64 Cb -0.10 -3.87 -0.04 0.00 -1.53 0.00 0.00 36.38 30.85 1unl s VAL 64 CO 0.02 0.31 0.34 -0.60 -3.33 0.00 0.00 175.10 171.84 1unl s ARG 65 N -1.27 4.14 -0.34 1.54 6.06 -1.26 -4.98 118.95 122.85 1unl s ARG 65 Ca 0.47 0.09 -0.25 0.00 -2.50 0.00 0.00 55.73 53.54 1unl s ARG 65 Cb -0.33 -3.54 0.01 0.00 0.06 0.00 0.00 34.95 31.14 1unl s ARG 65 CO 0.42 -0.03 0.85 -1.17 -2.50 0.00 0.00 175.30 172.87 1unl s LEU 66 N 1.29 4.06 -0.05 -0.88 2.96 -1.26 -1.29 118.68 123.51 1unl s LEU 66 Ca 0.16 0.62 0.02 0.00 -0.22 0.00 0.00 54.13 54.71 1unl s LEU 66 Cb -0.14 -3.16 -0.25 0.00 0.50 0.00 0.00 46.19 43.13 1unl s LEU 66 CO 0.07 -0.73 0.66 0.45 -1.32 0.00 0.00 176.35 175.48 1unl h HIS 67 N 8.28 0.29 -2.87 5.38 3.86 -1.01 -3.48 115.15 125.59 1unl h HIS 67 Ca -0.24 -0.21 0.05 0.00 -1.16 0.00 0.00 60.37 58.82 1unl h HIS 67 Cb 1.09 -0.01 -0.09 0.00 1.06 0.00 0.00 27.41 29.46 1unl h HIS 67 CO 0.80 1.36 0.27 0.34 0.86 0.00 0.00 177.93 181.56 1unl s ASP 68 N -6.68 -0.37 -0.13 2.45 3.68 -1.11 -4.99 116.67 109.52 1unl s ASP 68 Ca -0.11 -0.33 -0.01 0.00 2.13 0.00 0.00 52.55 54.23 1unl s ASP 68 Cb 0.07 0.63 0.03 0.00 -1.45 0.00 0.00 42.92 42.21 1unl s ASP 68 CO 0.82 -1.12 -0.04 -0.69 0.13 0.00 0.00 175.17 174.27 1unl s VAL 69 N -3.73 0.89 0.06 1.11 1.01 -1.26 -0.47 120.40 118.00 1unl s VAL 69 Ca 0.07 -0.35 0.04 0.00 0.00 0.00 0.00 61.98 61.74 1unl s VAL 69 Cb -0.03 -1.03 -0.04 0.00 0.00 0.00 0.00 36.38 35.28 1unl s VAL 69 CO -0.02 0.22 -0.02 -0.76 0.00 0.00 0.00 175.10 174.52 1unl s LEU 70 N 1.75 3.41 -0.24 3.92 2.01 -0.44 -4.98 118.68 124.10 1unl s LEU 70 Ca 0.03 -0.14 0.00 0.00 0.01 0.00 0.00 54.13 54.03 1unl s LEU 70 Cb -0.14 -2.08 0.06 0.00 0.01 0.00 0.00 46.19 44.05 1unl s LEU 70 CO -0.07 0.22 -0.03 -2.28 1.01 0.00 0.00 176.35 175.19 1unl s HIS 71 N -1.21 2.25 -0.01 0.29 5.65 -1.26 -1.17 115.29 119.83 1unl s HIS 71 Ca 0.23 -1.71 -0.00 0.00 0.25 0.00 0.00 55.06 53.83 1unl s HIS 71 Cb -0.12 -1.58 -0.01 0.00 -1.18 0.00 0.00 32.58 29.69 1unl s HIS 71 CO 0.15 -0.77 -0.01 0.45 -0.65 0.00 0.00 174.74 173.91 1unl n SER 72 N 4.71 2.04 0.00 9.88 2.88 -0.93 -4.97 113.62 127.23 1unl n SER 72 Ca -0.10 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.44 1unl n SER 72 Cb 0.44 -0.02 0.00 0.00 -0.75 0.00 0.00 64.21 63.88 1unl n SER 72 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1unl n ASP 73 N -2.78 0.00 -2.81 -3.46 2.03 -1.26 -4.87 116.55 103.40 1unl n ASP 73 Ca -0.02 0.00 -0.02 0.00 0.52 0.00 0.00 54.79 55.28 1unl n ASP 73 Cb 0.52 0.00 0.05 0.00 -0.72 0.00 0.00 41.12 40.96 1unl n ASP 73 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1unl n LYS 74 N -0.62 1.64 -4.23 -0.67 4.76 -1.26 -5.10 118.16 112.68 1unl n LYS 74 Ca 0.00 -3.47 -0.13 0.00 -2.87 0.00 0.00 58.31 51.84 1unl n LYS 74 Cb 0.00 -1.55 -0.10 0.00 -1.84 0.00 0.00 35.03 31.54 1unl n LYS 74 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1unl s LYS 75 N -3.70 1.03 -0.14 1.97 1.02 -1.26 -2.22 119.74 116.45 1unl s LYS 75 Ca 0.27 -1.46 -0.02 0.00 0.02 0.00 0.00 55.97 54.78 1unl s LYS 75 Cb 0.34 -0.42 0.04 0.00 -0.52 0.00 0.00 37.83 37.28 1unl s LYS 75 CO -0.03 -0.01 0.02 -1.17 -0.92 0.00 0.00 175.35 173.24 1unl s LEU 76 N -3.15 0.90 -0.32 3.17 2.96 -0.53 -2.19 118.68 119.52 1unl s LEU 76 Ca 0.18 -0.48 -0.08 0.00 -0.22 0.00 0.00 54.13 53.53 1unl s LEU 76 Cb 0.04 -0.53 0.01 0.00 0.50 0.00 0.00 46.19 46.22 1unl s LEU 76 CO 0.00 -0.25 0.12 -0.89 -1.32 0.00 0.00 176.35 174.01 1unl s THR 77 N 1.91 4.19 -0.12 3.68 2.01 -0.31 -1.19 115.64 125.80 1unl s THR 77 Ca 0.02 -0.70 -0.23 0.00 0.31 0.00 0.00 61.69 61.09 1unl s THR 77 Cb -0.15 -3.21 -0.03 0.00 0.01 0.00 0.00 72.50 69.12 1unl s THR 77 CO -0.07 -0.00 0.68 -0.76 -0.69 0.00 0.00 174.62 173.78 1unl s LEU 78 N 1.52 4.24 -0.25 4.42 1.43 -0.81 -1.33 118.68 127.91 1unl s LEU 78 Ca 0.02 1.06 -0.13 0.00 -1.03 0.00 0.00 54.13 54.05 1unl s LEU 78 Cb -0.18 -3.02 -0.04 0.00 0.03 0.00 0.00 46.19 42.98 1unl s LEU 78 CO 0.04 -0.19 0.29 -0.69 0.23 0.00 0.00 176.35 176.03 1unl s VAL 79 N 1.31 5.25 0.24 -1.59 1.01 0.37 -1.43 120.40 125.56 1unl s VAL 79 Ca 0.34 0.43 0.12 0.00 0.00 0.00 0.00 61.98 62.86 1unl s VAL 79 Cb -0.17 -3.62 -0.05 0.00 0.00 0.00 0.00 36.38 32.54 1unl s VAL 79 CO 0.14 0.24 -0.21 -0.36 0.00 0.00 0.00 175.10 174.91 1unl s PHE 80 N 1.61 2.31 0.38 5.22 0.40 0.63 -0.32 117.98 128.22 1unl s PHE 80 Ca 0.12 -0.34 -0.26 0.00 -0.60 0.00 0.00 56.93 55.86 1unl s PHE 80 Cb -0.15 -1.07 -0.11 0.00 0.51 0.00 0.00 43.02 42.19 1unl s PHE 80 CO 0.08 0.61 1.15 -1.91 0.70 0.00 0.00 175.22 175.85 1unl n GLU 81 N -0.19 1.70 -3.70 0.44 2.13 -0.41 -1.77 120.64 118.85 1unl n GLU 81 Ca -0.09 0.60 -0.37 0.00 0.66 0.00 0.00 57.16 57.97 1unl n GLU 81 Cb 0.58 -2.18 -0.07 0.00 0.27 0.00 0.00 31.44 30.04 1unl n GLU 81 CO 0.00 0.00 0.00 0.12 -0.41 0.00 0.00 177.13 176.84 1unl s PHE 82 N -1.18 3.57 0.13 4.31 2.19 -1.26 -4.14 117.98 121.60 1unl s PHE 82 Ca 0.60 0.61 0.10 0.00 0.33 0.00 0.00 56.93 58.58 1unl s PHE 82 Cb -0.56 -2.14 -0.04 0.00 -1.31 0.00 0.00 43.02 38.97 1unl s PHE 82 CO 0.59 0.54 -0.24 0.00 1.83 0.00 0.00 175.22 177.94 1unl h ASP 84 N 3.81 0.74 -5.15 0.00 3.32 -1.90 -3.47 116.42 113.77 1unl h ASP 84 Ca -0.48 -0.58 -0.03 0.00 0.02 0.00 0.00 57.03 55.96 1unl h ASP 84 Cb 1.18 -0.22 -0.06 0.00 0.22 0.00 0.00 39.33 40.45 1unl h ASP 84 CO 0.41 1.19 0.04 0.00 -1.72 0.00 0.00 179.24 179.17 1unl s GLN 85 N -3.92 1.76 0.41 3.56 -2.07 -0.91 -5.03 119.66 113.46 1unl s GLN 85 Ca -0.12 -1.24 0.08 0.00 -1.82 0.00 0.00 55.36 52.26 1unl s GLN 85 Cb 0.07 0.54 0.01 0.00 -1.09 0.00 0.00 33.01 32.54 1unl s GLN 85 CO 0.85 -0.77 0.56 0.16 -1.32 0.00 0.00 175.29 174.76 1unl s ASP 86 N -3.01 5.70 0.48 12.60 1.47 -1.26 0.06 116.67 132.70 1unl s ASP 86 Ca 0.18 -0.38 0.20 0.00 1.18 0.00 0.00 52.55 53.74 1unl s ASP 86 Cb -0.03 -0.74 1.19 0.00 -0.34 0.00 0.00 42.92 43.00 1unl s ASP 86 CO 0.10 -0.72 2.02 0.25 0.68 0.00 0.00 175.17 177.50 1unl h LEU 87 N 0.67 0.00 -0.08 2.11 5.85 -0.54 -1.43 115.31 121.89 1unl h LEU 87 Ca -0.41 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.30 1unl h LEU 87 Cb 1.28 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.30 1unl h LEU 87 CO 0.46 0.17 0.00 0.50 -0.34 0.00 0.00 178.44 179.23 1unl h LYS 88 N 0.00 0.14 -0.10 1.25 1.63 -1.85 -1.13 116.57 116.51 1unl h LYS 88 Ca -0.00 -0.04 -0.07 0.00 -0.85 0.00 0.00 60.65 59.68 1unl h LYS 88 Cb 0.35 -0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 31.96 1unl h LYS 88 CO 0.02 0.40 -0.26 -0.22 -3.45 0.00 0.00 179.45 175.94 1unl h LYS 89 N -0.14 0.18 -0.32 1.90 3.64 -1.85 -2.97 116.57 117.02 1unl h LYS 89 Ca 0.02 -0.06 -0.04 0.00 -1.27 0.00 0.00 60.65 59.31 1unl h LYS 89 Cb 0.33 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.12 1unl h LYS 89 CO 0.00 0.43 0.05 -0.92 -2.27 0.00 0.00 179.45 176.74 1unl h TYR 90 N 0.16 0.56 -0.81 1.91 3.20 -0.98 -2.10 116.97 118.91 1unl h TYR 90 Ca 0.03 -0.08 0.13 0.00 3.14 0.00 0.00 58.73 61.95 1unl h TYR 90 Cb 0.56 -0.15 -0.09 0.00 1.54 0.00 0.00 36.73 38.58 1unl h TYR 90 CO 0.01 0.61 0.40 0.74 -1.64 0.00 0.00 178.16 178.28 1unl h PHE 91 N 0.35 0.70 -0.04 -3.82 0.05 -1.09 -1.99 116.94 111.11 1unl h PHE 91 Ca 0.10 0.03 -0.10 0.00 3.82 0.00 0.00 57.97 61.82 1unl h PHE 91 Cb 0.36 -0.19 -0.01 0.00 2.00 0.00 0.00 35.95 38.10 1unl h PHE 91 CO 0.02 0.18 -0.45 -0.44 -0.18 0.00 0.00 178.31 177.44 1unl h ASP 92 N 0.60 0.09 0.39 2.17 3.45 -1.34 0.29 116.42 122.07 1unl h ASP 92 Ca 0.43 -0.04 -0.05 0.00 0.43 0.00 0.00 57.03 57.80 1unl h ASP 92 Cb 0.59 -0.03 -0.01 0.00 -0.56 0.00 0.00 39.33 39.32 1unl h ASP 92 CO -0.35 0.53 -0.24 0.28 -1.57 0.00 0.00 179.24 177.89 1unl h SER 93 N 0.07 0.00 0.00 6.45 0.02 -0.67 -3.28 113.55 116.14 1unl h SER 93 Ca 0.00 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.88 1unl h SER 93 Cb 0.82 0.00 -0.16 0.00 0.14 0.00 0.00 62.40 63.20 1unl h SER 93 CO 0.06 0.24 -0.69 0.00 -1.14 0.00 0.00 176.83 175.31 1unl n ASN 95 N -0.40 -5.88 -1.08 0.00 5.15 -1.09 -0.69 115.26 111.27 1unl n ASN 95 Ca 0.12 -0.22 -0.12 0.00 -0.60 0.00 0.00 54.58 53.76 1unl n ASN 95 Cb 0.88 -4.75 -0.05 0.00 -0.53 0.00 0.00 39.78 35.33 1unl n ASN 95 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1unl n GLY 96 N -1.39 1.16 3.00 8.20 0.00 1.00 -4.92 105.19 112.25 1unl n GLY 96 Ca -0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.56 1unl n GLY 96 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1unl s ASP 97 N -2.20 4.65 0.04 1.61 3.68 0.14 -3.44 116.67 121.15 1unl s ASP 97 Ca 0.00 -2.80 -0.12 0.00 2.13 0.00 0.00 52.55 51.76 1unl s ASP 97 Cb 0.00 -1.70 -0.06 0.00 -1.45 0.00 0.00 42.92 39.71 1unl s ASP 97 CO 0.00 -0.30 0.40 -0.76 0.13 0.00 0.00 175.17 174.64 1unl s LEU 98 N 0.01 4.40 0.29 -1.34 1.02 -1.26 -4.94 118.68 116.87 1unl s LEU 98 Ca 0.16 0.87 -0.30 0.00 0.02 0.00 0.00 54.13 54.88 1unl s LEU 98 Cb -0.23 -2.80 -0.11 0.00 0.02 0.00 0.00 46.19 43.07 1unl s LEU 98 CO -0.02 0.24 1.49 -0.62 0.02 0.00 0.00 176.35 177.46 1unl s ASP 99 N -1.44 6.51 0.46 2.29 -1.08 -1.26 -4.86 116.67 117.29 1unl s ASP 99 Ca 0.29 2.83 0.28 0.00 -0.52 0.00 0.00 52.55 55.43 1unl s ASP 99 Cb -0.15 -2.64 1.34 0.00 -1.46 0.00 0.00 42.92 40.01 1unl s ASP 99 CO 0.16 -0.79 1.75 -0.65 0.52 0.00 0.00 175.17 176.16 1unl h PRO 100 N 4.47 0.18 -0.00 4.34 0.11 -1.96 -0.30 132.00 138.84 1unl h PRO 100 Ca -0.47 -0.01 -0.18 0.00 0.11 0.00 0.00 66.00 65.45 1unl h PRO 100 Cb 1.22 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 32.27 1unl h PRO 100 CO 0.75 0.12 -0.81 0.93 -0.21 0.00 0.00 178.00 178.78 1unl h GLU 101 N 0.19 0.10 -0.13 1.05 4.39 -1.98 -2.32 114.58 115.88 1unl h GLU 101 Ca 0.63 -0.11 -0.15 0.00 0.34 0.00 0.00 59.36 60.08 1unl h GLU 101 Cb 2.03 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 30.70 1unl h GLU 101 CO -0.20 0.86 -0.54 0.82 -1.16 0.00 0.00 179.01 178.79 1unl h ILE 102 N 0.06 1.34 -0.50 3.13 2.04 -1.47 -1.51 117.51 120.61 1unl h ILE 102 Ca -0.02 -1.81 0.07 0.00 1.00 0.00 0.00 64.86 64.09 1unl h ILE 102 Cb 1.42 1.83 -0.06 0.00 -0.74 0.00 0.00 36.82 39.27 1unl h ILE 102 CO 0.12 0.55 0.16 0.58 0.00 0.00 0.00 178.15 179.56 1unl h VAL 103 N 0.30 0.80 -0.63 1.67 2.07 -1.18 -0.86 116.25 118.42 1unl h VAL 103 Ca 0.01 -0.11 -0.08 0.00 0.82 0.00 0.00 66.70 67.33 1unl h VAL 103 Cb 1.05 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 31.23 1unl h VAL 103 CO 0.09 0.06 0.07 0.50 0.02 0.00 0.00 177.57 178.32 1unl h LYS 104 N 0.33 1.05 -0.42 1.57 3.64 -1.28 -2.61 116.57 118.86 1unl h LYS 104 Ca 0.24 -0.29 -0.07 0.00 -1.27 0.00 0.00 60.65 59.26 1unl h LYS 104 Cb 0.28 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.96 1unl h LYS 104 CO -0.26 0.98 -0.02 1.03 -2.27 0.00 0.00 179.45 178.91 1unl h SER 105 N 0.98 0.74 -0.34 4.20 0.87 -0.84 -1.12 113.55 118.04 1unl h SER 105 Ca 0.19 -0.32 -0.17 0.00 -1.23 0.00 0.00 61.79 60.26 1unl h SER 105 Cb 0.46 -0.20 -0.00 0.00 -0.44 0.00 0.00 62.40 62.22 1unl h SER 105 CO 0.02 0.88 -0.45 -0.26 -0.53 0.00 0.00 176.83 176.48 1unl h PHE 106 N 0.58 1.12 -0.32 2.24 0.04 -1.09 -1.97 116.94 117.55 1unl h PHE 106 Ca 0.12 -0.36 -0.07 0.00 2.80 0.00 0.00 57.97 60.46 1unl h PHE 106 Cb 0.51 -0.22 -0.01 0.00 2.20 0.00 0.00 35.95 38.42 1unl h PHE 106 CO 0.04 1.19 -0.07 1.25 -0.60 0.00 0.00 178.31 180.13 1unl h LEU 107 N 0.72 0.61 -0.78 1.54 5.85 -1.38 -0.52 115.31 121.35 1unl h LEU 107 Ca 0.04 -0.36 0.06 0.00 0.84 0.00 0.00 57.88 58.47 1unl h LEU 107 Cb 1.05 -0.17 -0.06 0.00 0.37 0.00 0.00 40.66 41.86 1unl h LEU 107 CO 0.11 0.82 0.46 0.15 -0.34 0.00 0.00 178.44 179.65 1unl h PHE 108 N 0.38 0.86 -0.23 1.25 3.57 -1.12 0.39 116.94 122.04 1unl h PHE 108 Ca 0.08 0.03 -0.18 0.00 3.53 0.00 0.00 57.97 61.42 1unl h PHE 108 Cb 0.55 -0.27 -0.00 0.00 2.79 0.00 0.00 35.95 39.02 1unl h PHE 108 CO 0.05 0.42 -0.59 1.96 -2.23 0.00 0.00 178.31 177.92 1unl h GLN 109 N 0.84 0.75 -0.16 1.11 4.20 -1.17 -0.68 115.11 120.01 1unl h GLN 109 Ca 0.35 -0.50 -0.00 0.00 0.06 0.00 0.00 58.65 58.55 1unl h GLN 109 Cb 0.19 0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.03 1unl h GLN 109 CO -0.18 1.13 0.08 1.25 -0.67 0.00 0.00 178.83 180.44 1unl h LEU 110 N 0.57 0.20 -1.12 1.46 5.85 -0.67 -1.82 115.31 119.78 1unl h LEU 110 Ca 0.00 -0.10 -0.01 0.00 0.84 0.00 0.00 57.88 58.61 1unl h LEU 110 Cb 1.18 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 42.12 1unl h LEU 110 CO 0.12 0.24 0.40 -0.07 -0.34 0.00 0.00 178.44 178.79 1unl h LEU 111 N 0.15 0.91 0.09 2.25 3.38 -0.76 0.06 115.31 121.38 1unl h LEU 111 Ca 0.06 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 1unl h LEU 111 Cb 0.09 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.61 1unl h LEU 111 CO -0.01 0.73 -0.04 0.11 0.09 0.00 0.00 178.44 179.32 1unl h LYS 112 N 1.02 -0.12 -0.59 1.13 1.57 -0.97 0.40 116.57 119.01 1unl h LYS 112 Ca 0.26 0.01 0.02 0.00 -1.87 0.00 0.00 60.65 59.06 1unl h LYS 112 Cb 0.03 0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.33 1unl h LYS 112 CO -0.04 0.07 0.38 0.78 -0.57 0.00 0.00 179.45 180.07 1unl h GLY 113 N -0.29 0.83 0.93 3.86 0.00 -1.14 -2.07 103.07 105.19 1unl h GLY 113 Ca -0.01 -0.29 -0.07 0.00 0.00 0.00 0.00 47.33 46.96 1unl h GLY 113 CO 0.02 0.27 -0.05 -2.00 0.00 0.00 0.00 176.54 174.78 1unl h LEU 114 N 0.76 0.67 -1.00 3.11 5.85 -0.95 -2.32 115.31 121.43 1unl h LEU 114 Ca 0.23 -0.34 0.11 0.00 0.84 0.00 0.00 57.88 58.71 1unl h LEU 114 Cb -0.04 -0.18 -0.08 0.00 0.37 0.00 0.00 40.66 40.73 1unl h LEU 114 CO -0.07 0.86 0.63 1.23 -0.34 0.00 0.00 178.44 180.74 1unl h GLY 115 N 0.47 1.60 0.98 3.75 0.00 -0.09 -0.61 103.07 109.18 1unl h GLY 115 Ca 0.10 -0.43 -0.12 0.00 0.00 0.00 0.00 47.33 46.88 1unl h GLY 115 CO 0.03 0.20 -0.26 -2.75 0.00 0.00 0.00 176.54 173.76 1unl h PHE 116 N 1.03 0.86 0.19 5.60 3.57 -1.22 -1.64 116.94 125.34 1unl h PHE 116 Ca 0.48 -0.25 -0.01 0.00 3.53 0.00 0.00 57.97 61.72 1unl h PHE 116 Cb 0.40 -0.18 0.00 0.00 2.79 0.00 0.00 35.95 38.96 1unl h PHE 116 CO -0.01 0.99 -0.09 0.00 -2.23 0.00 0.00 178.31 176.97 1unl h HIS 118 N -0.29 0.97 0.00 0.00 3.86 -1.11 -0.94 115.15 117.64 1unl h HIS 118 Ca -0.03 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.21 1unl h HIS 118 Cb 0.23 -0.31 -0.00 0.00 1.06 0.00 0.00 27.41 28.39 1unl h HIS 118 CO -0.06 0.46 -0.03 0.66 0.86 0.00 0.00 177.93 179.83 1unl h SER 119 N 0.93 0.00 -0.60 2.45 4.64 -1.22 -2.61 113.55 117.15 1unl h SER 119 Ca 0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 1unl h SER 119 Cb 0.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 1unl h SER 119 CO -0.20 0.03 0.00 0.54 -0.87 0.00 0.00 176.83 176.33 1unl n ARG 120 N -3.12 3.12 -3.24 4.77 5.12 -0.73 -4.96 116.66 117.62 1unl n ARG 120 Ca 0.01 -2.46 -0.16 0.00 -1.93 0.00 0.00 57.85 53.32 1unl n ARG 120 Cb 0.37 -1.72 0.07 0.00 -1.16 0.00 0.00 32.46 30.02 1unl n ARG 120 CO 0.00 0.00 0.00 0.09 -1.93 0.00 0.00 177.63 175.79 1unl n ASN 121 N 1.12 -3.00 -3.91 0.55 4.13 -0.87 -4.97 115.26 108.31 1unl n ASN 121 Ca 0.22 -0.49 -0.22 0.00 1.68 0.00 0.00 54.58 55.77 1unl n ASN 121 Cb 0.72 -4.30 -0.17 0.00 -1.54 0.00 0.00 39.78 34.49 1unl n ASN 121 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1unl s VAL 122 N -3.29 0.68 -0.13 2.41 1.01 -0.44 -1.58 120.40 119.06 1unl s VAL 122 Ca 0.13 -0.19 -0.09 0.00 0.00 0.00 0.00 61.98 61.83 1unl s VAL 122 Cb -0.06 -0.69 -0.04 0.00 0.00 0.00 0.00 36.38 35.59 1unl s VAL 122 CO 0.60 0.26 0.18 -0.76 0.00 0.00 0.00 175.10 175.39 1unl s LEU 123 N 0.99 4.34 -0.11 3.92 1.43 -0.56 -3.30 118.68 125.40 1unl s LEU 123 Ca -0.10 0.47 -0.21 0.00 -1.03 0.00 0.00 54.13 53.27 1unl s LEU 123 Cb -0.14 -2.16 -0.18 0.00 0.03 0.00 0.00 46.19 43.74 1unl s LEU 123 CO -0.00 0.32 0.66 -0.74 0.23 0.00 0.00 176.35 176.81 1unl h HIS 124 N 5.51 -0.04 -1.27 0.29 -0.00 -1.90 -2.15 115.15 115.59 1unl h HIS 124 Ca -0.50 -0.00 -0.35 0.00 -0.00 0.00 0.00 60.37 59.52 1unl h HIS 124 Cb 1.20 0.01 -0.10 0.00 -0.00 0.00 0.00 27.41 28.52 1unl h HIS 124 CO 0.70 0.60 -0.35 0.54 -0.00 0.00 0.00 177.93 179.41 1unl n ARG 125 N -4.73 -1.23 -2.69 5.26 1.74 -1.26 -2.55 116.66 111.20 1unl n ARG 125 Ca -0.07 1.02 -0.06 0.00 -0.77 0.00 0.00 57.85 57.97 1unl n ARG 125 Cb 0.32 -5.31 0.11 0.00 -1.02 0.00 0.00 32.46 26.56 1unl n ARG 125 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 1unl n ASP 126 N -0.89 -1.26 -4.64 0.55 4.64 -1.26 -1.58 116.55 112.11 1unl n ASP 126 Ca -0.18 -2.40 -0.43 0.00 -1.38 0.00 0.00 54.79 50.40 1unl n ASP 126 Cb 0.59 0.69 -0.02 0.00 -1.04 0.00 0.00 41.12 41.34 1unl n ASP 126 CO 0.00 0.00 0.00 -0.76 -0.82 0.00 0.00 177.20 175.62 1unl s LEU 127 N -3.47 3.96 0.12 -2.67 2.01 -1.26 -4.80 118.68 112.57 1unl s LEU 127 Ca 0.19 1.19 -0.24 0.00 0.01 0.00 0.00 54.13 55.28 1unl s LEU 127 Cb 0.42 -3.54 0.08 0.00 0.01 0.00 0.00 46.19 43.15 1unl s LEU 127 CO -0.08 -0.91 0.65 -1.59 1.01 0.00 0.00 176.35 175.43 1unl s LYS 128 N 3.74 1.19 0.32 1.70 -2.85 -1.26 -4.86 119.74 117.73 1unl s LYS 128 Ca 0.49 -0.39 0.08 0.00 -1.00 0.00 0.00 55.97 55.15 1unl s LYS 128 Cb -0.15 0.55 0.79 0.00 -2.06 0.00 0.00 37.83 36.97 1unl s LYS 128 CO 0.17 -0.51 1.79 -1.35 0.10 0.00 0.00 175.35 175.55 1unl h PRO 129 N 2.08 0.69 0.00 1.78 0.11 -1.93 -0.20 132.00 134.52 1unl h PRO 129 Ca -0.32 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.75 1unl h PRO 129 Cb 1.29 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1unl h PRO 129 CO 0.37 0.46 0.00 -0.56 -0.21 0.00 0.00 178.00 178.06 1unl h GLN 130 N 0.71 0.00 -0.64 1.05 -0.00 -1.94 -1.48 115.11 112.81 1unl h GLN 130 Ca 0.56 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 59.21 1unl h GLN 130 Cb 0.94 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.42 1unl h GLN 130 CO -0.34 0.00 0.00 0.09 -0.00 0.00 0.00 178.83 178.58 1unl n ASN 131 N -2.85 4.76 -4.08 0.06 3.02 -0.10 -4.75 115.26 111.32 1unl n ASN 131 Ca 0.01 -2.54 -0.33 0.00 -0.03 0.00 0.00 54.58 51.68 1unl n ASN 131 Cb 0.26 -0.59 -0.14 0.00 -0.61 0.00 0.00 39.78 38.69 1unl n ASN 131 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1unl s LEU 132 N -1.98 4.16 -0.05 3.41 1.02 -0.59 -1.34 118.68 123.31 1unl s LEU 132 Ca 0.49 -1.68 -0.16 0.00 0.02 0.00 0.00 54.13 52.80 1unl s LEU 132 Cb 0.33 -1.64 -0.05 0.00 0.02 0.00 0.00 46.19 44.85 1unl s LEU 132 CO 0.21 -0.30 0.43 -0.76 0.02 0.00 0.00 176.35 175.95 1unl s LEU 133 N 1.08 4.39 -0.11 1.79 1.43 0.12 -0.76 118.68 126.61 1unl s LEU 133 Ca -0.00 0.89 0.03 0.00 -1.03 0.00 0.00 54.13 54.02 1unl s LEU 133 Cb -0.20 -2.63 -0.00 0.00 0.03 0.00 0.00 46.19 43.39 1unl s LEU 133 CO -0.05 0.19 -0.20 -0.63 0.23 0.00 0.00 176.35 175.88 1unl s ILE 134 N -0.35 2.36 0.55 -0.59 -1.09 0.11 -0.24 121.20 121.95 1unl s ILE 134 Ca 0.24 -0.91 -0.01 0.00 -2.23 0.00 0.00 60.65 57.74 1unl s ILE 134 Cb -0.16 -1.94 0.02 0.00 -1.58 0.00 0.00 42.46 38.81 1unl s ILE 134 CO 0.12 0.55 0.79 0.20 -1.23 0.00 0.00 174.94 175.37 1unl s ASN 135 N 0.40 5.41 0.27 3.58 0.02 -0.32 -2.14 114.94 122.16 1unl s ASN 135 Ca -0.15 0.24 0.12 0.00 -1.02 0.00 0.00 52.86 52.05 1unl s ASN 135 Cb -0.17 -1.21 0.32 0.00 0.02 0.00 0.00 41.25 40.21 1unl s ASN 135 CO 0.07 -1.07 1.57 -0.09 0.02 0.00 0.00 177.10 177.60 1unl h ARG 136 N 0.04 0.00 0.00 -0.60 2.43 -1.99 -1.62 114.38 112.64 1unl h ARG 136 Ca -0.44 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.73 1unl h ARG 136 Cb 1.28 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.83 1unl h ARG 136 CO 0.56 0.61 0.00 0.27 -1.51 0.00 0.00 179.97 179.90 1unl n ASN 137 N -3.61 0.00 0.00 -3.80 6.94 -1.26 -4.89 115.26 108.63 1unl n ASN 137 Ca -0.00 0.13 0.00 0.00 -0.02 0.00 0.00 54.58 54.68 1unl n ASN 137 Cb 0.65 -0.32 0.00 0.00 -2.36 0.00 0.00 39.78 37.75 1unl n ASN 137 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1unl n GLY 138 N 0.15 0.84 3.76 4.83 0.00 -0.61 -5.07 105.19 109.08 1unl n GLY 138 Ca 0.07 -0.21 -0.40 0.00 0.00 0.00 0.00 46.02 45.48 1unl n GLY 138 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1unl s GLU 139 N -0.61 4.54 -0.09 1.61 2.02 -1.26 -4.88 118.70 120.04 1unl s GLU 139 Ca 0.00 1.13 -0.00 0.00 0.02 0.00 0.00 54.97 56.12 1unl s GLU 139 Cb 0.00 -3.32 -0.03 0.00 0.10 0.00 0.00 34.13 30.88 1unl s GLU 139 CO 0.00 0.40 -0.06 -1.17 0.02 0.00 0.00 175.26 174.45 1unl s LEU 140 N -0.52 3.17 -0.05 1.80 0.20 -1.26 -1.18 118.68 120.84 1unl s LEU 140 Ca 0.38 -0.06 0.01 0.00 0.69 0.00 0.00 54.13 55.15 1unl s LEU 140 Cb -0.22 -1.71 0.02 0.00 -0.43 0.00 0.00 46.19 43.85 1unl s LEU 140 CO 0.25 0.31 -0.05 -0.54 -0.29 0.00 0.00 176.35 176.02 1unl s LYS 141 N -0.48 0.96 0.15 1.98 1.02 0.67 -4.48 119.74 119.56 1unl s LYS 141 Ca 0.07 -0.15 -0.30 0.00 0.02 0.00 0.00 55.97 55.62 1unl s LYS 141 Cb -0.12 -0.94 -0.07 0.00 -0.52 0.00 0.00 37.83 36.18 1unl s LYS 141 CO 0.02 -0.08 1.03 -1.17 -0.92 0.00 0.00 175.35 174.24 1unl s LEU 142 N 0.94 4.50 0.29 3.17 2.96 0.02 -0.70 118.68 129.86 1unl s LEU 142 Ca -0.11 1.96 0.03 0.00 -0.22 0.00 0.00 54.13 55.79 1unl s LEU 142 Cb -0.14 -3.60 -0.04 0.00 0.50 0.00 0.00 46.19 42.91 1unl s LEU 142 CO 0.00 -0.14 0.15 0.00 -1.32 0.00 0.00 176.35 175.04 1unl s ALA 143 N -0.18 1.87 -0.42 5.97 0.00 -0.45 -0.99 121.76 127.57 1unl s ALA 143 Ca 0.48 -1.77 -0.14 0.00 0.00 0.00 0.00 51.96 50.52 1unl s ALA 143 Cb -0.27 1.15 0.02 0.00 0.00 0.00 0.00 23.12 24.02 1unl s ALA 143 CO 0.32 -0.50 0.54 0.09 0.00 0.00 0.00 175.76 176.21 1unl n ASN 144 N -0.81 -7.98 -2.16 0.00 3.02 -1.26 -4.81 115.26 101.26 1unl n ASN 144 Ca 0.01 0.64 -0.25 0.00 -0.03 0.00 0.00 54.58 54.94 1unl n ASN 144 Cb 0.65 -5.40 0.13 0.00 -0.61 0.00 0.00 39.78 34.56 1unl n ASN 144 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1unl n PHE 145 N -0.19 2.85 0.14 3.10 3.01 -1.26 -4.56 117.46 120.56 1unl n PHE 145 Ca 0.11 -2.10 0.01 0.00 1.01 0.00 0.00 57.45 56.48 1unl n PHE 145 Cb 0.41 -1.05 0.14 0.00 -0.01 0.00 0.00 39.48 38.98 1unl n PHE 145 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 1unl h GLY 146 N 1.54 0.00 -0.71 1.37 0.00 -1.89 -2.82 103.07 100.56 1unl h GLY 146 Ca 0.57 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.90 1unl h GLY 146 CO 1.16 0.00 -0.14 1.04 0.00 0.00 0.00 176.54 178.60 1unl n LEU 147 N -3.47 1.81 -4.81 3.11 4.32 -1.26 -4.83 117.00 111.86 1unl n LEU 147 Ca 0.00 -0.60 -0.32 0.00 -0.02 0.00 0.00 56.01 55.07 1unl n LEU 147 Cb 0.67 -0.03 0.01 0.00 -1.62 0.00 0.00 43.42 42.45 1unl n LEU 147 CO 0.41 0.31 0.71 0.00 -1.22 0.00 0.00 177.39 177.60 1unl s ALA 148 N -2.20 2.78 0.19 -1.18 0.00 -1.06 -4.66 121.76 115.64 1unl s ALA 148 Ca 0.29 0.30 -0.18 0.00 0.00 0.00 0.00 51.96 52.38 1unl s ALA 148 Cb 0.20 -3.20 0.03 0.00 0.00 0.00 0.00 23.12 20.15 1unl s ALA 148 CO 0.41 -0.80 0.52 -0.98 0.00 0.00 0.00 175.76 174.91 1unl s ARG 149 N -4.27 1.36 0.23 0.00 1.70 -0.81 -4.90 118.95 112.26 1unl s ARG 149 Ca 0.62 -0.84 -0.30 0.00 -0.47 0.00 0.00 55.73 54.74 1unl s ARG 149 Cb -0.15 0.52 -0.09 0.00 -0.57 0.00 0.00 34.95 34.67 1unl s ARG 149 CO 0.40 -0.58 0.93 0.00 -1.08 0.00 0.00 175.30 174.97 1unl s ALA 150 N -3.86 3.34 0.17 7.88 0.00 -1.26 -1.50 121.76 126.53 1unl s ALA 150 Ca 0.08 0.60 0.10 0.00 0.00 0.00 0.00 51.96 52.75 1unl s ALA 150 Cb -0.01 -3.20 -0.04 0.00 0.00 0.00 0.00 23.12 19.87 1unl s ALA 150 CO -0.04 0.20 -0.17 -0.59 0.00 0.00 0.00 175.76 175.16 1unl s PHE 151 N -1.11 2.48 0.00 0.00 -0.71 -0.61 -4.92 117.98 113.10 1unl s PHE 151 Ca 0.41 -0.29 0.00 0.00 -1.04 0.00 0.00 56.93 56.01 1unl s PHE 151 Cb -0.26 -1.24 0.00 0.00 -1.21 0.00 0.00 43.02 40.31 1unl s PHE 151 CO 0.32 0.48 0.00 0.41 -1.34 0.00 0.00 175.22 175.08 1unl n GLY 152 N 0.29 3.15 3.67 1.99 0.00 -1.26 -4.76 105.19 108.28 1unl n GLY 152 Ca -0.13 -0.45 -0.47 0.00 0.00 0.00 0.00 46.02 44.97 1unl n GLY 152 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1unl n ILE 153 N 0.00 0.25 -1.14 -0.61 5.41 -1.26 -4.81 119.36 117.20 1unl n ILE 153 Ca 0.00 -0.05 -0.47 0.00 1.00 0.00 0.00 62.75 63.24 1unl n ILE 153 Cb 0.00 -1.66 -0.11 0.00 -0.71 0.00 0.00 39.64 37.15 1unl n ILE 153 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 1unl n PRO 154 N 4.80 0.00 -4.80 0.38 -0.01 -1.26 -4.88 135.00 129.23 1unl n PRO 154 Ca 0.19 0.00 -0.33 0.00 -0.01 0.00 0.00 63.50 63.36 1unl n PRO 154 Cb 0.29 -1.29 -0.13 0.00 -0.01 0.00 0.00 33.50 32.36 1unl n PRO 154 CO 0.00 0.00 0.00 0.08 -0.01 0.00 0.00 175.50 175.57 1unl s VAL 155 N 5.96 3.16 0.16 -1.45 1.01 -1.26 -5.01 120.40 122.97 1unl s VAL 155 Ca 1.08 -0.75 -0.15 0.00 0.00 0.00 0.00 61.98 62.15 1unl s VAL 155 Cb -1.23 -2.27 0.04 0.00 0.00 0.00 0.00 36.38 32.92 1unl s VAL 155 CO 0.52 0.55 1.75 -0.09 0.00 0.00 0.00 175.10 177.83 1unl h ARG 156 N 5.17 0.27 -1.60 2.72 2.43 -1.98 -3.48 114.38 117.90 1unl h ARG 156 Ca -0.47 -0.02 0.33 0.00 -0.81 0.00 0.00 59.98 59.02 1unl h ARG 156 Cb 1.16 -0.06 -0.11 0.00 -0.42 0.00 0.00 29.97 30.54 1unl h ARG 156 CO 0.51 0.18 0.85 0.00 -1.51 0.00 0.00 179.97 180.00 1unl s TYR 158 N -2.29 1.96 0.40 0.00 1.51 -0.14 -5.05 117.35 113.74 1unl s TYR 158 Ca 0.18 -0.42 -0.27 0.00 -1.01 0.00 0.00 57.07 55.55 1unl s TYR 158 Cb 0.04 -1.03 -0.10 0.00 -0.11 0.00 0.00 41.96 40.76 1unl s TYR 158 CO -0.03 0.31 1.46 0.45 -1.11 0.00 0.00 175.55 176.63 1unl s SER 159 N -2.27 6.18 0.00 2.29 0.15 -1.26 -4.46 113.70 114.33 1unl s SER 159 Ca 0.12 3.00 0.26 0.00 0.70 0.00 0.00 55.95 60.04 1unl s SER 159 Cb -0.08 -2.66 0.60 0.00 -1.71 0.00 0.00 66.02 62.17 1unl s SER 159 CO 0.06 -0.98 1.47 0.00 1.20 0.00 0.00 173.24 174.99 1unl n ALA 160 N 0.22 3.12 -2.10 5.45 0.00 -1.26 -4.47 120.51 121.48 1unl n ALA 160 Ca 0.02 -0.47 -0.40 0.00 0.00 0.00 0.00 53.44 52.59 1unl n ALA 160 Cb 0.40 -1.05 -0.00 0.00 0.00 0.00 0.00 19.45 18.80 1unl n ALA 160 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1unl n GLU 161 N -0.39 4.61 -4.22 0.00 -0.58 -1.26 -4.84 120.64 113.96 1unl n GLU 161 Ca 0.12 -3.60 -0.13 0.00 -0.42 0.00 0.00 57.16 53.13 1unl n GLU 161 Cb 0.38 -2.64 -0.10 0.00 -0.57 0.00 0.00 31.44 28.51 1unl n GLU 161 CO 0.00 0.00 0.00 0.14 -0.48 0.00 0.00 177.13 176.79 1unl s VAL 162 N -1.38 1.02 0.28 2.62 -7.23 -1.26 -5.08 120.40 109.37 1unl s VAL 162 Ca 0.51 -2.01 0.00 0.00 -1.81 0.00 0.00 61.98 58.67 1unl s VAL 162 Cb 0.18 -1.79 0.00 0.00 0.56 0.00 0.00 36.38 35.33 1unl s VAL 162 CO -0.09 -0.78 0.00 0.52 -0.31 0.00 0.00 175.10 174.44 1unl n VAL 163 N -0.13 -4.02 -1.70 1.32 0.31 -0.61 -4.90 118.33 108.60 1unl n VAL 163 Ca -0.11 1.68 -0.41 0.00 -0.01 0.00 0.00 64.34 65.49 1unl n VAL 163 Cb 0.61 -2.48 0.01 0.00 -0.91 0.00 0.00 33.84 31.06 1unl n VAL 163 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1unl n THR 164 N -0.15 2.56 -0.28 2.52 -1.04 -1.26 -4.72 114.28 111.92 1unl n THR 164 Ca 0.00 -0.50 0.07 0.00 -2.04 0.00 0.00 64.05 61.58 1unl n THR 164 Cb 0.00 -1.55 0.22 0.00 -1.82 0.00 0.00 70.33 67.18 1unl n THR 164 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 1unl h LEU 165 N 2.05 0.38 -1.78 -4.42 5.85 -1.96 -1.51 115.31 113.91 1unl h LEU 165 Ca -0.48 0.11 -0.00 0.00 0.84 0.00 0.00 57.88 58.35 1unl h LEU 165 Cb 1.30 0.06 -0.00 0.00 0.37 0.00 0.00 40.66 42.39 1unl h LEU 165 CO 0.60 0.13 -0.01 -0.50 -0.34 0.00 0.00 178.44 178.32 1unl h TRP 166 N 0.50 0.00 -0.24 1.25 6.55 -1.89 -2.27 115.95 119.85 1unl h TRP 166 Ca 0.45 0.00 0.00 0.00 0.95 0.00 0.00 58.89 60.29 1unl h TRP 166 Cb 0.69 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.99 1unl h TRP 166 CO -0.14 0.01 0.00 0.66 -1.05 0.00 0.00 178.44 177.92 1unl n TYR 167 N -3.11 0.31 -2.93 0.49 4.01 -0.60 -4.60 117.16 110.73 1unl n TYR 167 Ca -0.00 -0.33 -0.40 0.00 -0.16 0.00 0.00 57.90 57.01 1unl n TYR 167 Cb 0.26 -0.02 -0.05 0.00 -0.31 0.00 0.00 39.34 39.23 1unl n TYR 167 CO 0.00 0.00 0.00 0.50 -0.46 0.00 0.00 176.86 176.90 1unl s ARG 168 N -0.98 4.52 0.61 -0.72 3.52 -0.86 -4.03 118.95 121.01 1unl s ARG 168 Ca 0.20 1.12 -0.15 0.00 -0.13 0.00 0.00 55.73 56.77 1unl s ARG 168 Cb 0.11 -3.39 -0.03 0.00 -1.56 0.00 0.00 34.95 30.08 1unl s ARG 168 CO 0.15 0.20 1.07 -1.25 -0.81 0.00 0.00 175.30 174.66 1unl s PRO 169 N 0.23 3.22 0.40 5.12 0.04 -1.26 -4.86 135.00 137.90 1unl s PRO 169 Ca 0.41 1.22 0.07 0.00 0.04 0.00 0.00 61.00 62.75 1unl s PRO 169 Cb -0.20 -2.02 0.84 0.00 0.04 0.00 0.00 34.50 33.16 1unl s PRO 169 CO 0.23 -0.89 2.02 -1.00 0.04 0.00 0.00 177.00 177.40 1unl h PRO 170 N 0.32 0.48 -0.74 0.56 0.13 -1.94 -1.31 132.00 129.51 1unl h PRO 170 Ca -0.47 -0.05 -0.04 0.00 -0.87 0.00 0.00 66.00 64.58 1unl h PRO 170 Cb 1.22 -0.10 -0.03 0.00 0.13 0.00 0.00 31.00 32.22 1unl h PRO 170 CO 0.57 0.37 0.29 0.38 -0.23 0.00 0.00 178.00 179.38 1unl h ASP 171 N 0.48 1.01 0.50 1.44 -0.00 -1.94 -0.98 116.42 116.93 1unl h ASP 171 Ca 0.12 -0.15 -0.20 0.00 -0.00 0.00 0.00 57.03 56.81 1unl h ASP 171 Cb 0.04 -0.26 -0.01 0.00 -0.00 0.00 0.00 39.33 39.10 1unl h ASP 171 CO -0.02 0.89 -0.85 0.58 -0.00 0.00 0.00 179.24 179.85 1unl h VAL 172 N 1.07 1.46 0.00 4.15 2.07 -1.69 -1.10 116.25 122.22 1unl h VAL 172 Ca 0.25 -2.49 -0.06 0.00 0.82 0.00 0.00 66.70 65.22 1unl h VAL 172 Cb 0.20 2.38 -0.01 0.00 -1.52 0.00 0.00 31.29 32.35 1unl h VAL 172 CO -0.02 0.73 -0.29 -0.07 0.02 0.00 0.00 177.57 177.94 1unl h LEU 173 N 0.15 0.00 -1.20 2.57 3.38 -0.93 0.61 115.31 119.89 1unl h LEU 173 Ca -0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1unl h LEU 173 Cb 1.46 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.21 1unl h LEU 173 CO 0.13 0.29 0.00 0.49 0.09 0.00 0.00 178.44 179.44 1unl n PHE 174 N -4.05 0.45 -1.46 1.13 0.99 -0.40 -4.92 117.46 109.20 1unl n PHE 174 Ca -0.02 -0.20 0.00 0.00 -0.00 0.00 0.00 57.45 57.23 1unl n PHE 174 Cb 0.35 -0.06 0.00 0.00 -1.00 0.00 0.00 39.48 38.77 1unl n PHE 174 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1unl n GLY 175 N 0.76 0.48 3.68 1.37 0.00 0.21 -1.31 105.19 110.37 1unl n GLY 175 Ca 0.09 -0.89 -0.46 0.00 0.00 0.00 0.00 46.02 44.77 1unl n GLY 175 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1unl n ALA 176 N -0.32 1.53 0.75 4.61 0.00 -0.46 -4.44 120.51 122.19 1unl n ALA 176 Ca 0.00 0.44 0.08 0.00 0.00 0.00 0.00 53.44 53.95 1unl n ALA 176 Cb 0.27 -2.38 -0.05 0.00 0.00 0.00 0.00 19.45 17.30 1unl n ALA 176 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1unl n LYS 177 N 3.58 1.69 -3.87 0.00 4.76 -1.26 -4.21 118.16 118.84 1unl n LYS 177 Ca 0.17 -0.38 -0.30 0.00 -2.87 0.00 0.00 58.31 54.93 1unl n LYS 177 Cb 0.30 -1.27 -0.15 0.00 -1.84 0.00 0.00 35.03 32.06 1unl n LYS 177 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1unl s LEU 178 N -2.45 2.73 0.11 -0.35 1.43 -1.26 -0.97 118.68 117.92 1unl s LEU 178 Ca 0.10 -1.45 -0.02 0.00 -1.03 0.00 0.00 54.13 51.72 1unl s LEU 178 Cb 0.13 -1.11 -0.04 0.00 0.03 0.00 0.00 46.19 45.20 1unl s LEU 178 CO 0.55 -0.32 0.06 -0.72 0.23 0.00 0.00 176.35 176.15 1unl s TYR 179 N 1.42 0.71 0.00 0.29 -0.85 -1.26 -5.08 117.35 112.58 1unl s TYR 179 Ca 0.02 -1.13 0.00 0.00 -0.52 0.00 0.00 57.07 55.44 1unl s TYR 179 Cb -0.18 -0.40 0.00 0.00 0.38 0.00 0.00 41.96 41.75 1unl s TYR 179 CO -0.12 -0.51 0.00 -1.13 -1.52 0.00 0.00 175.55 172.27 1unl n SER 180 N -0.06 0.01 0.25 -0.18 3.41 -1.26 -4.99 113.62 110.80 1unl n SER 180 Ca -0.08 0.00 0.16 0.00 -0.26 0.00 0.00 58.87 58.69 1unl n SER 180 Cb 0.63 0.00 0.85 0.00 -0.26 0.00 0.00 64.21 65.43 1unl n SER 180 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 1unl h THR 181 N 0.00 0.00 -0.22 6.66 1.35 -1.98 -2.93 112.91 115.79 1unl h THR 181 Ca 0.00 0.00 0.06 0.00 -0.55 0.00 0.00 66.41 65.92 1unl h THR 181 Cb 0.00 0.69 -0.01 0.00 -1.73 0.00 0.00 68.15 67.10 1unl h THR 181 CO 0.00 0.00 0.27 0.77 -0.25 0.00 0.00 175.52 176.31 1unl h SER 182 N 0.00 0.00 -0.34 5.36 4.64 -1.94 -2.92 113.55 118.35 1unl h SER 182 Ca 0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 1unl h SER 182 Cb 0.08 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.16 1unl h SER 182 CO 0.00 0.00 0.08 -0.29 -0.87 0.00 0.00 176.83 175.75 1unl h ILE 183 N 0.00 1.22 -0.02 0.95 2.10 -1.91 -2.47 117.51 117.39 1unl h ILE 183 Ca 0.10 -0.76 -0.13 0.00 1.08 0.00 0.00 64.86 65.15 1unl h ILE 183 Cb 0.64 1.07 -0.02 0.00 -1.09 0.00 0.00 36.82 37.43 1unl h ILE 183 CO -0.00 0.26 -0.58 0.44 -1.08 0.00 0.00 178.15 177.19 1unl h ASP 184 N 0.40 0.07 -0.36 2.19 3.45 -1.78 -3.22 116.42 117.16 1unl h ASP 184 Ca 0.11 -0.04 -0.08 0.00 0.43 0.00 0.00 57.03 57.45 1unl h ASP 184 Cb 0.31 -0.02 -0.02 0.00 -0.56 0.00 0.00 39.33 39.04 1unl h ASP 184 CO 0.00 0.63 -0.05 0.24 -1.57 0.00 0.00 179.24 178.50 1unl h MET 185 N 0.05 0.76 -0.30 3.56 2.86 -1.42 -0.44 114.93 119.99 1unl h MET 185 Ca -0.00 -0.22 -0.01 0.00 -2.06 0.00 0.00 59.70 57.40 1unl h MET 185 Cb 1.03 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 32.60 1unl h MET 185 CO 0.08 0.81 0.14 2.35 1.06 0.00 0.00 176.91 181.34 1unl h TRP 186 N 0.71 0.45 -0.77 -0.22 2.91 -1.50 -2.21 115.95 115.31 1unl h TRP 186 Ca 0.13 -0.03 0.04 0.00 1.13 0.00 0.00 58.89 60.16 1unl h TRP 186 Cb 0.50 -0.14 -0.04 0.00 -0.51 0.00 0.00 29.16 28.97 1unl h TRP 186 CO 0.03 0.42 0.51 0.77 -1.03 0.00 0.00 178.44 179.13 1unl h SER 187 N 0.35 0.80 -0.55 2.65 0.02 -1.49 -1.71 113.55 113.61 1unl h SER 187 Ca 0.10 -0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 61.01 1unl h SER 187 Cb 0.15 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 62.48 1unl h SER 187 CO -0.01 0.55 0.21 0.00 -1.14 0.00 0.00 176.83 176.43 1unl h ALA 188 N 1.55 1.25 -0.57 3.77 0.00 -0.84 -2.09 119.26 122.34 1unl h ALA 188 Ca 0.31 -0.18 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 1unl h ALA 188 Cb 0.08 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 1unl h ALA 188 CO -0.09 0.54 0.18 0.78 0.00 0.00 0.00 179.25 180.65 1unl h GLY 189 N 0.98 0.95 0.99 0.00 0.00 -0.72 -0.24 103.07 105.04 1unl h GLY 189 Ca 0.20 -0.56 -0.02 0.00 0.00 0.00 0.00 47.33 46.94 1unl h GLY 189 CO -0.01 0.53 0.26 0.00 0.00 0.00 0.00 176.54 177.32 1unl h ILE 191 N 0.78 1.24 -0.84 0.00 2.04 -1.22 -2.77 117.51 116.74 1unl h ILE 191 Ca 0.20 -0.81 0.20 0.00 1.00 0.00 0.00 64.86 65.44 1unl h ILE 191 Cb 0.14 1.38 -0.12 0.00 -0.74 0.00 0.00 36.82 37.48 1unl h ILE 191 CO -0.02 0.25 0.31 0.15 0.00 0.00 0.00 178.15 178.84 1unl h PHE 192 N 0.12 0.50 -0.48 1.37 3.57 -0.81 0.15 116.94 121.37 1unl h PHE 192 Ca 0.06 0.04 -0.10 0.00 3.53 0.00 0.00 57.97 61.50 1unl h PHE 192 Cb 0.36 -0.09 -0.02 0.00 2.79 0.00 0.00 35.95 38.99 1unl h PHE 192 CO 0.03 -0.06 -0.11 0.00 -2.23 0.00 0.00 178.31 175.93 1unl h ALA 193 N 1.68 0.90 -0.04 2.41 0.00 -1.02 -0.61 119.26 122.58 1unl h ALA 193 Ca 0.51 -0.33 -0.00 0.00 0.00 0.00 0.00 54.91 55.08 1unl h ALA 193 Cb 0.93 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 1unl h ALA 193 CO -0.53 0.63 0.02 0.93 0.00 0.00 0.00 179.25 180.31 1unl h GLU 194 N 0.79 0.06 -0.70 0.00 5.08 -1.03 -2.97 114.58 115.82 1unl h GLU 194 Ca 0.13 -0.01 0.13 0.00 -1.00 0.00 0.00 59.36 58.61 1unl h GLU 194 Cb 0.63 -0.01 -0.09 0.00 0.50 0.00 0.00 28.75 29.78 1unl h GLU 194 CO 0.04 0.13 0.23 -0.07 -1.00 0.00 0.00 179.01 178.34 1unl h LEU 195 N -0.02 0.15 -2.23 1.33 4.07 -0.78 0.41 115.31 118.24 1unl h LEU 195 Ca 0.02 0.11 0.00 0.00 0.08 0.00 0.00 57.88 58.09 1unl h LEU 195 Cb 0.08 0.12 0.00 0.00 1.08 0.00 0.00 40.66 41.95 1unl h LEU 195 CO -0.00 0.06 0.00 0.00 -1.08 0.00 0.00 178.44 177.41 1unl n ALA 196 N -2.56 2.94 -1.42 1.53 0.00 -0.26 -4.60 120.51 116.14 1unl n ALA 196 Ca 0.12 -1.05 0.00 0.00 0.00 0.00 0.00 53.44 52.52 1unl n ALA 196 Cb 0.39 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.81 1unl n ALA 196 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1unl n ASN 197 N 0.63 0.00 0.00 0.00 2.85 -1.06 -2.68 115.26 115.01 1unl n ASN 197 Ca 0.17 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.64 1unl n ASN 197 Cb 0.65 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.67 1unl n ASN 197 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1unl n ALA 198 N -2.58 0.96 -2.37 5.20 0.00 -1.16 -4.80 120.51 115.76 1unl n ALA 198 Ca 0.00 -0.07 -0.19 0.00 0.00 0.00 0.00 53.44 53.17 1unl n ALA 198 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 1unl n ALA 198 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1unl n GLY 199 N 0.00 -0.43 3.73 0.00 0.00 0.11 -4.45 105.19 104.16 1unl n GLY 199 Ca 0.00 -0.07 -0.34 0.00 0.00 0.00 0.00 46.02 45.60 1unl n GLY 199 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1unl s ARG 200 N -4.96 3.03 0.22 1.61 1.81 -1.26 -4.98 118.95 114.41 1unl s ARG 200 Ca 0.00 -0.43 -0.32 0.00 -1.72 0.00 0.00 55.73 53.27 1unl s ARG 200 Cb 0.00 -2.84 -0.14 0.00 -0.45 0.00 0.00 34.95 31.53 1unl s ARG 200 CO 0.00 0.69 1.42 -2.30 -0.68 0.00 0.00 175.30 174.43 1unl n PRO 201 N 1.76 2.01 -0.14 3.54 -0.02 -1.26 -4.39 135.00 136.50 1unl n PRO 201 Ca -0.17 0.72 -0.12 0.00 -2.02 0.00 0.00 63.50 61.91 1unl n PRO 201 Cb 0.53 -2.38 -0.01 0.00 -0.02 0.00 0.00 33.50 31.62 1unl n PRO 201 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1unl h LEU 202 N 4.45 0.92 -6.44 2.45 5.85 -1.92 -3.38 115.31 117.23 1unl h LEU 202 Ca -0.45 -0.41 -0.60 0.00 0.84 0.00 0.00 57.88 57.26 1unl h LEU 202 Cb 1.28 -0.25 -0.41 0.00 0.37 0.00 0.00 40.66 41.64 1unl h LEU 202 CO 0.77 1.12 -0.71 0.49 -0.34 0.00 0.00 178.44 179.77 1unl n PHE 203 N -4.19 2.37 -1.87 1.25 3.72 -1.26 -5.02 117.46 112.45 1unl n PHE 203 Ca -0.01 -4.01 -0.42 0.00 -0.05 0.00 0.00 57.45 52.96 1unl n PHE 203 Cb 0.45 -0.45 0.00 0.00 -0.94 0.00 0.00 39.48 38.53 1unl n PHE 203 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 1unl n PRO 204 N 1.49 2.98 -2.39 -1.08 -0.04 -1.26 -4.53 135.00 130.17 1unl n PRO 204 Ca 0.26 -2.78 -0.32 0.00 -0.04 0.00 0.00 63.50 60.62 1unl n PRO 204 Cb 0.42 -3.25 -0.03 0.00 -0.04 0.00 0.00 33.50 30.60 1unl n PRO 204 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 1unl s GLY 205 N 2.92 2.03 0.27 0.55 0.00 -1.26 -4.99 107.32 106.84 1unl s GLY 205 Ca 0.46 0.14 0.20 0.00 0.00 0.00 0.00 44.72 45.52 1unl s GLY 205 CO -0.07 0.40 1.27 3.43 0.00 0.00 0.00 173.10 178.14 1unl h ASN 206 N 0.85 0.00 -5.37 1.64 -0.26 -1.94 -3.47 115.58 107.04 1unl h ASN 206 Ca -0.47 0.00 0.15 0.00 -0.56 0.00 0.00 56.30 55.42 1unl h ASN 206 Cb 1.19 0.00 -0.04 0.00 -1.06 0.00 0.00 38.32 38.41 1unl h ASN 206 CO 0.62 0.20 0.54 1.51 -1.06 0.00 0.00 177.43 179.24 1unl s ASP 207 N -5.93 -0.02 0.19 5.81 1.47 -1.26 -5.02 116.67 111.92 1unl s ASP 207 Ca 0.02 -0.67 -0.11 0.00 1.18 0.00 0.00 52.55 52.97 1unl s ASP 207 Cb 0.08 0.53 0.21 0.00 -0.34 0.00 0.00 42.92 43.40 1unl s ASP 207 CO 0.75 -1.03 1.75 0.58 0.68 0.00 0.00 175.17 177.89 1unl h VAL 208 N 2.00 0.81 -0.00 2.11 2.07 -1.97 0.32 116.25 121.59 1unl h VAL 208 Ca -0.27 -0.13 -0.00 0.00 0.82 0.00 0.00 66.70 67.11 1unl h VAL 208 Cb 1.22 0.39 -0.00 0.00 -1.52 0.00 0.00 31.29 31.38 1unl h VAL 208 CO 0.35 0.07 0.00 -0.78 0.02 0.00 0.00 177.57 177.23 1unl h ASP 209 N 0.39 0.01 -0.20 0.57 1.82 -1.96 -2.13 116.42 114.91 1unl h ASP 209 Ca 0.27 -0.05 -0.01 0.00 -0.39 0.00 0.00 57.03 56.84 1unl h ASP 209 Cb 0.30 -0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.29 1unl h ASP 209 CO -0.27 0.05 0.09 -0.78 -1.61 0.00 0.00 179.24 176.73 1unl h ASP 210 N -0.04 0.31 -0.10 2.28 3.58 -1.87 -2.46 116.42 118.11 1unl h ASP 210 Ca 0.00 -0.02 -0.01 0.00 0.42 0.00 0.00 57.03 57.42 1unl h ASP 210 Cb 0.05 -0.08 -0.00 0.00 1.72 0.00 0.00 39.33 41.02 1unl h ASP 210 CO -0.00 0.29 0.02 -0.61 -2.88 0.00 0.00 179.24 176.06 1unl h GLN 211 N 0.35 0.17 -0.74 0.28 5.75 -0.34 -0.65 115.11 119.91 1unl h GLN 211 Ca 0.09 -0.04 0.01 0.00 -0.15 0.00 0.00 58.65 58.55 1unl h GLN 211 Cb 0.09 -0.02 -0.04 0.00 1.07 0.00 0.00 27.48 28.58 1unl h GLN 211 CO -0.01 0.35 0.49 -0.07 -2.65 0.00 0.00 178.83 176.95 1unl h LEU 212 N -0.05 0.86 -0.41 -2.39 3.38 -1.18 -2.23 115.31 113.28 1unl h LEU 212 Ca 0.03 -0.03 -0.04 0.00 0.09 0.00 0.00 57.88 57.94 1unl h LEU 212 Cb 0.27 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 1unl h LEU 212 CO 0.00 0.63 0.11 0.11 0.09 0.00 0.00 178.44 179.38 1unl h LYS 213 N 1.01 0.65 -0.68 1.13 1.57 -1.19 -0.67 116.57 118.39 1unl h LYS 213 Ca 0.27 -0.15 -0.02 0.00 -1.87 0.00 0.00 60.65 58.88 1unl h LYS 213 Cb -0.11 -0.09 -0.03 0.00 0.08 0.00 0.00 32.23 32.08 1unl h LYS 213 CO -0.06 0.66 0.35 0.00 -0.57 0.00 0.00 179.45 179.83 1unl h ARG 214 N 0.52 0.95 -0.17 3.15 3.08 -0.84 0.52 114.38 121.58 1unl h ARG 214 Ca 0.13 -0.11 -0.06 0.00 0.07 0.00 0.00 59.98 60.01 1unl h ARG 214 Cb 0.29 -0.19 -0.00 0.00 0.08 0.00 0.00 29.97 30.16 1unl h ARG 214 CO -0.00 0.71 -0.12 0.82 -1.07 0.00 0.00 179.97 180.30 1unl h ILE 215 N 0.95 1.33 -0.04 2.04 2.04 -0.93 -3.20 117.51 119.70 1unl h ILE 215 Ca 0.24 -1.23 -0.13 0.00 1.00 0.00 0.00 64.86 64.73 1unl h ILE 215 Cb 0.06 1.76 -0.01 0.00 -0.74 0.00 0.00 36.82 37.88 1unl h ILE 215 CO -0.04 0.37 -0.59 -0.26 0.00 0.00 0.00 178.15 177.63 1unl h PHE 216 N 0.05 0.15 -0.44 1.37 0.04 -0.84 -1.41 116.94 115.87 1unl h PHE 216 Ca 0.03 -0.06 -0.01 0.00 2.80 0.00 0.00 57.97 60.73 1unl h PHE 216 Cb 0.63 -0.03 -0.02 0.00 2.20 0.00 0.00 35.95 38.74 1unl h PHE 216 CO 0.07 0.68 0.22 -0.09 -0.60 0.00 0.00 178.31 178.59 1unl h ARG 217 N 0.09 0.60 0.12 1.51 2.43 -0.92 0.18 114.38 118.39 1unl h ARG 217 Ca -0.01 -0.06 -0.37 0.00 -0.81 0.00 0.00 59.98 58.74 1unl h ARG 217 Cb 1.07 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 30.48 1unl h ARG 217 CO 0.08 0.47 -2.00 -0.11 -1.51 0.00 0.00 179.97 176.90 1unl n LEU 218 N -4.40 2.64 0.00 3.80 7.94 -1.11 -4.49 117.00 121.37 1unl n LEU 218 Ca 0.03 0.21 0.11 0.00 -1.11 0.00 0.00 56.01 55.25 1unl n LEU 218 Cb 0.11 -1.11 0.09 0.00 0.53 0.00 0.00 43.42 43.04 1unl n LEU 218 CO 0.37 0.86 0.22 0.18 -1.11 0.00 0.00 177.39 177.90 1unl n LEU 219 N -3.48 0.70 0.00 -1.96 4.32 -0.55 -4.35 117.00 111.68 1unl n LEU 219 Ca -0.32 -0.19 0.00 0.00 -0.02 0.00 0.00 56.01 55.48 1unl n LEU 219 Cb 1.05 -0.14 0.00 0.00 -1.62 0.00 0.00 43.42 42.71 1unl n LEU 219 CO 0.43 0.16 0.00 0.61 -1.22 0.00 0.00 177.39 177.37 1unl n GLY 220 N 1.49 -2.01 3.66 -0.72 0.00 0.61 -4.49 105.19 103.73 1unl n GLY 220 Ca 0.05 -1.32 -0.43 0.00 0.00 0.00 0.00 46.02 44.31 1unl n GLY 220 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1unl s THR 221 N -2.98 4.33 0.41 2.61 2.01 -0.99 -4.63 115.64 116.40 1unl s THR 221 Ca 0.00 1.61 -0.25 0.00 0.31 0.00 0.00 61.69 63.36 1unl s THR 221 Cb 0.00 -4.04 -0.08 0.00 0.01 0.00 0.00 72.50 68.39 1unl s THR 221 CO 0.00 -0.13 1.26 -2.16 -0.69 0.00 0.00 174.62 172.91 1unl s PRO 222 N 3.33 3.95 0.61 4.92 0.04 -1.26 -4.83 135.00 141.75 1unl s PRO 222 Ca 0.53 2.06 0.06 0.00 0.04 0.00 0.00 61.00 63.69 1unl s PRO 222 Cb -0.21 -2.70 0.11 0.00 0.04 0.00 0.00 34.50 31.74 1unl s PRO 222 CO 0.14 -0.48 0.84 0.25 0.04 0.00 0.00 177.00 177.79 1unl n THR 223 N 0.05 0.00 0.63 1.26 -2.24 -1.26 -4.95 114.28 107.77 1unl n THR 223 Ca 0.04 -1.72 0.13 0.00 -2.27 0.00 0.00 64.05 60.23 1unl n THR 223 Cb 0.45 -0.68 0.45 0.00 -2.10 0.00 0.00 70.33 68.44 1unl n THR 223 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 1unl n GLU 224 N -2.42 0.21 -0.06 -0.78 0.28 -1.26 -1.10 120.64 115.51 1unl n GLU 224 Ca 0.16 0.23 -0.13 0.00 -0.16 0.00 0.00 57.16 57.25 1unl n GLU 224 Cb 0.57 -1.77 -0.07 0.00 1.43 0.00 0.00 31.44 31.60 1unl n GLU 224 CO 0.00 0.00 0.00 0.93 -0.16 0.00 0.00 177.13 177.90 1unl h GLU 225 N 0.00 0.44 -0.00 3.44 4.39 -1.96 -2.59 114.58 118.29 1unl h GLU 225 Ca 0.00 -0.25 -0.21 0.00 0.34 0.00 0.00 59.36 59.24 1unl h GLU 225 Cb 0.62 0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 29.28 1unl h GLU 225 CO 0.00 0.83 -0.90 1.96 -1.16 0.00 0.00 179.01 179.74 1unl h GLN 226 N 0.08 0.34 -2.05 2.33 4.20 -1.94 -3.42 115.11 114.64 1unl h GLN 226 Ca 0.02 -0.36 -0.55 0.00 0.06 0.00 0.00 58.65 57.83 1unl h GLN 226 Cb 0.78 0.10 -0.37 0.00 0.30 0.00 0.00 27.48 28.29 1unl h GLN 226 CO 0.05 1.04 -1.00 1.87 -0.67 0.00 0.00 178.83 180.12 1unl n TRP 227 N -3.72 -0.88 0.25 2.96 -0.00 -0.26 -4.82 117.44 110.96 1unl n TRP 227 Ca -0.05 -3.29 0.08 0.00 -0.00 0.00 0.00 57.50 54.24 1unl n TRP 227 Cb 0.81 0.08 0.64 0.00 -0.00 0.00 0.00 31.31 32.84 1unl n TRP 227 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 177.69 176.69 1unl h PRO 228 N 4.79 0.00 -0.00 5.87 0.13 -1.69 -2.46 132.00 138.64 1unl h PRO 228 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 1unl h PRO 228 Cb 0.91 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.04 1unl h PRO 228 CO 0.40 0.07 -0.11 -1.13 -0.23 0.00 0.00 178.00 177.00 1unl n SER 229 N -4.30 0.51 -0.24 1.44 3.41 -1.26 -4.01 113.62 109.17 1unl n SER 229 Ca -0.03 -0.60 0.04 0.00 -0.26 0.00 0.00 58.87 58.03 1unl n SER 229 Cb 0.15 -0.06 0.16 0.00 -0.26 0.00 0.00 64.21 64.21 1unl n SER 229 CO 0.00 0.00 0.00 -0.03 -0.16 0.00 0.00 175.04 174.85 1unl h MET 230 N 0.61 0.27 0.00 4.33 -1.53 -1.83 -1.04 114.93 115.74 1unl h MET 230 Ca 0.00 -0.02 0.00 0.00 -3.44 0.00 0.00 59.70 56.24 1unl h MET 230 Cb 0.36 -0.06 0.00 0.00 -0.55 0.00 0.00 31.60 31.35 1unl h MET 230 CO 0.00 0.18 0.00 0.25 0.14 0.00 0.00 176.91 177.48 1unl n THR 231 N -5.14 0.91 1.19 -0.77 -2.24 -1.26 -2.45 114.28 104.53 1unl n THR 231 Ca 0.13 0.23 0.12 0.00 -2.27 0.00 0.00 64.05 62.27 1unl n THR 231 Cb 0.42 -1.06 0.26 0.00 -2.10 0.00 0.00 70.33 67.85 1unl n THR 231 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1unl n LYS 232 N -1.84 1.27 -2.32 -0.78 4.01 -0.40 -4.93 118.16 113.17 1unl n LYS 232 Ca 0.03 -0.90 -0.39 0.00 -0.51 0.00 0.00 58.31 56.54 1unl n LYS 232 Cb 0.20 -1.48 -0.03 0.00 -0.51 0.00 0.00 35.03 33.21 1unl n LYS 232 CO 0.00 0.00 0.00 -0.51 -1.11 0.00 0.00 177.40 175.78 1unl s LEU 233 N -2.34 4.34 0.36 -0.35 1.43 -1.02 -4.94 118.68 116.16 1unl s LEU 233 Ca 0.26 2.38 0.11 0.00 -1.03 0.00 0.00 54.13 55.84 1unl s LEU 233 Cb 0.19 -3.84 0.89 0.00 0.03 0.00 0.00 46.19 43.46 1unl s LEU 233 CO 0.48 -0.48 1.83 -0.65 0.23 0.00 0.00 176.35 177.76 1unl h PRO 234 N 3.12 0.60 -0.27 1.29 0.11 -1.77 -2.49 132.00 132.59 1unl h PRO 234 Ca -0.48 -0.04 -0.15 0.00 0.11 0.00 0.00 66.00 65.44 1unl h PRO 234 Cb 1.22 -0.13 -0.09 0.00 0.11 0.00 0.00 31.00 32.11 1unl h PRO 234 CO 0.64 0.39 -0.23 -0.25 -0.21 0.00 0.00 178.00 178.35 1unl n ASP 235 N -4.60 2.38 -4.73 -2.05 8.00 -0.43 -5.02 116.55 110.08 1unl n ASP 235 Ca 0.20 -3.83 -0.41 0.00 0.71 0.00 0.00 54.79 51.45 1unl n ASP 235 Cb 0.59 -0.60 -0.03 0.00 -0.02 0.00 0.00 41.12 41.06 1unl n ASP 235 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1unl s TYR 236 N -3.28 3.28 0.02 1.24 5.04 -0.94 -4.76 117.35 117.95 1unl s TYR 236 Ca 0.43 1.22 -0.02 0.00 -2.44 0.00 0.00 57.07 56.26 1unl s TYR 236 Cb 0.40 -3.59 -0.01 0.00 0.35 0.00 0.00 41.96 39.11 1unl s TYR 236 CO -0.02 -1.84 0.02 -1.59 -1.34 0.00 0.00 175.55 170.78 1unl s LYS 237 N 0.03 0.37 0.34 4.97 -2.85 -1.26 -5.03 119.74 116.31 1unl s LYS 237 Ca 0.57 -0.55 -0.29 0.00 -1.00 0.00 0.00 55.97 54.70 1unl s LYS 237 Cb -0.36 0.14 -0.11 0.00 -2.06 0.00 0.00 37.83 35.44 1unl s LYS 237 CO 0.37 -0.07 1.54 -2.14 0.10 0.00 0.00 175.35 175.15 1unl s PRO 238 N -1.47 4.11 0.20 1.78 0.02 -1.26 -5.03 135.00 133.34 1unl s PRO 238 Ca -0.15 2.59 0.08 0.00 0.02 0.00 0.00 61.00 63.54 1unl s PRO 238 Cb -0.09 -2.99 -0.04 0.00 0.02 0.00 0.00 34.50 31.40 1unl s PRO 238 CO -0.00 -0.59 -0.04 0.71 -0.33 0.00 0.00 177.00 176.75 1unl s TYR 239 N -0.65 2.72 0.59 6.54 1.51 -1.26 -5.11 117.35 121.69 1unl s TYR 239 Ca 0.57 -0.19 -0.18 0.00 -1.01 0.00 0.00 57.07 56.26 1unl s TYR 239 Cb -0.47 -1.30 -0.05 0.00 -0.11 0.00 0.00 41.96 40.03 1unl s TYR 239 CO 0.57 0.54 0.90 -2.30 -1.11 0.00 0.00 175.55 174.15 1unl n PRO 240 N -0.22 0.84 -2.91 -1.71 -0.02 -1.26 -4.92 135.00 124.80 1unl n PRO 240 Ca -0.09 0.33 -0.43 0.00 -2.02 0.00 0.00 63.50 61.28 1unl n PRO 240 Cb 0.56 -2.09 -0.04 0.00 -0.02 0.00 0.00 33.50 31.91 1unl n PRO 240 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 1unl s MET 241 N -2.64 3.10 0.07 -0.52 -1.94 -1.26 -4.75 119.30 111.36 1unl s MET 241 Ca 0.74 -0.93 -0.17 0.00 -1.71 0.00 0.00 55.69 53.62 1unl s MET 241 Cb -0.42 -4.24 -0.06 0.00 2.01 0.00 0.00 34.83 32.12 1unl s MET 241 CO 0.48 -1.76 0.53 0.71 -0.01 0.00 0.00 175.02 174.97 1unl s TYR 242 N 3.79 3.75 0.46 -0.03 1.51 -1.26 -4.95 117.35 120.63 1unl s TYR 242 Ca 0.20 1.17 -0.23 0.00 -1.01 0.00 0.00 57.07 57.20 1unl s TYR 242 Cb -0.18 -2.42 -0.07 0.00 -0.11 0.00 0.00 41.96 39.17 1unl s TYR 242 CO 0.09 0.57 1.20 -1.25 -1.11 0.00 0.00 175.55 175.06 1unl s PRO 243 N -1.26 3.70 -0.64 -1.71 0.04 -1.26 -2.35 135.00 131.53 1unl s PRO 243 Ca 0.29 1.86 0.01 0.00 0.04 0.00 0.00 61.00 63.20 1unl s PRO 243 Cb -0.18 -2.42 0.40 0.00 0.04 0.00 0.00 34.50 32.34 1unl s PRO 243 CO 0.18 -0.62 1.70 0.00 0.04 0.00 0.00 177.00 178.29 1unl n ALA 244 N -0.49 5.94 0.19 8.56 0.00 -1.26 -3.91 120.51 129.53 1unl n ALA 244 Ca 0.07 -3.99 0.02 0.00 0.00 0.00 0.00 53.44 49.54 1unl n ALA 244 Cb 0.47 -1.38 0.01 0.00 0.00 0.00 0.00 19.45 18.55 1unl n ALA 244 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1unl n THR 245 N -0.63 0.00 -1.65 0.00 -1.04 -1.26 -4.78 114.28 104.91 1unl n THR 245 Ca 0.51 -0.47 -0.38 0.00 -2.04 0.00 0.00 64.05 61.66 1unl n THR 245 Cb 0.52 1.07 -0.03 0.00 -1.82 0.00 0.00 70.33 70.07 1unl n THR 245 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1unl s THR 246 N -0.67 3.08 0.28 12.58 2.01 -1.26 -4.86 115.64 126.79 1unl s THR 246 Ca 0.04 0.06 -0.29 0.00 0.31 0.00 0.00 61.69 61.81 1unl s THR 246 Cb 0.04 -3.16 -0.10 0.00 0.01 0.00 0.00 72.50 69.28 1unl s THR 246 CO 0.09 -0.14 1.37 -0.94 -0.69 0.00 0.00 174.62 174.31 1unl s SER 247 N 10.41 6.72 0.00 3.53 1.04 -1.26 -4.87 113.70 129.26 1unl s SER 247 Ca 0.94 2.66 0.04 0.00 0.48 0.00 0.00 55.95 60.07 1unl s SER 247 Cb -0.21 -2.63 0.16 0.00 0.10 0.00 0.00 66.02 63.43 1unl s SER 247 CO 0.28 -0.62 1.12 0.18 0.98 0.00 0.00 173.24 175.18 1unl n LEU 248 N 1.64 0.00 -0.12 2.42 4.77 -1.26 -3.36 117.00 121.10 1unl n LEU 248 Ca 0.04 0.50 -0.05 0.00 -0.03 0.00 0.00 56.01 56.47 1unl n LEU 248 Cb 0.41 -0.50 0.01 0.00 -2.33 0.00 0.00 43.42 41.01 1unl n LEU 248 CO 0.60 -0.44 0.79 0.58 -1.33 0.00 0.00 177.39 177.59 1unl h VAL 249 N 0.00 0.61 0.00 4.08 2.07 -1.89 -0.68 116.25 120.44 1unl h VAL 249 Ca 0.00 -0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1unl h VAL 249 Cb 0.06 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 30.44 1unl h VAL 249 CO 0.00 0.00 -0.05 0.78 0.02 0.00 0.00 177.57 178.32 1unl h ASN 250 N 0.00 0.00 0.92 0.57 2.35 -1.96 -2.91 115.58 114.55 1unl h ASN 250 Ca 0.19 -0.01 -0.22 0.00 -0.55 0.00 0.00 56.30 55.71 1unl h ASN 250 Cb 0.29 0.00 -0.03 0.00 0.05 0.00 0.00 38.32 38.62 1unl h ASN 250 CO -0.40 0.00 -1.11 0.58 -1.65 0.00 0.00 177.43 174.86 1unl h VAL 251 N 0.00 1.58 -2.35 2.81 2.07 -1.58 -3.39 116.25 115.39 1unl h VAL 251 Ca 0.00 -3.31 -0.59 0.00 0.82 0.00 0.00 66.70 63.63 1unl h VAL 251 Cb 0.83 2.78 -0.39 0.00 -1.52 0.00 0.00 31.29 32.99 1unl h VAL 251 CO 0.00 0.90 -0.94 1.33 0.02 0.00 0.00 177.57 178.88 1unl n VAL 252 N -3.30 -0.47 0.30 2.57 0.24 -0.33 -4.61 118.33 112.73 1unl n VAL 252 Ca -0.03 -3.89 0.20 0.00 -2.04 0.00 0.00 64.34 58.58 1unl n VAL 252 Cb 0.96 -1.83 0.90 0.00 -1.47 0.00 0.00 33.84 32.40 1unl n VAL 252 CO 0.00 0.00 0.00 1.55 -2.14 0.00 0.00 176.83 176.24 1unl h PRO 253 N 5.07 0.00 -0.00 7.34 0.13 -1.51 -2.52 132.00 140.51 1unl h PRO 253 Ca 0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.33 1unl h PRO 253 Cb 0.86 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.99 1unl h PRO 253 CO 0.47 0.00 -0.12 1.63 -0.23 0.00 0.00 178.00 179.75 1unl n LYS 254 N -3.07 0.16 -3.89 0.86 4.76 -1.09 -4.82 118.16 111.06 1unl n LYS 254 Ca -0.01 -0.04 -0.36 0.00 -2.87 0.00 0.00 58.31 55.04 1unl n LYS 254 Cb 0.21 -1.50 -0.08 0.00 -1.84 0.00 0.00 35.03 31.82 1unl n LYS 254 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1unl s LEU 255 N -2.86 4.13 0.00 -0.35 1.02 -0.95 -4.92 118.68 114.75 1unl s LEU 255 Ca 0.18 0.27 -0.11 0.00 0.02 0.00 0.00 54.13 54.49 1unl s LEU 255 Cb 0.19 -2.03 0.15 0.00 0.02 0.00 0.00 46.19 44.51 1unl s LEU 255 CO 0.55 0.27 0.86 -0.46 0.02 0.00 0.00 176.35 177.59 1unl n ASN 256 N 2.90 0.06 -0.08 2.29 6.94 -1.26 -4.77 115.26 121.33 1unl n ASN 256 Ca -0.18 -1.31 0.05 0.00 -0.02 0.00 0.00 54.58 53.13 1unl n ASN 256 Cb 0.53 -0.66 0.40 0.00 -2.36 0.00 0.00 39.78 37.69 1unl n ASN 256 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1unl h ALA 257 N -1.87 1.72 -0.35 -2.53 0.00 -1.99 -1.56 119.26 112.69 1unl h ALA 257 Ca -0.28 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 54.49 1unl h ALA 257 Cb 0.77 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1unl h ALA 257 CO 0.20 0.22 -0.22 1.15 0.00 0.00 0.00 179.25 180.59 1unl h THR 258 N 0.63 1.29 -0.45 0.00 2.02 -1.98 -2.26 112.91 112.16 1unl h THR 258 Ca 0.22 -1.36 -0.01 0.00 0.77 0.00 0.00 66.41 66.03 1unl h THR 258 Cb 0.09 1.40 -0.02 0.00 -1.74 0.00 0.00 68.15 67.88 1unl h THR 258 CO -0.06 0.45 0.23 1.23 0.37 0.00 0.00 175.52 177.74 1unl h GLY 259 N 0.55 0.67 1.66 2.16 0.00 -1.70 -2.61 103.07 103.81 1unl h GLY 259 Ca 0.07 -0.32 -0.06 0.00 0.00 0.00 0.00 47.33 47.02 1unl h GLY 259 CO 0.06 0.30 -0.12 3.21 0.00 0.00 0.00 176.54 180.00 1unl h ARG 260 N 0.58 0.42 -0.40 4.80 3.08 -1.27 -1.79 114.38 119.80 1unl h ARG 260 Ca 0.16 -0.11 -0.04 0.00 0.07 0.00 0.00 59.98 60.06 1unl h ARG 260 Cb 0.08 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.06 1unl h ARG 260 CO -0.02 0.54 0.11 0.22 -1.07 0.00 0.00 179.97 179.74 1unl h ASP 261 N 0.39 0.60 -0.98 7.04 1.82 -1.16 -0.61 116.42 123.52 1unl h ASP 261 Ca 0.08 -0.22 0.03 0.00 -0.39 0.00 0.00 57.03 56.52 1unl h ASP 261 Cb 0.44 -0.16 -0.06 0.00 0.68 0.00 0.00 39.33 40.24 1unl h ASP 261 CO 0.03 0.66 0.64 0.25 -1.61 0.00 0.00 179.24 179.21 1unl h LEU 262 N 0.50 1.08 -0.58 2.28 5.85 -1.04 -2.15 115.31 121.24 1unl h LEU 262 Ca 0.13 -0.01 -0.13 0.00 0.84 0.00 0.00 57.88 58.70 1unl h LEU 262 Cb 0.29 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.06 1unl h LEU 262 CO -0.00 0.74 -0.31 0.25 -0.34 0.00 0.00 178.44 178.78 1unl h LEU 263 N 1.25 0.83 -1.32 2.25 5.85 -0.96 -2.15 115.31 121.06 1unl h LEU 263 Ca 0.38 -0.34 0.00 0.00 0.84 0.00 0.00 57.88 58.77 1unl h LEU 263 Cb -0.02 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 40.74 1unl h LEU 263 CO -0.12 1.07 0.44 1.56 -0.34 0.00 0.00 178.44 181.05 1unl h GLN 264 N 0.67 0.89 0.00 1.25 4.20 -0.93 -1.07 115.11 120.11 1unl h GLN 264 Ca 0.07 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.73 1unl h GLN 264 Cb 0.85 -0.20 0.00 0.00 0.30 0.00 0.00 27.48 28.43 1unl h GLN 264 CO 0.07 0.60 0.00 -0.91 -0.67 0.00 0.00 178.83 177.92 1unl h ASN 265 N 0.91 0.00 0.17 1.46 2.35 -0.92 -3.25 115.58 116.30 1unl h ASN 265 Ca 0.25 0.00 -0.35 0.00 -0.55 0.00 0.00 56.30 55.64 1unl h ASN 265 Cb -0.09 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.29 1unl h ASN 265 CO -0.05 0.00 -1.79 -0.07 -1.65 0.00 0.00 177.43 173.86 1unl h LEU 266 N 0.00 0.58 -5.93 1.61 3.38 -1.04 0.11 115.31 114.01 1unl h LEU 266 Ca 0.00 -0.94 -0.77 0.00 0.09 0.00 0.00 57.88 56.26 1unl h LEU 266 Cb 0.87 -0.19 -0.18 0.00 0.09 0.00 0.00 40.66 41.25 1unl h LEU 266 CO 0.00 1.80 1.84 0.18 0.09 0.00 0.00 178.44 182.35 1unl n LEU 267 N -3.58 7.71 -4.67 1.67 4.77 -0.44 -4.19 117.00 118.27 1unl n LEU 267 Ca -0.26 -5.08 -0.35 0.00 -0.03 0.00 0.00 56.01 50.29 1unl n LEU 267 Cb 1.07 -1.29 -0.09 0.00 -2.33 0.00 0.00 43.42 40.77 1unl n LEU 267 CO 0.50 2.02 -0.22 -0.54 -1.33 0.00 0.00 177.39 177.82 1unl s LYS 268 N -2.36 4.06 0.18 3.23 -0.14 -1.26 -4.91 119.74 118.55 1unl s LYS 268 Ca 0.47 -0.29 -0.13 0.00 -1.36 0.00 0.00 55.97 54.66 1unl s LYS 268 Cb 0.18 -3.34 0.09 0.00 -1.68 0.00 0.00 37.83 33.08 1unl s LYS 268 CO -0.10 0.24 1.84 0.00 -0.76 0.00 0.00 175.35 176.57 1unl s ASN 270 N -5.68 6.13 0.38 0.00 3.04 -1.26 -4.47 114.94 113.09 1unl s ASN 270 Ca -0.13 1.24 0.12 0.00 0.04 0.00 0.00 52.86 54.13 1unl s ASN 270 Cb 0.13 -2.53 0.92 0.00 -1.54 0.00 0.00 41.25 38.23 1unl s ASN 270 CO 0.75 -1.52 1.86 1.55 -3.04 0.00 0.00 177.10 176.70 1unl h PRO 271 N 11.75 0.56 -0.60 0.43 0.13 -1.96 -0.71 132.00 141.60 1unl h PRO 271 Ca -0.32 -0.03 0.05 0.00 -0.87 0.00 0.00 66.00 64.83 1unl h PRO 271 Cb 1.15 -0.13 -0.03 0.00 0.13 0.00 0.00 31.00 32.12 1unl h PRO 271 CO 1.04 0.37 0.40 0.28 -0.23 0.00 0.00 178.00 179.85 1unl h VAL 272 N 0.58 1.03 -0.00 1.56 2.07 -1.93 -2.36 116.25 117.20 1unl h VAL 272 Ca 0.46 -0.22 0.00 0.00 0.82 0.00 0.00 66.70 67.76 1unl h VAL 272 Cb 0.89 0.34 0.00 0.00 -1.52 0.00 0.00 31.29 31.00 1unl h VAL 272 CO -0.20 0.12 -0.05 0.00 0.02 0.00 0.00 177.57 177.45 1unl n GLN 273 N -4.47 0.57 -2.67 1.57 6.02 -0.28 -4.87 117.38 113.25 1unl n GLN 273 Ca 0.08 -0.10 -0.42 0.00 -0.01 0.00 0.00 57.00 56.55 1unl n GLN 273 Cb 0.19 -1.50 -0.03 0.00 1.02 0.00 0.00 30.24 29.93 1unl n GLN 273 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 1unl s ARG 274 N -2.50 4.48 0.37 -1.09 0.52 -0.89 -4.86 118.95 114.98 1unl s ARG 274 Ca 0.30 1.44 -0.27 0.00 -0.52 0.00 0.00 55.73 56.68 1unl s ARG 274 Cb 0.20 -3.49 -0.12 0.00 0.52 0.00 0.00 34.95 32.06 1unl s ARG 274 CO 0.46 -0.19 1.19 1.51 0.02 0.00 0.00 175.30 178.29 1unl n ILE 275 N 4.21 2.21 -2.00 1.52 3.06 0.02 -4.99 119.36 123.39 1unl n ILE 275 Ca 0.08 -0.50 -0.30 0.00 -2.50 0.00 0.00 62.75 59.52 1unl n ILE 275 Cb 0.50 -1.41 0.01 0.00 0.54 0.00 0.00 39.64 39.28 1unl n ILE 275 CO 0.00 0.00 0.00 -0.94 -2.50 0.00 0.00 176.55 173.11 1unl s SER 276 N -0.48 6.23 0.17 9.51 1.04 -1.26 -4.88 113.70 124.03 1unl s SER 276 Ca 0.59 1.34 -0.14 0.00 0.48 0.00 0.00 55.95 58.21 1unl s SER 276 Cb -0.57 -2.43 0.07 0.00 0.10 0.00 0.00 66.02 63.19 1unl s SER 276 CO 0.60 -0.82 1.84 0.00 0.98 0.00 0.00 173.24 175.83 1unl h ALA 277 N -0.23 0.67 -0.62 5.32 0.00 -1.94 0.47 119.26 122.92 1unl h ALA 277 Ca -0.44 -0.03 0.07 0.00 0.00 0.00 0.00 54.91 54.51 1unl h ALA 277 Cb 1.19 -0.21 -0.06 0.00 0.00 0.00 0.00 17.79 18.72 1unl h ALA 277 CO 0.62 0.10 0.30 1.49 0.00 0.00 0.00 179.25 181.76 1unl h GLU 278 N 0.70 0.52 -0.00 0.00 4.81 -1.91 -2.08 114.58 116.62 1unl h GLU 278 Ca 0.20 -0.03 -0.20 0.00 -0.13 0.00 0.00 59.36 59.20 1unl h GLU 278 Cb -0.07 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 29.18 1unl h GLU 278 CO -0.05 0.34 -0.87 0.93 -0.73 0.00 0.00 179.01 178.64 1unl h GLU 279 N 0.54 0.22 -0.73 1.92 5.08 -1.88 -3.26 114.58 116.47 1unl h GLU 279 Ca 0.30 -0.23 -0.05 0.00 -1.00 0.00 0.00 59.36 58.38 1unl h GLU 279 Cb 0.28 0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.56 1unl h GLU 279 CO -0.24 0.96 0.27 0.00 -1.00 0.00 0.00 179.01 178.99 1unl h ALA 280 N 0.96 1.10 0.00 3.43 0.00 -0.66 -2.53 119.26 121.56 1unl h ALA 280 Ca -0.04 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.66 1unl h ALA 280 Cb 1.49 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.99 1unl h ALA 280 CO 0.13 0.63 -0.05 -0.07 0.00 0.00 0.00 179.25 179.89 1unl h LEU 281 N 1.06 0.00 -0.88 0.00 3.38 -1.44 -1.83 115.31 115.61 1unl h LEU 281 Ca 0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.21 1unl h LEU 281 Cb 0.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1unl h LEU 281 CO -0.02 0.05 0.00 0.00 0.09 0.00 0.00 178.44 178.57 1unl n GLN 282 N -4.36 1.59 -2.20 1.13 6.02 -0.98 -4.77 117.38 113.81 1unl n GLN 282 Ca -0.03 -0.87 -0.38 0.00 -0.01 0.00 0.00 57.00 55.70 1unl n GLN 282 Cb 0.13 -1.44 -0.01 0.00 1.02 0.00 0.00 30.24 29.94 1unl n GLN 282 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 1unl s HIS 283 N -1.93 2.92 -0.87 1.08 2.46 -0.69 -4.90 115.29 113.36 1unl s HIS 283 Ca 0.36 1.51 0.01 0.00 0.47 0.00 0.00 55.06 57.41 1unl s HIS 283 Cb 0.19 -3.48 0.03 0.00 -0.13 0.00 0.00 32.58 29.20 1unl s HIS 283 CO 0.31 -1.63 0.97 -0.35 -2.47 0.00 0.00 174.74 171.56 1unl n PRO 284 N -0.11 0.00 -0.08 2.88 -0.04 -1.26 -1.09 135.00 135.31 1unl n PRO 284 Ca 0.05 0.45 0.02 0.00 -0.04 0.00 0.00 63.50 63.99 1unl n PRO 284 Cb 0.46 -1.57 0.35 0.00 -0.04 0.00 0.00 33.50 32.70 1unl n PRO 284 CO 0.00 0.00 0.00 -0.92 -0.04 0.00 0.00 175.50 174.54 1unl h TYR 285 N 0.00 0.68 -0.03 0.54 3.20 -1.90 -2.87 116.97 116.58 1unl h TYR 285 Ca 0.00 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.88 1unl h TYR 285 Cb 0.11 -0.23 0.00 0.00 1.54 0.00 0.00 36.73 38.15 1unl h TYR 285 CO 0.00 0.44 0.00 1.19 -1.64 0.00 0.00 178.16 178.15 1unl n PHE 286 N -4.44 0.01 -0.63 -3.82 3.72 -0.25 -4.78 117.46 107.28 1unl n PHE 286 Ca 0.05 -0.01 0.50 0.00 -0.05 0.00 0.00 57.45 57.94 1unl n PHE 286 Cb 0.07 0.00 0.80 0.00 -0.94 0.00 0.00 39.48 39.40 1unl n PHE 286 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 1unl h SER 287 N 3.59 0.00 -3.41 4.37 4.64 -1.54 -3.21 113.55 117.99 1unl h SER 287 Ca 0.00 0.00 -0.43 0.00 -0.47 0.00 0.00 61.79 60.89 1unl h SER 287 Cb 0.76 0.00 -0.35 0.00 -0.31 0.00 0.00 62.40 62.51 1unl h SER 287 CO 0.00 0.00 -0.78 1.51 -0.87 0.00 0.00 176.83 176.69 1unl s ASP 288 N -4.03 1.23 0.00 4.97 3.84 -1.26 -5.10 116.67 116.32 1unl s ASP 288 Ca -0.05 -0.16 0.00 0.00 -0.00 0.00 0.00 52.55 52.34 1unl s ASP 288 Cb 0.26 -0.53 0.00 0.00 -1.38 0.00 0.00 42.92 41.27 1unl s ASP 288 CO 0.86 -0.07 0.00 0.33 -0.00 0.00 0.00 175.17 176.30 1unl n PHE 289 N 4.23 -0.62 -0.05 2.11 7.35 -1.22 -5.12 117.46 124.14 1unl n PHE 289 Ca -0.21 0.00 -0.10 0.00 -0.76 0.00 0.00 57.45 56.38 1unl n PHE 289 Cb 0.51 0.00 -0.03 0.00 0.35 0.00 0.00 39.48 40.30 1unl n PHE 289 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1unl h PRO 291 N -0.59 0.00 -0.00 0.00 0.11 -2.01 -3.56 132.00 125.94 1unl h PRO 291 Ca -0.16 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.95 1unl h PRO 291 Cb 0.90 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.01 1unl h PRO 291 CO -0.10 0.00 0.00 -0.35 -0.21 0.00 0.00 178.00 177.34