#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sfl s VAL 4 N 0.00 4.23 -0.12 3.57 1.01 -1.26 -4.89 120.40 122.94 1sfl s VAL 4 Ca 0.00 1.84 -0.05 0.00 0.00 0.00 0.00 61.98 63.77 1sfl s VAL 4 Cb 0.00 -4.15 -0.04 0.00 0.00 0.00 0.00 36.38 32.19 1sfl s VAL 4 CO 0.00 0.38 0.08 -1.61 0.00 0.00 0.00 175.10 173.95 1sfl s GLU 5 N -1.49 3.34 -0.16 2.72 2.02 -0.38 -4.99 118.70 119.76 1sfl s GLU 5 Ca 0.42 -0.26 -0.18 0.00 0.02 0.00 0.00 54.97 54.98 1sfl s GLU 5 Cb -0.22 -3.05 -0.04 0.00 0.10 0.00 0.00 34.13 30.92 1sfl s GLU 5 CO 0.27 0.69 0.46 0.08 0.02 0.00 0.00 175.26 176.78 1sfl s VAL 6 N -0.80 5.17 -0.19 2.63 1.01 -1.26 -2.14 120.40 124.83 1sfl s VAL 6 Ca 0.13 0.88 -0.06 0.00 0.00 0.00 0.00 61.98 62.93 1sfl s VAL 6 Cb -0.12 -3.80 -0.03 0.00 0.00 0.00 0.00 36.38 32.43 1sfl s VAL 6 CO 0.03 0.27 0.03 -0.69 0.00 0.00 0.00 175.10 174.74 1sfl s VAL 7 N 1.04 4.44 -0.27 2.92 1.01 -0.11 -0.79 120.40 128.65 1sfl s VAL 7 Ca 0.23 -0.15 -0.10 0.00 0.00 0.00 0.00 61.98 61.97 1sfl s VAL 7 Cb -0.15 -3.00 -0.04 0.00 0.00 0.00 0.00 36.38 33.19 1sfl s VAL 7 CO 0.09 0.45 0.14 0.00 0.00 0.00 0.00 175.10 175.78 1sfl s ALA 8 N 0.57 3.39 -0.22 5.51 0.00 0.41 0.36 121.76 131.79 1sfl s ALA 8 Ca 0.01 -1.09 -0.14 0.00 0.00 0.00 0.00 51.96 50.74 1sfl s ALA 8 Cb -0.13 -2.32 -0.04 0.00 0.00 0.00 0.00 23.12 20.63 1sfl s ALA 8 CO 0.02 -0.51 0.30 0.99 0.00 0.00 0.00 175.76 176.56 1sfl s THR 9 N 1.67 5.27 0.13 0.00 2.01 0.05 0.56 115.64 125.32 1sfl s THR 9 Ca 0.07 0.50 0.09 0.00 0.31 0.00 0.00 61.69 62.65 1sfl s THR 9 Cb -0.16 -3.64 -0.04 0.00 0.01 0.00 0.00 72.50 68.68 1sfl s THR 9 CO 0.08 0.29 -0.22 0.27 -0.69 0.00 0.00 174.62 174.35 1sfl s ILE 10 N 1.19 1.92 -0.38 1.82 -4.36 -0.37 -4.35 121.20 116.67 1sfl s ILE 10 Ca 0.14 -1.72 0.11 0.00 -0.26 0.00 0.00 60.65 58.93 1sfl s ILE 10 Cb -0.14 -1.77 0.34 0.00 1.25 0.00 0.00 42.46 42.14 1sfl s ILE 10 CO 0.06 -0.08 0.76 0.41 0.24 0.00 0.00 174.94 176.33 1sfl n THR 11 N 0.81 -0.17 -1.03 8.37 -1.04 -1.26 -1.37 114.28 118.59 1sfl n THR 11 Ca -0.17 -4.27 -0.28 0.00 -2.04 0.00 0.00 64.05 57.29 1sfl n THR 11 Cb 0.54 -0.13 0.23 0.00 -1.82 0.00 0.00 70.33 69.16 1sfl n THR 11 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1sfl n PRO 12 N 0.32 -2.99 -3.97 -2.82 -0.04 -1.26 -5.00 135.00 119.24 1sfl n PRO 12 Ca 0.23 -1.64 -0.22 0.00 -0.04 0.00 0.00 63.50 61.83 1sfl n PRO 12 Cb 0.66 -1.53 -0.05 0.00 -0.04 0.00 0.00 33.50 32.54 1sfl n PRO 12 CO 0.00 0.00 0.00 -0.65 -0.04 0.00 0.00 175.50 174.81 1sfl s GLN 13 N -5.33 2.54 0.14 0.54 -1.52 -1.26 -4.92 119.66 109.85 1sfl s GLN 13 Ca 0.67 -1.43 0.00 0.00 -1.95 0.00 0.00 55.36 52.65 1sfl s GLN 13 Cb -0.06 -2.32 0.33 0.00 -0.22 0.00 0.00 33.01 30.74 1sfl s GLN 13 CO 0.51 0.11 0.71 1.28 -0.25 0.00 0.00 175.29 177.65 1sfl n LEU 14 N -1.25 -0.07 -4.47 2.90 7.99 -1.26 -2.22 117.00 118.62 1sfl n LEU 14 Ca -0.03 0.77 -0.44 0.00 -0.01 0.00 0.00 56.01 56.31 1sfl n LEU 14 Cb 0.61 -0.27 -0.02 0.00 -0.11 0.00 0.00 43.42 43.62 1sfl n LEU 14 CO 0.43 -0.78 1.20 -0.44 -1.51 0.00 0.00 177.39 176.29 1sfl s SER 15 N -5.02 6.75 -0.33 -1.43 0.01 -1.26 -4.79 113.70 107.63 1sfl s SER 15 Ca -0.06 -2.28 -0.29 0.00 1.31 0.00 0.00 55.95 54.64 1sfl s SER 15 Cb 0.13 -2.42 -0.07 0.00 0.21 0.00 0.00 66.02 63.87 1sfl s SER 15 CO 0.35 -1.02 2.29 0.00 0.41 0.00 0.00 173.24 175.27 1sfl n ILE 16 N 5.43 0.20 -0.95 1.44 0.13 -0.94 -4.91 119.36 119.75 1sfl n ILE 16 Ca 0.30 -0.52 -0.36 0.00 -1.10 0.00 0.00 62.75 61.06 1sfl n ILE 16 Cb 0.47 -2.47 0.03 0.00 -0.84 0.00 0.00 39.64 36.83 1sfl n ILE 16 CO 0.00 0.00 0.00 -0.62 2.80 0.00 0.00 176.55 178.73 1sfl n GLU 17 N 8.76 0.00 -0.01 9.51 -0.58 -1.26 -4.89 120.64 132.17 1sfl n GLU 17 Ca 0.34 0.00 0.09 0.00 -0.42 0.00 0.00 57.16 57.17 1sfl n GLU 17 Cb 0.44 -0.95 -0.14 0.00 -0.57 0.00 0.00 31.44 30.22 1sfl n GLU 17 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 1sfl n GLU 18 N 2.39 0.64 -0.03 3.49 4.07 -1.26 -3.59 120.64 126.35 1sfl n GLU 18 Ca -0.02 -0.14 -0.15 0.00 -0.06 0.00 0.00 57.16 56.79 1sfl n GLU 18 Cb 0.68 -1.42 -0.09 0.00 -0.06 0.00 0.00 31.44 30.55 1sfl n GLU 18 CO 0.00 0.00 0.00 1.15 -0.06 0.00 0.00 177.13 178.22 1sfl h THR 19 N 0.00 1.41 0.19 6.31 2.02 -2.00 -3.14 112.91 117.70 1sfl h THR 19 Ca 0.00 -1.76 -0.01 0.00 0.77 0.00 0.00 66.41 65.41 1sfl h THR 19 Cb 0.77 2.31 0.00 0.00 -1.74 0.00 0.00 68.15 69.49 1sfl h THR 19 CO 0.00 0.51 -0.09 0.25 0.37 0.00 0.00 175.52 176.56 1sfl h LEU 20 N -0.10 -0.22 -2.18 2.58 5.85 -1.95 -2.03 115.31 117.27 1sfl h LEU 20 Ca -0.02 -0.19 0.05 0.00 0.84 0.00 0.00 57.88 58.56 1sfl h LEU 20 Cb 1.02 0.06 -0.01 0.00 0.37 0.00 0.00 40.66 42.10 1sfl h LEU 20 CO 0.08 0.07 0.27 -0.29 -0.34 0.00 0.00 178.44 178.23 1sfl h ILE 21 N -0.52 0.31 0.20 4.05 6.09 -1.67 0.39 117.51 126.36 1sfl h ILE 21 Ca -0.03 0.00 -0.32 0.00 -1.37 0.00 0.00 64.86 63.14 1sfl h ILE 21 Cb 0.39 0.77 0.02 0.00 0.47 0.00 0.00 36.82 38.47 1sfl h ILE 21 CO 0.04 0.00 -1.55 -0.61 -3.07 0.00 0.00 178.15 172.96 1sfl h GLN 22 N 0.00 0.42 -0.37 2.19 4.15 -1.46 -2.85 115.11 117.19 1sfl h GLN 22 Ca 0.09 -0.71 -0.02 0.00 0.77 0.00 0.00 58.65 58.78 1sfl h GLN 22 Cb 0.63 0.26 -0.02 0.00 0.21 0.00 0.00 27.48 28.57 1sfl h GLN 22 CO -0.00 1.34 0.13 0.87 -1.93 0.00 0.00 178.83 179.24 1sfl h LYS 23 N 0.02 0.52 0.28 1.69 1.57 -0.33 -1.94 116.57 118.37 1sfl h LYS 23 Ca -0.30 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.40 1sfl h LYS 23 Cb 2.04 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 34.26 1sfl h LYS 23 CO 0.19 0.45 -0.13 0.82 -0.57 0.00 0.00 179.45 180.20 1sfl h ILE 24 N 0.52 0.76 -0.29 1.86 1.08 -1.04 -2.73 117.51 117.67 1sfl h ILE 24 Ca 0.13 -0.27 0.04 0.00 -0.39 0.00 0.00 64.86 64.36 1sfl h ILE 24 Cb 0.13 0.92 -0.02 0.00 -3.07 0.00 0.00 36.82 34.79 1sfl h ILE 24 CO -0.01 0.06 0.20 0.78 -0.69 0.00 0.00 178.15 178.49 1sfl h ASN 25 N -0.51 0.21 -0.05 1.72 -0.26 -1.23 -1.58 115.58 113.88 1sfl h ASN 25 Ca -0.04 -0.00 -0.05 0.00 -0.56 0.00 0.00 56.30 55.65 1sfl h ASN 25 Cb 0.38 -0.05 -0.01 0.00 -1.06 0.00 0.00 38.32 37.58 1sfl h ASN 25 CO 0.06 0.14 -0.10 0.45 -1.06 0.00 0.00 177.43 176.92 1sfl h HIS 26 N 0.24 0.33 -0.63 1.19 3.86 -1.06 -2.69 115.15 116.39 1sfl h HIS 26 Ca 0.13 -0.04 0.00 0.00 -1.16 0.00 0.00 60.37 59.30 1sfl h HIS 26 Cb 0.20 -0.10 0.00 0.00 1.06 0.00 0.00 27.41 28.58 1sfl h HIS 26 CO -0.00 0.42 0.00 0.54 0.86 0.00 0.00 177.93 179.75 1sfl n ARG 27 N -4.27 3.88 -0.45 2.45 1.74 -0.63 -4.65 116.66 114.74 1sfl n ARG 27 Ca -0.00 -2.93 0.38 0.00 -0.77 0.00 0.00 57.85 54.53 1sfl n ARG 27 Cb 0.27 -1.94 0.69 0.00 -1.02 0.00 0.00 32.46 30.46 1sfl n ARG 27 CO 0.00 0.00 0.00 0.97 -1.52 0.00 0.00 177.63 177.08 1sfl h ILE 28 N 3.99 0.24 0.00 0.55 2.10 -1.12 0.18 117.51 123.45 1sfl h ILE 28 Ca 0.00 -0.03 -0.11 0.00 1.08 0.00 0.00 64.86 65.80 1sfl h ILE 28 Cb 1.52 0.13 -0.02 0.00 -1.09 0.00 0.00 36.82 37.37 1sfl h ILE 28 CO 0.27 0.02 -0.51 -0.78 -1.08 0.00 0.00 178.15 176.06 1sfl h ASP 29 N 0.09 0.00 -0.01 2.19 1.82 -1.86 -3.21 116.42 115.45 1sfl h ASP 29 Ca 0.74 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 57.38 1sfl h ASP 29 Cb 2.59 0.00 0.00 0.00 0.68 0.00 0.00 39.33 42.60 1sfl h ASP 29 CO -0.20 0.51 -0.09 0.00 -1.61 0.00 0.00 179.24 177.85 1sfl n ALA 30 N -2.35 2.70 -3.15 -0.78 0.00 0.63 -4.88 120.51 112.68 1sfl n ALA 30 Ca -0.00 -0.60 -0.38 0.00 0.00 0.00 0.00 53.44 52.45 1sfl n ALA 30 Cb 0.59 -0.92 -0.12 0.00 0.00 0.00 0.00 19.45 19.00 1sfl n ALA 30 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1sfl s ILE 31 N -2.11 3.99 -0.18 0.00 1.01 -1.09 -4.64 121.20 118.19 1sfl s ILE 31 Ca 0.29 -0.84 -0.02 0.00 0.00 0.00 0.00 60.65 60.08 1sfl s ILE 31 Cb 0.20 -3.14 -0.22 0.00 0.01 0.00 0.00 42.46 39.31 1sfl s ILE 31 CO 0.36 -0.03 0.13 0.47 0.00 0.00 0.00 174.94 175.87 1sfl n ASP 32 N 4.87 1.98 -4.01 3.58 8.00 0.03 -4.64 116.55 126.35 1sfl n ASP 32 Ca -0.14 0.07 -0.23 0.00 0.71 0.00 0.00 54.79 55.21 1sfl n ASP 32 Cb 0.47 -0.61 -0.16 0.00 -0.02 0.00 0.00 41.12 40.80 1sfl n ASP 32 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1sfl s VAL 33 N -2.54 0.97 -0.34 2.53 1.01 -0.68 -1.29 120.40 120.06 1sfl s VAL 33 Ca -0.27 -0.42 -0.11 0.00 0.00 0.00 0.00 61.98 61.19 1sfl s VAL 33 Cb 0.08 -0.88 0.00 0.00 0.00 0.00 0.00 36.38 35.58 1sfl s VAL 33 CO 0.71 0.31 0.19 -0.22 0.00 0.00 0.00 175.10 176.08 1sfl s LEU 34 N 0.46 4.39 -0.35 3.92 2.96 0.09 -0.45 118.68 129.70 1sfl s LEU 34 Ca -0.09 -0.65 -0.18 0.00 -0.22 0.00 0.00 54.13 53.00 1sfl s LEU 34 Cb -0.13 -2.04 -0.00 0.00 0.50 0.00 0.00 46.19 44.52 1sfl s LEU 34 CO 0.02 -0.26 0.49 -0.70 -1.32 0.00 0.00 176.35 174.58 1sfl s GLU 35 N 1.62 3.61 -0.57 1.98 2.12 0.19 -1.03 118.70 126.62 1sfl s GLU 35 Ca 0.04 -0.20 -0.19 0.00 0.36 0.00 0.00 54.97 54.99 1sfl s GLU 35 Cb -0.18 -3.81 0.10 0.00 0.26 0.00 0.00 34.13 30.50 1sfl s GLU 35 CO 0.07 -0.63 0.67 -1.17 -0.54 0.00 0.00 175.26 173.66 1sfl s LEU 36 N 2.34 5.36 0.26 2.70 2.96 0.22 -1.24 118.68 131.28 1sfl s LEU 36 Ca 0.18 -1.35 -0.30 0.00 -0.22 0.00 0.00 54.13 52.44 1sfl s LEU 36 Cb -0.16 -2.32 -0.09 0.00 0.50 0.00 0.00 46.19 44.12 1sfl s LEU 36 CO 0.13 -1.05 1.06 -0.13 -1.32 0.00 0.00 176.35 175.05 1sfl s ARG 37 N 2.59 4.68 0.00 1.98 1.81 -0.47 -1.50 118.95 128.04 1sfl s ARG 37 Ca 0.11 1.73 0.00 0.00 -1.72 0.00 0.00 55.73 55.85 1sfl s ARG 37 Cb -0.24 -3.22 0.00 0.00 -0.45 0.00 0.00 34.95 31.04 1sfl s ARG 37 CO 0.07 0.26 0.27 0.44 -0.68 0.00 0.00 175.30 175.67 1sfl n ILE 38 N 1.40 0.00 0.30 1.52 -5.35 0.08 -4.59 119.36 112.73 1sfl n ILE 38 Ca -0.01 -0.31 0.09 0.00 -0.27 0.00 0.00 62.75 62.25 1sfl n ILE 38 Cb 0.45 1.34 0.41 0.00 -1.74 0.00 0.00 39.64 40.10 1sfl n ILE 38 CO 0.00 0.00 0.00 -0.90 -1.76 0.00 0.00 176.55 173.89 1sfl n ASP 39 N -0.07 0.41 -0.77 7.28 5.75 -1.26 -2.14 116.55 125.75 1sfl n ASP 39 Ca 0.00 0.63 0.02 0.00 -0.01 0.00 0.00 54.79 55.43 1sfl n ASP 39 Cb 0.08 -0.71 0.11 0.00 -1.03 0.00 0.00 41.12 39.57 1sfl n ASP 39 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1sfl n GLN 40 N -1.99 1.93 -4.01 0.11 0.00 -1.26 -3.13 117.38 109.03 1sfl n GLN 40 Ca 0.01 -0.82 -0.34 0.00 0.00 0.00 0.00 57.00 55.85 1sfl n GLN 40 Cb 0.14 -1.59 -0.15 0.00 0.00 0.00 0.00 30.24 28.63 1sfl n GLN 40 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.06 177.00 1sfl s PHE 41 N -1.53 2.92 0.18 2.61 2.99 -0.91 -5.00 117.98 119.24 1sfl s PHE 41 Ca 0.14 -1.43 -0.30 0.00 0.00 0.00 0.00 56.93 55.34 1sfl s PHE 41 Cb 0.10 -2.01 -0.08 0.00 0.00 0.00 0.00 43.02 41.03 1sfl s PHE 41 CO 0.05 -0.71 1.19 -1.21 -0.00 0.00 0.00 175.22 174.54 1sfl s GLU 42 N 1.35 4.50 -1.43 0.44 2.02 -1.26 -2.91 118.70 121.40 1sfl s GLU 42 Ca 0.03 1.86 -0.07 0.00 0.02 0.00 0.00 54.97 56.82 1sfl s GLU 42 Cb -0.15 -3.25 0.04 0.00 0.10 0.00 0.00 34.13 30.88 1sfl s GLU 42 CO -0.08 -0.08 0.78 0.09 0.02 0.00 0.00 175.26 175.99 1sfl n ASN 43 N 2.56 -2.62 -4.75 -0.19 3.02 -1.26 -4.89 115.26 107.13 1sfl n ASN 43 Ca 0.04 -0.84 -0.41 0.00 -0.03 0.00 0.00 54.58 53.34 1sfl n ASN 43 Cb 0.45 -3.78 -0.03 0.00 -0.61 0.00 0.00 39.78 35.81 1sfl n ASN 43 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1sfl s VAL 44 N -3.54 3.19 0.25 2.41 0.11 -1.15 -5.02 120.40 116.66 1sfl s VAL 44 Ca 0.31 1.07 0.10 0.00 -2.93 0.00 0.00 61.98 60.53 1sfl s VAL 44 Cb -0.16 -3.68 -0.05 0.00 -1.53 0.00 0.00 36.38 30.97 1sfl s VAL 44 CO 0.84 0.20 -0.10 0.42 -3.33 0.00 0.00 175.10 173.13 1sfl s THR 45 N -0.44 3.01 0.48 5.04 -4.23 -1.26 -5.02 115.64 113.22 1sfl s THR 45 Ca 0.52 -2.05 0.15 0.00 -1.18 0.00 0.00 61.69 59.13 1sfl s THR 45 Cb -0.36 -2.57 0.23 0.00 1.34 0.00 0.00 72.50 71.14 1sfl s THR 45 CO 0.42 -0.32 2.08 0.58 -0.54 0.00 0.00 174.62 176.84 1sfl h VAL 46 N 2.24 1.06 -0.38 2.29 2.07 -1.95 -2.06 116.25 119.53 1sfl h VAL 46 Ca -0.43 -0.26 -0.11 0.00 0.82 0.00 0.00 66.70 66.72 1sfl h VAL 46 Cb 1.24 1.10 -0.01 0.00 -1.52 0.00 0.00 31.29 32.10 1sfl h VAL 46 CO 0.58 0.08 -0.18 0.44 0.02 0.00 0.00 177.57 178.51 1sfl h ASP 47 N 0.04 0.81 -0.33 0.57 5.19 -1.98 0.53 116.42 121.24 1sfl h ASP 47 Ca 0.01 -0.40 -0.00 0.00 -0.62 0.00 0.00 57.03 56.01 1sfl h ASP 47 Cb 0.12 -0.22 -0.02 0.00 0.18 0.00 0.00 39.33 39.40 1sfl h ASP 47 CO 0.01 1.03 0.19 1.56 -3.12 0.00 0.00 179.24 178.91 1sfl h GLN 48 N 0.58 0.45 -0.82 3.56 4.20 -1.81 -1.08 115.11 120.19 1sfl h GLN 48 Ca 0.08 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.74 1sfl h GLN 48 Cb 0.72 -0.09 -0.04 0.00 0.30 0.00 0.00 27.48 28.37 1sfl h GLN 48 CO 0.05 0.36 0.47 0.28 -0.67 0.00 0.00 178.83 179.33 1sfl h VAL 49 N 0.42 1.24 -0.87 -0.54 2.07 -1.25 -1.81 116.25 115.51 1sfl h VAL 49 Ca 0.12 -0.56 0.02 0.00 0.82 0.00 0.00 66.70 67.10 1sfl h VAL 49 Cb 0.03 0.11 -0.05 0.00 -1.52 0.00 0.00 31.29 29.87 1sfl h VAL 49 CO -0.02 0.26 0.57 0.00 0.02 0.00 0.00 177.57 178.40 1sfl h ALA 50 N 1.25 1.12 0.83 1.67 0.00 -0.38 -2.12 119.26 121.63 1sfl h ALA 50 Ca 0.29 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 55.11 1sfl h ALA 50 Cb -0.00 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.45 1sfl h ALA 50 CO -0.05 0.47 -0.48 0.93 0.00 0.00 0.00 179.25 180.12 1sfl h GLU 51 N 1.15 -1.17 -1.01 0.00 5.08 -0.46 -2.83 114.58 115.34 1sfl h GLU 51 Ca 0.33 0.08 0.26 0.00 -1.00 0.00 0.00 59.36 59.03 1sfl h GLU 51 Cb -0.08 0.27 -0.12 0.00 0.50 0.00 0.00 28.75 29.31 1sfl h GLU 51 CO -0.09 -0.78 0.60 0.52 -1.00 0.00 0.00 179.01 178.27 1sfl h MET 52 N -1.21 0.51 0.51 2.33 2.86 -1.13 -1.71 114.93 117.08 1sfl h MET 52 Ca -0.11 -0.03 -0.02 0.00 -2.06 0.00 0.00 59.70 57.48 1sfl h MET 52 Cb 0.96 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 32.50 1sfl h MET 52 CO 0.13 0.34 -0.34 0.82 1.06 0.00 0.00 176.91 178.92 1sfl h ILE 53 N 0.52 0.31 -1.00 -1.22 5.03 -1.16 -2.66 117.51 117.34 1sfl h ILE 53 Ca 0.65 0.00 0.17 0.00 -0.12 0.00 0.00 64.86 65.57 1sfl h ILE 53 Cb 1.33 0.31 -0.10 0.00 -3.03 0.00 0.00 36.82 35.33 1sfl h ILE 53 CO -0.47 0.00 0.62 0.71 -0.68 0.00 0.00 178.15 178.33 1sfl h THR 54 N -0.81 0.76 0.00 -0.27 1.35 -1.10 0.59 112.91 113.43 1sfl h THR 54 Ca -0.06 -0.28 0.00 0.00 -0.55 0.00 0.00 66.41 65.53 1sfl h THR 54 Cb 0.67 -0.12 0.00 0.00 -1.73 0.00 0.00 68.15 66.98 1sfl h THR 54 CO 0.04 0.15 0.00 1.17 -0.25 0.00 0.00 175.52 176.63 1sfl n LYS 55 N -4.72 0.08 0.01 4.72 0.00 -1.00 -3.23 118.16 114.02 1sfl n LYS 55 Ca 0.22 0.03 -0.01 0.00 0.00 0.00 0.00 58.31 58.55 1sfl n LYS 55 Cb 0.53 -1.50 -0.00 0.00 0.00 0.00 0.00 35.03 34.05 1sfl n LYS 55 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 1sfl n LEU 56 N -1.04 0.77 -4.60 3.14 4.77 0.20 -5.09 117.00 115.15 1sfl n LEU 56 Ca 0.02 0.11 -0.54 0.00 -0.03 0.00 0.00 56.01 55.57 1sfl n LEU 56 Cb 0.01 -0.31 -0.06 0.00 -2.33 0.00 0.00 43.42 40.73 1sfl n LEU 56 CO 0.02 -0.58 0.92 0.29 -1.33 0.00 0.00 177.39 176.71 1sfl n LYS 57 N -3.22 1.00 0.00 3.23 5.02 -0.90 -5.13 118.16 118.16 1sfl n LYS 57 Ca -0.02 0.36 0.00 0.00 -2.02 0.00 0.00 58.31 56.63 1sfl n LYS 57 Cb 0.08 -1.99 0.00 0.00 -0.02 0.00 0.00 35.03 33.09 1sfl n LYS 57 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1sfl n ASP 61 N 2.80 0.00 -0.21 4.39 5.68 -1.26 -5.12 116.55 122.84 1sfl n ASP 61 Ca 0.20 0.00 0.08 0.00 -0.50 0.00 0.00 54.79 54.57 1sfl n ASP 61 Cb 0.17 0.00 -0.05 0.00 -1.14 0.00 0.00 41.12 40.10 1sfl n ASP 61 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1sfl n SER 62 N 0.00 1.28 -3.81 -1.12 7.64 -1.26 -4.99 113.62 111.36 1sfl n SER 62 Ca 0.00 -1.14 -0.10 0.00 1.01 0.00 0.00 58.87 58.64 1sfl n SER 62 Cb 0.00 0.73 -0.06 0.00 -1.01 0.00 0.00 64.21 63.87 1sfl n SER 62 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 1sfl s PHE 63 N -2.34 0.10 0.41 1.43 -0.71 -1.26 -4.85 117.98 110.75 1sfl s PHE 63 Ca 0.11 -0.47 -0.21 0.00 -1.04 0.00 0.00 56.93 55.32 1sfl s PHE 63 Cb 0.14 0.08 -0.11 0.00 -1.21 0.00 0.00 43.02 41.93 1sfl s PHE 63 CO 0.58 -0.69 0.92 0.15 -1.34 0.00 0.00 175.22 174.84 1sfl s LYS 64 N -3.88 4.23 -0.30 1.99 1.02 -0.41 -4.85 119.74 117.53 1sfl s LYS 64 Ca 0.09 1.08 -0.09 0.00 0.02 0.00 0.00 55.97 57.07 1sfl s LYS 64 Cb 0.03 -2.26 -0.01 0.00 -0.52 0.00 0.00 37.83 35.07 1sfl s LYS 64 CO -0.07 0.02 0.14 -1.17 -0.92 0.00 0.00 175.35 173.35 1sfl s LEU 65 N -3.06 4.03 -0.14 3.17 1.98 -1.26 -0.73 118.68 122.66 1sfl s LEU 65 Ca 0.60 -0.49 -0.04 0.00 -2.89 0.00 0.00 54.13 51.31 1sfl s LEU 65 Cb -0.10 -1.99 -0.03 0.00 0.66 0.00 0.00 46.19 44.73 1sfl s LEU 65 CO 0.14 -0.18 -0.03 -0.22 -1.89 0.00 0.00 176.35 174.18 1sfl s LEU 66 N 1.61 3.33 -0.17 -0.68 2.96 -0.20 -1.49 118.68 124.04 1sfl s LEU 66 Ca 0.05 -0.07 -0.01 0.00 -0.22 0.00 0.00 54.13 53.87 1sfl s LEU 66 Cb -0.17 -1.80 -0.01 0.00 0.50 0.00 0.00 46.19 44.72 1sfl s LEU 66 CO 0.06 0.21 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.50 1sfl s VAL 67 N 0.14 3.01 -0.10 1.68 1.01 -0.46 0.71 120.40 126.40 1sfl s VAL 67 Ca -0.01 -0.64 0.02 0.00 0.00 0.00 0.00 61.98 61.35 1sfl s VAL 67 Cb -0.13 -2.31 0.01 0.00 0.00 0.00 0.00 36.38 33.95 1sfl s VAL 67 CO 0.02 0.49 -0.14 -0.89 0.00 0.00 0.00 175.10 174.58 1sfl s THR 68 N 0.94 1.36 -0.44 3.92 2.01 -0.56 -2.54 115.64 120.33 1sfl s THR 68 Ca -0.02 -0.57 -0.04 0.00 0.31 0.00 0.00 61.69 61.37 1sfl s THR 68 Cb -0.15 -1.25 0.12 0.00 0.01 0.00 0.00 72.50 71.23 1sfl s THR 68 CO -0.01 0.41 0.25 -0.47 -0.69 0.00 0.00 174.62 174.11 1sfl s TYR 69 N 0.94 3.55 -0.23 4.92 6.14 -1.26 -0.74 117.35 130.67 1sfl s TYR 69 Ca -0.08 -2.33 -0.24 0.00 0.64 0.00 0.00 57.07 55.05 1sfl s TYR 69 Cb -0.15 -3.28 -0.01 0.00 0.42 0.00 0.00 41.96 38.94 1sfl s TYR 69 CO -0.00 -0.97 0.80 0.50 0.64 0.00 0.00 175.55 176.51 1sfl s ARG 70 N 1.10 4.19 0.52 4.97 6.06 -1.26 -4.89 118.95 129.64 1sfl s ARG 70 Ca 0.08 0.89 -0.18 0.00 -2.50 0.00 0.00 55.73 54.03 1sfl s ARG 70 Cb -0.23 -3.63 -0.07 0.00 0.06 0.00 0.00 34.95 31.07 1sfl s ARG 70 CO -0.04 -0.46 1.01 0.95 -2.50 0.00 0.00 175.30 174.26 1sfl s THR 71 N 2.65 4.20 0.36 4.11 -4.23 -1.26 -1.46 115.64 120.01 1sfl s THR 71 Ca 0.34 1.15 0.03 0.00 -1.18 0.00 0.00 61.69 62.03 1sfl s THR 71 Cb -0.15 -3.57 0.26 0.00 1.34 0.00 0.00 72.50 70.38 1sfl s THR 71 CO 0.08 -0.51 2.02 0.07 -0.54 0.00 0.00 174.62 175.74 1sfl h LYS 72 N 1.04 0.80 -0.86 3.99 2.10 -0.81 0.13 116.57 122.96 1sfl h LYS 72 Ca -0.48 -0.05 0.18 0.00 -2.00 0.00 0.00 60.65 58.31 1sfl h LYS 72 Cb 1.20 -0.18 -0.11 0.00 -0.90 0.00 0.00 32.23 32.24 1sfl h LYS 72 CO 0.60 0.53 0.40 1.25 -2.00 0.00 0.00 179.45 180.23 1sfl h LEU 73 N 0.82 0.40 -3.80 7.07 7.12 -1.87 -1.38 115.31 123.67 1sfl h LEU 73 Ca 0.22 0.12 -0.49 0.00 0.13 0.00 0.00 57.88 57.87 1sfl h LEU 73 Cb -0.10 0.08 -0.27 0.00 -0.53 0.00 0.00 40.66 39.85 1sfl h LEU 73 CO -0.05 0.10 0.36 0.00 -0.13 0.00 0.00 178.44 178.72 1sfl n GLN 74 N -4.97 2.44 -0.25 1.25 6.02 -0.27 -4.91 117.38 116.69 1sfl n GLN 74 Ca 0.19 -3.28 0.00 0.00 -0.01 0.00 0.00 57.00 53.90 1sfl n GLN 74 Cb 0.54 -2.13 0.00 0.00 1.02 0.00 0.00 30.24 29.67 1sfl n GLN 74 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1sfl n GLY 75 N -1.02 0.63 0.00 1.08 0.00 -0.52 -4.82 105.19 100.54 1sfl n GLY 75 Ca 0.52 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.54 1sfl n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sfl n GLY 76 N -2.00 2.11 0.00 -0.02 0.00 0.29 -4.92 105.19 100.65 1sfl n GLY 76 Ca 0.00 -2.01 0.06 0.00 0.00 0.00 0.00 46.02 44.07 1sfl n GLY 76 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1sfl n TYR 77 N 0.00 0.00 -1.89 1.61 4.01 -1.13 -3.79 117.16 115.97 1sfl n TYR 77 Ca 0.00 0.00 -0.42 0.00 -0.16 0.00 0.00 57.90 57.32 1sfl n TYR 77 Cb 0.00 -0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.00 1sfl n TYR 77 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 1sfl s GLY 78 N -2.19 1.33 0.00 2.72 0.00 -0.54 -4.66 107.32 103.98 1sfl s GLY 78 Ca 0.05 0.93 0.15 0.00 0.00 0.00 0.00 44.72 45.85 1sfl s GLY 78 CO 0.51 3.24 1.00 -1.06 0.00 0.00 0.00 173.10 176.79 1sfl n GLN 79 N 7.54 1.18 -1.11 2.90 6.02 -1.26 -0.39 117.38 132.26 1sfl n GLN 79 Ca 0.20 -1.44 -0.36 0.00 -0.01 0.00 0.00 57.00 55.38 1sfl n GLN 79 Cb 0.43 -1.30 0.06 0.00 1.02 0.00 0.00 30.24 30.46 1sfl n GLN 79 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 1sfl n PHE 80 N 0.86 -2.31 -2.28 1.08 0.99 -1.26 -4.91 117.46 109.63 1sfl n PHE 80 Ca 0.09 0.25 -0.36 0.00 -0.00 0.00 0.00 57.45 57.44 1sfl n PHE 80 Cb 0.39 -1.74 -0.00 0.00 -1.00 0.00 0.00 39.48 37.12 1sfl n PHE 80 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.76 177.75 1sfl s THR 81 N -2.04 3.19 0.34 4.37 2.01 -1.26 -4.78 115.64 117.47 1sfl s THR 81 Ca 0.56 0.78 0.07 0.00 0.31 0.00 0.00 61.69 63.41 1sfl s THR 81 Cb -0.31 -3.34 0.31 0.00 0.01 0.00 0.00 72.50 69.18 1sfl s THR 81 CO 0.67 -0.12 1.87 -1.13 -0.69 0.00 0.00 174.62 175.22 1sfl h ASN 82 N 1.45 0.71 -0.44 3.53 -1.24 -1.99 0.45 115.58 118.05 1sfl h ASN 82 Ca -0.50 0.04 -0.06 0.00 0.71 0.00 0.00 56.30 56.48 1sfl h ASN 82 Cb 1.26 -0.11 -0.02 0.00 0.73 0.00 0.00 38.32 40.18 1sfl h ASN 82 CO 0.58 0.38 0.03 -0.78 -1.29 0.00 0.00 177.43 176.34 1sfl h ASP 83 N 0.76 0.75 0.63 1.15 1.82 -2.00 -1.28 116.42 118.26 1sfl h ASP 83 Ca 0.44 -0.29 -0.11 0.00 -0.39 0.00 0.00 57.03 56.68 1sfl h ASP 83 Cb 0.62 -0.20 -0.02 0.00 0.68 0.00 0.00 39.33 40.42 1sfl h ASP 83 CO -0.21 0.85 -0.53 0.28 -1.61 0.00 0.00 179.24 178.03 1sfl h SER 84 N 0.62 0.00 0.22 2.28 0.02 -1.52 -2.67 113.55 112.50 1sfl h SER 84 Ca 0.13 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.07 1sfl h SER 84 Cb 0.46 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.00 1sfl h SER 84 CO 0.02 0.53 -0.11 0.22 -1.14 0.00 0.00 176.83 176.36 1sfl h TYR 85 N 0.00 -0.28 0.00 3.45 3.20 0.24 -1.23 116.97 122.35 1sfl h TYR 85 Ca -0.01 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.82 1sfl h TYR 85 Cb 1.00 0.09 -0.01 0.00 1.54 0.00 0.00 36.73 39.35 1sfl h TYR 85 CO 0.00 -0.02 -0.17 -0.07 -1.64 0.00 0.00 178.16 176.26 1sfl h LEU 86 N -0.51 0.00 -0.27 2.82 3.38 -1.22 -1.11 115.31 118.40 1sfl h LEU 86 Ca -0.03 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.82 1sfl h LEU 86 Cb 0.38 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.13 1sfl h LEU 86 CO 0.05 0.17 -0.32 0.78 0.09 0.00 0.00 178.44 179.21 1sfl h ASN 87 N 0.00 0.74 -0.33 -0.43 -0.26 -1.30 -1.84 115.58 112.17 1sfl h ASN 87 Ca -0.00 -0.49 -0.01 0.00 -0.56 0.00 0.00 56.30 55.24 1sfl h ASN 87 Cb 0.36 -0.21 -0.02 0.00 -1.06 0.00 0.00 38.32 37.39 1sfl h ASN 87 CO 0.02 1.09 0.17 0.25 -1.06 0.00 0.00 177.43 177.90 1sfl h LEU 88 N 0.41 0.43 -0.81 1.61 5.85 -0.54 -0.66 115.31 121.60 1sfl h LEU 88 Ca 0.04 -0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.65 1sfl h LEU 88 Cb 0.90 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.78 1sfl h LEU 88 CO 0.08 0.42 0.53 0.40 -0.34 0.00 0.00 178.44 179.52 1sfl h ILE 89 N 0.41 1.21 -0.63 4.05 2.04 -1.17 -1.96 117.51 121.46 1sfl h ILE 89 Ca 0.12 -0.41 -0.09 0.00 1.00 0.00 0.00 64.86 65.47 1sfl h ILE 89 Cb 0.10 0.03 -0.02 0.00 -0.74 0.00 0.00 36.82 36.19 1sfl h ILE 89 CO -0.02 0.21 0.04 -1.28 0.00 0.00 0.00 178.15 177.11 1sfl h SER 90 N 1.11 1.04 0.38 1.72 0.87 -1.07 -3.04 113.55 114.56 1sfl h SER 90 Ca 0.30 -0.28 -0.05 0.00 -1.23 0.00 0.00 61.79 60.53 1sfl h SER 90 Cb -0.10 -0.28 -0.01 0.00 -0.44 0.00 0.00 62.40 61.57 1sfl h SER 90 CO -0.06 1.07 -0.23 0.44 -0.53 0.00 0.00 176.83 177.52 1sfl h ASP 91 N 0.99 0.00 0.43 6.23 3.32 -0.54 -2.81 116.42 124.04 1sfl h ASP 91 Ca 0.18 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.23 1sfl h ASP 91 Cb 0.51 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.06 1sfl h ASP 91 CO 0.02 0.23 0.00 0.18 -1.72 0.00 0.00 179.24 177.96 1sfl n LEU 92 N -3.92 0.48 0.22 1.55 4.77 -0.79 -2.48 117.00 116.83 1sfl n LEU 92 Ca -0.02 0.65 0.07 0.00 -0.03 0.00 0.00 56.01 56.68 1sfl n LEU 92 Cb 0.32 -0.63 0.53 0.00 -2.33 0.00 0.00 43.42 41.30 1sfl n LEU 92 CO 0.35 -0.62 0.87 0.00 -1.33 0.00 0.00 177.39 176.66 1sfl h ALA 93 N 2.20 1.49 0.00 -1.18 0.00 -1.64 -2.54 119.26 117.59 1sfl h ALA 93 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1sfl h ALA 93 Cb 0.21 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.97 1sfl h ALA 93 CO 0.00 0.27 0.00 0.09 0.00 0.00 0.00 179.25 179.61 1sfl n ASN 94 N -4.06 0.03 -4.50 0.00 3.02 -1.04 -4.61 115.26 104.12 1sfl n ASN 94 Ca -0.02 0.50 -0.42 0.00 -0.03 0.00 0.00 54.58 54.61 1sfl n ASN 94 Cb 0.29 -0.51 -0.03 0.00 -0.61 0.00 0.00 39.78 38.91 1sfl n ASN 94 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1sfl s ILE 95 N -3.01 4.07 0.34 2.41 1.01 -0.96 -4.91 121.20 120.15 1sfl s ILE 95 Ca 0.12 -0.18 0.12 0.00 0.00 0.00 0.00 60.65 60.72 1sfl s ILE 95 Cb 0.17 -4.82 0.33 0.00 0.01 0.00 0.00 42.46 38.15 1sfl s ILE 95 CO 0.48 -1.67 1.72 -1.13 0.00 0.00 0.00 174.94 174.34 1sfl h ASN 96 N 9.72 0.61 0.60 3.58 -1.24 -1.87 -1.81 115.58 125.16 1sfl h ASN 96 Ca -0.21 0.14 0.00 0.00 0.71 0.00 0.00 56.30 56.94 1sfl h ASN 96 Cb 1.05 0.05 0.00 0.00 0.73 0.00 0.00 38.32 40.15 1sfl h ASN 96 CO 1.24 0.05 0.00 0.61 -1.29 0.00 0.00 177.43 178.04 1sfl n GLY 97 N -1.34 -1.16 3.70 1.57 0.00 -1.26 -4.74 105.19 101.97 1sfl n GLY 97 Ca 0.28 0.06 -0.42 0.00 0.00 0.00 0.00 46.02 45.93 1sfl n GLY 97 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1sfl s ILE 98 N -3.25 4.46 -0.22 -0.61 -1.09 -0.68 -4.73 121.20 115.09 1sfl s ILE 98 Ca 0.04 1.77 -0.01 0.00 -2.23 0.00 0.00 60.65 60.22 1sfl s ILE 98 Cb 0.09 -4.13 -0.20 0.00 -1.58 0.00 0.00 42.46 36.64 1sfl s ILE 98 CO 0.34 0.09 -0.05 0.47 -1.23 0.00 0.00 174.94 174.56 1sfl n ASP 99 N 4.31 2.02 -4.07 3.58 8.00 -0.56 -4.86 116.55 124.97 1sfl n ASP 99 Ca 0.08 -0.03 -0.18 0.00 0.71 0.00 0.00 54.79 55.37 1sfl n ASP 99 Cb 0.48 -0.55 -0.14 0.00 -0.02 0.00 0.00 41.12 40.89 1sfl n ASP 99 CO 0.00 0.00 0.00 -0.04 -0.39 0.00 0.00 177.20 176.77 1sfl s MET 100 N -2.53 0.76 -0.03 -1.24 -1.94 -0.55 -1.31 119.30 112.46 1sfl s MET 100 Ca -0.31 -0.56 0.04 0.00 -1.71 0.00 0.00 55.69 53.15 1sfl s MET 100 Cb 0.08 -0.72 -0.01 0.00 2.01 0.00 0.00 34.83 36.20 1sfl s MET 100 CO 0.65 0.18 -0.15 0.42 -0.01 0.00 0.00 175.02 176.11 1sfl s ILE 101 N -0.66 1.21 -0.14 2.53 -1.09 -0.37 -1.35 121.20 121.33 1sfl s ILE 101 Ca 0.00 -0.62 -0.13 0.00 -2.23 0.00 0.00 60.65 57.67 1sfl s ILE 101 Cb -0.06 -1.03 -0.05 0.00 -1.58 0.00 0.00 42.46 39.74 1sfl s ILE 101 CO 0.00 0.35 0.29 -0.62 -1.23 0.00 0.00 174.94 173.74 1sfl s ASP 102 N -0.09 6.48 -0.08 3.58 -1.08 -1.05 -1.21 116.67 123.23 1sfl s ASP 102 Ca 0.00 0.56 0.01 0.00 -0.52 0.00 0.00 52.55 52.61 1sfl s ASP 102 Cb -0.09 -2.18 0.02 0.00 -1.46 0.00 0.00 42.92 39.21 1sfl s ASP 102 CO 0.01 0.16 -0.10 -0.51 0.52 0.00 0.00 175.17 175.24 1sfl s ILE 103 N 0.13 1.06 0.20 4.11 1.10 0.15 -4.67 121.20 123.28 1sfl s ILE 103 Ca 0.17 -0.40 -0.30 0.00 -0.51 0.00 0.00 60.65 59.61 1sfl s ILE 103 Cb -0.13 -1.01 -0.08 0.00 0.15 0.00 0.00 42.46 41.39 1sfl s ILE 103 CO 0.05 0.35 0.95 -1.61 -2.11 0.00 0.00 174.94 172.56 1sfl s GLU 104 N 0.95 4.81 0.08 3.50 2.02 -1.26 -1.21 118.70 127.59 1sfl s GLU 104 Ca -0.09 1.48 0.07 0.00 0.02 0.00 0.00 54.97 56.44 1sfl s GLU 104 Cb -0.15 -3.31 -0.04 0.00 0.10 0.00 0.00 34.13 30.74 1sfl s GLU 104 CO 0.00 0.43 -0.13 -0.46 0.02 0.00 0.00 175.26 175.13 1sfl s TRP 105 N -0.85 2.69 -0.05 1.61 -0.00 0.15 -4.86 118.94 117.63 1sfl s TRP 105 Ca 0.43 -0.18 -0.29 0.00 -0.00 0.00 0.00 56.10 56.06 1sfl s TRP 105 Cb -0.25 -1.45 0.10 0.00 -0.00 0.00 0.00 33.47 31.87 1sfl s TRP 105 CO 0.31 0.37 0.86 1.14 -0.00 0.00 0.00 176.95 179.64 1sfl s GLN 106 N -1.90 0.82 0.28 5.86 -2.07 -1.26 -4.52 119.66 116.88 1sfl s GLN 106 Ca 0.19 -0.07 -0.01 0.00 -1.82 0.00 0.00 55.36 53.65 1sfl s GLN 106 Cb -0.11 0.38 0.64 0.00 -1.09 0.00 0.00 33.01 32.83 1sfl s GLN 106 CO 0.10 -0.31 1.63 0.00 -1.32 0.00 0.00 175.29 175.39 1sfl h ALA 107 N 2.36 1.11 -0.02 2.60 0.00 -2.02 -2.14 119.26 121.15 1sfl h ALA 107 Ca -0.23 0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1sfl h ALA 107 Cb 1.20 0.39 0.00 0.00 0.00 0.00 0.00 17.79 19.38 1sfl h ALA 107 CO 0.33 -0.47 0.00 -0.40 0.00 0.00 0.00 179.25 178.71 1sfl n ASP 108 N -5.30 0.29 -4.79 0.00 5.68 -1.26 -4.93 116.55 106.24 1sfl n ASP 108 Ca 0.19 -2.00 -0.32 0.00 -0.50 0.00 0.00 54.79 52.16 1sfl n ASP 108 Cb 0.63 -0.10 0.05 0.00 -1.14 0.00 0.00 41.12 40.56 1sfl n ASP 108 CO 0.00 0.00 0.00 0.27 -1.33 0.00 0.00 177.20 176.14 1sfl s ILE 109 N -1.82 3.55 -0.68 2.12 -0.00 -0.81 -4.95 121.20 118.62 1sfl s ILE 109 Ca 0.02 0.64 -0.24 0.00 -0.00 0.00 0.00 60.65 61.07 1sfl s ILE 109 Cb 0.01 -3.19 0.06 0.00 -0.00 0.00 0.00 42.46 39.34 1sfl s ILE 109 CO 0.01 -0.53 1.06 -0.62 -0.00 0.00 0.00 174.94 174.86 1sfl s ASP 110 N -3.01 6.17 0.14 4.36 3.68 -1.26 -4.93 116.67 121.81 1sfl s ASP 110 Ca 0.63 -0.85 -0.19 0.00 2.13 0.00 0.00 52.55 54.27 1sfl s ASP 110 Cb -0.17 -2.46 -0.00 0.00 -1.45 0.00 0.00 42.92 38.84 1sfl s ASP 110 CO 0.46 -1.55 1.70 0.40 0.13 0.00 0.00 175.17 176.30 1sfl h ILE 111 N 5.99 0.76 0.00 4.11 2.04 -1.96 -1.62 117.51 126.83 1sfl h ILE 111 Ca -0.28 -0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.54 1sfl h ILE 111 Cb 1.06 0.76 -0.01 0.00 -0.74 0.00 0.00 36.82 37.90 1sfl h ILE 111 CO 1.21 0.00 -0.18 -0.33 0.00 0.00 0.00 178.15 178.85 1sfl h GLU 112 N 0.00 0.00 -0.16 2.37 5.08 -2.00 -1.35 114.58 118.52 1sfl h GLU 112 Ca 0.12 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.36 1sfl h GLU 112 Cb 0.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.43 1sfl h GLU 112 CO -0.25 0.18 -0.36 -0.22 -1.00 0.00 0.00 179.01 177.36 1sfl h LYS 113 N 0.00 0.53 -0.46 2.33 3.64 -1.86 -2.47 116.57 118.28 1sfl h LYS 113 Ca -0.00 -0.35 0.00 0.00 -1.27 0.00 0.00 60.65 59.03 1sfl h LYS 113 Cb 0.33 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.17 1sfl h LYS 113 CO 0.02 0.97 0.29 0.45 -2.27 0.00 0.00 179.45 178.91 1sfl h HIS 114 N 0.17 0.59 -0.89 1.91 3.86 -0.82 -1.73 115.15 118.23 1sfl h HIS 114 Ca 0.00 0.01 0.03 0.00 -1.16 0.00 0.00 60.37 59.24 1sfl h HIS 114 Cb 0.96 -0.20 -0.05 0.00 1.06 0.00 0.00 27.41 29.19 1sfl h HIS 114 CO 0.10 0.39 0.58 0.37 0.86 0.00 0.00 177.93 180.23 1sfl h GLN 115 N 0.61 1.12 -0.65 2.45 5.75 -1.26 0.25 115.11 123.39 1sfl h GLN 115 Ca 0.17 -0.07 0.01 0.00 -0.15 0.00 0.00 58.65 58.60 1sfl h GLN 115 Cb -0.04 -0.25 -0.03 0.00 1.07 0.00 0.00 27.48 28.22 1sfl h GLN 115 CO -0.03 0.74 0.43 -0.09 -2.65 0.00 0.00 178.83 177.22 1sfl h ARG 116 N 1.15 0.85 -0.26 1.69 2.43 -0.93 0.33 114.38 119.65 1sfl h ARG 116 Ca 0.35 -0.05 -0.08 0.00 -0.81 0.00 0.00 59.98 59.39 1sfl h ARG 116 Cb -0.04 -0.19 -0.01 0.00 -0.42 0.00 0.00 29.97 29.31 1sfl h ARG 116 CO -0.10 0.57 -0.14 0.82 -1.51 0.00 0.00 179.97 179.61 1sfl h ILE 117 N 0.88 1.30 -0.54 1.20 2.04 -0.66 -1.36 117.51 120.37 1sfl h ILE 117 Ca 0.24 -1.23 -0.01 0.00 1.00 0.00 0.00 64.86 64.86 1sfl h ILE 117 Cb -0.10 1.55 -0.03 0.00 -0.74 0.00 0.00 36.82 37.51 1sfl h ILE 117 CO -0.05 0.38 0.31 0.40 0.00 0.00 0.00 178.15 179.19 1sfl h ILE 118 N 0.27 1.17 -0.66 -0.67 5.03 -0.75 0.03 117.51 121.93 1sfl h ILE 118 Ca 0.06 -0.41 -0.06 0.00 -0.12 0.00 0.00 64.86 64.32 1sfl h ILE 118 Cb 0.65 0.47 -0.03 0.00 -3.03 0.00 0.00 36.82 34.88 1sfl h ILE 118 CO 0.04 0.18 0.18 0.74 -0.68 0.00 0.00 178.15 178.61 1sfl h THR 119 N 0.72 1.26 -0.05 -0.27 2.02 -0.91 -1.38 112.91 114.30 1sfl h THR 119 Ca 0.19 -0.92 0.02 0.00 0.77 0.00 0.00 66.41 66.48 1sfl h THR 119 Cb 0.02 0.59 -0.03 0.00 -1.74 0.00 0.00 68.15 66.99 1sfl h THR 119 CO -0.03 0.35 -0.10 -0.74 0.37 0.00 0.00 175.52 175.37 1sfl h HIS 120 N 0.98 -0.24 -0.49 3.16 -0.00 -0.79 -1.06 115.15 116.71 1sfl h HIS 120 Ca 0.21 0.01 0.03 0.00 -0.00 0.00 0.00 60.37 60.62 1sfl h HIS 120 Cb 0.34 0.12 -0.04 0.00 -0.00 0.00 0.00 27.41 27.83 1sfl h HIS 120 CO 0.03 -0.15 0.28 -0.07 -0.00 0.00 0.00 177.93 178.01 1sfl h LEU 121 N -0.14 0.43 -1.53 0.26 3.38 -0.71 -2.11 115.31 114.89 1sfl h LEU 121 Ca 0.05 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.00 1sfl h LEU 121 Cb 0.22 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.89 1sfl h LEU 121 CO -0.14 0.30 -0.15 1.56 0.09 0.00 0.00 178.44 180.10 1sfl h GLN 122 N 0.55 0.00 0.00 1.13 4.20 -0.97 -1.42 115.11 118.60 1sfl h GLN 122 Ca 0.20 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.91 1sfl h GLN 122 Cb 0.06 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.84 1sfl h GLN 122 CO -0.11 0.15 0.00 1.96 -0.67 0.00 0.00 178.83 180.16 1sfl h GLN 123 N 0.00 0.00 -0.65 1.46 4.20 -0.50 -1.71 115.11 117.91 1sfl h GLN 123 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1sfl h GLN 123 Cb 0.54 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.32 1sfl h GLN 123 CO 0.02 0.00 0.00 0.66 -0.67 0.00 0.00 178.83 178.84 1sfl n TYR 124 N -2.79 1.15 -3.37 2.96 4.02 -0.60 -4.94 117.16 113.59 1sfl n TYR 124 Ca 0.02 -0.50 -0.22 0.00 -0.01 0.00 0.00 57.90 57.20 1sfl n TYR 124 Cb 0.36 -0.13 0.06 0.00 -0.02 0.00 0.00 39.34 39.61 1sfl n TYR 124 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 1sfl n ASN 125 N 1.17 -6.03 -4.71 7.72 5.03 -0.64 -5.01 115.26 112.79 1sfl n ASN 125 Ca 0.23 -0.44 -0.35 0.00 0.87 0.00 0.00 54.58 54.89 1sfl n ASN 125 Cb 0.71 -4.71 -0.09 0.00 -1.02 0.00 0.00 39.78 34.67 1sfl n ASN 125 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 1sfl s LYS 126 N -6.06 3.63 0.05 3.52 -0.14 -0.79 -4.97 119.74 114.99 1sfl s LYS 126 Ca 0.48 -0.30 -0.30 0.00 -1.36 0.00 0.00 55.97 54.48 1sfl s LYS 126 Cb -0.21 -3.12 -0.04 0.00 -1.68 0.00 0.00 37.83 32.78 1sfl s LYS 126 CO 0.59 0.49 1.00 -1.21 -0.76 0.00 0.00 175.35 175.46 1sfl s GLU 127 N -0.25 4.60 -0.16 1.68 2.02 -0.43 -3.91 118.70 122.26 1sfl s GLU 127 Ca 0.08 1.47 -0.07 0.00 0.02 0.00 0.00 54.97 56.47 1sfl s GLU 127 Cb -0.12 -3.41 -0.04 0.00 0.10 0.00 0.00 34.13 30.65 1sfl s GLU 127 CO 0.01 0.03 0.09 0.08 0.02 0.00 0.00 175.26 175.50 1sfl s VAL 128 N 0.60 5.09 -0.32 2.63 1.01 -1.26 -1.24 120.40 126.91 1sfl s VAL 128 Ca 0.51 0.07 -0.02 0.00 0.00 0.00 0.00 61.98 62.53 1sfl s VAL 128 Cb -0.23 -3.27 0.06 0.00 0.00 0.00 0.00 36.38 32.94 1sfl s VAL 128 CO 0.29 0.51 0.05 -0.63 0.00 0.00 0.00 175.10 175.32 1sfl s ILE 129 N -0.14 3.12 -0.14 2.22 -1.09 -0.35 -0.66 121.20 124.16 1sfl s ILE 129 Ca 0.09 -1.49 -0.18 0.00 -2.23 0.00 0.00 60.65 56.83 1sfl s ILE 129 Cb -0.12 -2.86 -0.04 0.00 -1.58 0.00 0.00 42.46 37.86 1sfl s ILE 129 CO 0.01 -0.23 0.47 -0.63 -1.23 0.00 0.00 174.94 173.33 1sfl s ILE 130 N 1.24 5.18 0.14 2.92 1.01 -0.59 -0.67 121.20 130.43 1sfl s ILE 130 Ca -0.02 0.92 0.07 0.00 0.00 0.00 0.00 60.65 61.61 1sfl s ILE 130 Cb -0.20 -3.81 -0.04 0.00 0.01 0.00 0.00 42.46 38.42 1sfl s ILE 130 CO -0.01 0.29 -0.16 -0.94 0.00 0.00 0.00 174.94 174.12 1sfl s SER 131 N 0.76 2.24 -0.02 3.58 1.04 -0.35 -0.06 113.70 120.89 1sfl s SER 131 Ca 0.25 -0.82 -0.01 0.00 0.48 0.00 0.00 55.95 55.84 1sfl s SER 131 Cb -0.15 -0.10 0.01 0.00 0.10 0.00 0.00 66.02 65.88 1sfl s SER 131 CO 0.10 -0.10 0.05 -2.28 0.98 0.00 0.00 173.24 171.99 1sfl s HIS 132 N -2.07 -0.04 -0.07 5.02 2.46 0.55 0.34 115.29 121.48 1sfl s HIS 132 Ca 0.11 0.16 0.02 0.00 0.47 0.00 0.00 55.06 55.82 1sfl s HIS 132 Cb -0.05 -0.06 0.01 0.00 -0.13 0.00 0.00 32.58 32.35 1sfl s HIS 132 CO 0.04 -0.05 -0.13 -1.01 -2.47 0.00 0.00 174.74 171.11 1sfl s HIS 133 N 0.41 1.61 -0.27 3.88 3.76 -1.26 -1.10 115.29 122.32 1sfl s HIS 133 Ca -0.03 -0.63 0.02 0.00 -0.15 0.00 0.00 55.06 54.27 1sfl s HIS 133 Cb -0.05 -1.17 0.07 0.00 1.11 0.00 0.00 32.58 32.55 1sfl s HIS 133 CO -0.01 -0.32 -0.03 1.21 -0.85 0.00 0.00 174.74 174.74 1sfl s ASN 134 N 0.70 4.27 0.00 1.40 3.84 0.13 -4.93 114.94 120.35 1sfl s ASN 134 Ca -0.14 -1.53 0.27 0.00 0.21 0.00 0.00 52.86 51.68 1sfl s ASN 134 Cb -0.16 -1.37 0.94 0.00 -0.55 0.00 0.00 41.25 40.11 1sfl s ASN 134 CO 0.03 -0.27 1.68 0.49 -2.79 0.00 0.00 177.10 176.24 1sfl n PHE 135 N 4.51 0.00 -0.06 0.43 3.01 -1.26 -1.71 117.46 122.38 1sfl n PHE 135 Ca -0.08 0.00 -0.22 0.00 1.01 0.00 0.00 57.45 58.16 1sfl n PHE 135 Cb 0.43 -0.07 -0.13 0.00 -0.01 0.00 0.00 39.48 39.70 1sfl n PHE 135 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 1sfl n GLU 136 N -0.30 0.67 -1.82 -1.08 4.71 -1.26 -4.73 120.64 116.84 1sfl n GLU 136 Ca 0.16 0.32 -0.03 0.00 -0.01 0.00 0.00 57.16 57.60 1sfl n GLU 136 Cb 0.34 -1.66 0.01 0.00 -1.01 0.00 0.00 31.44 29.12 1sfl n GLU 136 CO 0.00 0.00 0.00 -1.13 0.09 0.00 0.00 177.13 176.09 1sfl n SER 137 N -3.76 -0.66 -3.98 1.62 3.41 -1.25 -4.85 113.62 104.15 1sfl n SER 137 Ca -0.37 -1.46 -0.31 0.00 -0.26 0.00 0.00 58.87 56.47 1sfl n SER 137 Cb 0.93 1.11 -0.15 0.00 -0.26 0.00 0.00 64.21 65.83 1sfl n SER 137 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1sfl s THR 138 N -2.72 1.79 1.10 6.66 2.01 -0.71 -2.43 115.64 121.33 1sfl s THR 138 Ca 0.05 -1.54 -0.12 0.00 0.31 0.00 0.00 61.69 60.39 1sfl s THR 138 Cb -0.01 -2.07 0.24 0.00 0.01 0.00 0.00 72.50 70.67 1sfl s THR 138 CO 0.03 -0.20 1.03 -2.65 -0.69 0.00 0.00 174.62 172.14 1sfl n PRO 139 N 4.55 -1.83 -0.63 4.92 -0.02 -1.26 -4.95 135.00 135.78 1sfl n PRO 139 Ca -0.09 -0.49 -0.30 0.00 -2.02 0.00 0.00 63.50 60.59 1sfl n PRO 139 Cb 0.43 -2.22 0.19 0.00 -0.02 0.00 0.00 33.50 31.88 1sfl n PRO 139 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1sfl n PRO 140 N -4.66 -0.92 -0.08 0.52 -0.02 -1.26 -4.62 135.00 123.95 1sfl n PRO 140 Ca 0.06 -0.21 -0.08 0.00 -2.02 0.00 0.00 63.50 61.25 1sfl n PRO 140 Cb 0.53 -2.33 -0.01 0.00 -0.02 0.00 0.00 33.50 31.67 1sfl n PRO 140 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1sfl h LEU 141 N -2.09 -0.88 -1.20 2.45 6.46 -1.92 -0.60 115.31 117.54 1sfl h LEU 141 Ca -0.47 0.16 0.15 0.00 -0.12 0.00 0.00 57.88 57.60 1sfl h LEU 141 Cb 1.28 0.42 -0.08 0.00 -0.73 0.00 0.00 40.66 41.55 1sfl h LEU 141 CO 0.43 -0.29 0.60 0.44 -0.62 0.00 0.00 178.44 178.99 1sfl h ASP 142 N -0.24 0.71 -0.18 1.25 3.45 -1.98 0.46 116.42 119.89 1sfl h ASP 142 Ca 0.16 0.05 -0.18 0.00 0.43 0.00 0.00 57.03 57.49 1sfl h ASP 142 Cb 0.49 -0.09 -0.00 0.00 -0.56 0.00 0.00 39.33 39.17 1sfl h ASP 142 CO -0.45 0.34 -0.55 -0.33 -1.57 0.00 0.00 179.24 176.67 1sfl h GLU 143 N 0.74 0.77 -0.34 3.56 4.39 -1.62 -1.70 114.58 120.38 1sfl h GLU 143 Ca 0.49 -0.49 -0.01 0.00 0.34 0.00 0.00 59.36 59.68 1sfl h GLU 143 Cb 0.75 0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 29.45 1sfl h GLU 143 CO -0.25 1.12 0.17 -0.07 -1.16 0.00 0.00 179.01 178.82 1sfl h LEU 144 N 0.59 0.45 -1.25 1.33 3.38 0.40 -0.94 115.31 119.28 1sfl h LEU 144 Ca 0.01 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 57.83 1sfl h LEU 144 Cb 1.14 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.76 1sfl h LEU 144 CO 0.12 0.44 0.15 -0.61 0.09 0.00 0.00 178.44 178.63 1sfl h GLN 145 N 0.42 0.67 -0.14 1.13 4.15 -0.92 -1.94 115.11 118.48 1sfl h GLN 145 Ca 0.12 -0.11 -0.13 0.00 0.77 0.00 0.00 58.65 59.30 1sfl h GLN 145 Cb 0.11 -0.12 -0.01 0.00 0.21 0.00 0.00 27.48 27.67 1sfl h GLN 145 CO -0.02 0.58 -0.48 0.35 -1.93 0.00 0.00 178.83 177.33 1sfl h PHE 146 N 0.66 0.43 -0.17 3.99 3.57 -0.81 -0.39 116.94 124.22 1sfl h PHE 146 Ca 0.16 -0.14 -0.01 0.00 3.53 0.00 0.00 57.97 61.50 1sfl h PHE 146 Cb 0.19 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 38.83 1sfl h PHE 146 CO 0.01 0.77 0.05 0.82 -2.23 0.00 0.00 178.31 177.73 1sfl h ILE 147 N 0.29 1.19 -1.00 1.41 1.08 -0.65 -1.95 117.51 117.88 1sfl h ILE 147 Ca 0.01 -0.60 0.03 0.00 -0.39 0.00 0.00 64.86 63.91 1sfl h ILE 147 Cb 0.96 1.28 -0.06 0.00 -3.07 0.00 0.00 36.82 35.94 1sfl h ILE 147 CO 0.08 0.18 0.65 -0.26 -0.69 0.00 0.00 178.15 178.12 1sfl h PHE 148 N 0.08 1.23 -0.07 1.37 0.05 -1.19 -1.97 116.94 116.45 1sfl h PHE 148 Ca 0.05 0.03 0.00 0.00 3.82 0.00 0.00 57.97 61.87 1sfl h PHE 148 Cb 0.24 -0.41 -0.00 0.00 2.00 0.00 0.00 35.95 37.78 1sfl h PHE 148 CO 0.00 0.73 0.04 0.35 -0.18 0.00 0.00 178.31 179.25 1sfl h PHE 149 N 1.28 0.08 -0.26 -0.55 3.57 -0.79 -1.72 116.94 118.56 1sfl h PHE 149 Ca 0.39 0.00 -0.10 0.00 3.53 0.00 0.00 57.97 61.79 1sfl h PHE 149 Cb -0.04 -0.03 -0.01 0.00 2.79 0.00 0.00 35.95 38.66 1sfl h PHE 149 CO -0.00 0.06 -0.25 0.87 -2.23 0.00 0.00 178.31 176.75 1sfl h LYS 150 N 0.09 0.49 -0.26 1.11 1.57 -1.09 -2.69 116.57 115.78 1sfl h LYS 150 Ca 0.02 -0.19 -0.08 0.00 -1.87 0.00 0.00 60.65 58.54 1sfl h LYS 150 Cb -0.01 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 1sfl h LYS 150 CO -0.01 0.71 -0.15 0.52 -0.57 0.00 0.00 179.45 179.95 1sfl h MET 151 N 0.43 0.56 0.00 3.15 2.86 -1.23 -2.90 114.93 117.81 1sfl h MET 151 Ca 0.06 -0.26 0.00 0.00 -2.06 0.00 0.00 59.70 57.44 1sfl h MET 151 Cb 0.67 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.32 1sfl h MET 151 CO 0.05 0.83 0.00 0.00 1.06 0.00 0.00 176.91 178.85 1sfl n GLN 152 N -4.43 0.16 0.31 1.72 -0.00 -0.66 -2.49 117.38 111.99 1sfl n GLN 152 Ca -0.04 0.39 0.17 0.00 -0.00 0.00 0.00 57.00 57.53 1sfl n GLN 152 Cb 0.38 -1.80 1.00 0.00 -0.00 0.00 0.00 30.24 29.81 1sfl n GLN 152 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.06 177.93 1sfl h LYS 153 N 0.00 0.00 -0.00 2.61 1.79 -1.26 0.15 116.57 119.86 1sfl h LYS 153 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 1sfl h LYS 153 Cb 0.34 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.99 1sfl h LYS 153 CO 0.00 0.01 -0.02 1.19 -1.08 0.00 0.00 179.45 179.55 1sfl n PHE 154 N -3.56 0.00 -3.62 -1.35 3.01 -1.04 -4.94 117.46 105.97 1sfl n PHE 154 Ca -0.03 0.00 -0.21 0.00 1.01 0.00 0.00 57.45 58.22 1sfl n PHE 154 Cb 0.10 -0.09 0.05 0.00 -0.01 0.00 0.00 39.48 39.53 1sfl n PHE 154 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 1sfl n ASN 155 N -0.87 -2.11 -3.76 4.37 5.03 0.51 -4.91 115.26 113.52 1sfl n ASN 155 Ca 0.20 -0.79 -0.28 0.00 0.87 0.00 0.00 54.58 54.58 1sfl n ASN 155 Cb 0.20 -4.28 0.20 0.00 -1.02 0.00 0.00 39.78 34.88 1sfl n ASN 155 CO 0.00 0.00 0.00 -0.81 -1.83 0.00 0.00 177.26 174.62 1sfl n PRO 156 N -4.15 -1.34 0.02 3.52 -0.04 -1.26 -4.99 135.00 126.76 1sfl n PRO 156 Ca -0.26 -1.91 -0.11 0.00 -0.04 0.00 0.00 63.50 61.18 1sfl n PRO 156 Cb 0.67 -1.30 -0.14 0.00 -0.04 0.00 0.00 33.50 32.69 1sfl n PRO 156 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1sfl h GLU 157 N 0.00 0.07 -4.13 0.54 3.07 -1.25 -3.46 114.58 109.43 1sfl h GLU 157 Ca -0.40 -0.13 -0.23 0.00 -0.50 0.00 0.00 59.36 58.10 1sfl h GLU 157 Cb 1.11 0.05 -0.23 0.00 -0.84 0.00 0.00 28.75 28.84 1sfl h GLU 157 CO 0.28 0.80 -0.72 0.71 -1.40 0.00 0.00 179.01 178.69 1sfl s TYR 158 N -2.63 0.34 -0.11 4.33 2.02 -0.36 -2.17 117.35 118.78 1sfl s TYR 158 Ca -0.06 -0.38 0.03 0.00 -0.37 0.00 0.00 57.07 56.30 1sfl s TYR 158 Cb 0.08 -0.22 -0.00 0.00 -0.40 0.00 0.00 41.96 41.42 1sfl s TYR 158 CO 0.83 -0.11 -0.22 0.14 -1.57 0.00 0.00 175.55 174.62 1sfl s VAL 159 N -1.02 2.19 -0.13 0.71 -7.23 -0.51 -1.54 120.40 112.88 1sfl s VAL 159 Ca -0.09 -0.97 0.01 0.00 -1.81 0.00 0.00 61.98 59.12 1sfl s VAL 159 Cb -0.07 -1.85 0.02 0.00 0.56 0.00 0.00 36.38 35.04 1sfl s VAL 159 CO -0.00 0.55 -0.16 -0.75 -0.31 0.00 0.00 175.10 174.43 1sfl s LYS 160 N 0.38 2.38 -0.15 4.82 2.20 0.91 -0.90 119.74 129.39 1sfl s LYS 160 Ca -0.17 -0.61 0.00 0.00 -0.36 0.00 0.00 55.97 54.83 1sfl s LYS 160 Cb -0.18 -2.06 0.03 0.00 -1.51 0.00 0.00 37.83 34.11 1sfl s LYS 160 CO 0.08 -0.12 -0.12 -1.17 -0.36 0.00 0.00 175.35 173.66 1sfl s LEU 161 N 1.14 1.63 -0.13 5.43 2.96 -0.38 -0.33 118.68 129.00 1sfl s LEU 161 Ca -0.02 -0.49 0.01 0.00 -0.22 0.00 0.00 54.13 53.41 1sfl s LEU 161 Cb -0.14 -1.10 -0.00 0.00 0.50 0.00 0.00 46.19 45.44 1sfl s LEU 161 CO -0.05 -0.08 -0.18 0.00 -1.32 0.00 0.00 176.35 174.72 1sfl s ALA 162 N 1.53 2.42 0.13 5.97 0.00 -0.26 -0.50 121.76 131.05 1sfl s ALA 162 Ca 0.04 -0.97 0.04 0.00 0.00 0.00 0.00 51.96 51.07 1sfl s ALA 162 Cb -0.13 -1.07 -0.04 0.00 0.00 0.00 0.00 23.12 21.87 1sfl s ALA 162 CO -0.10 0.16 -0.09 0.14 0.00 0.00 0.00 175.76 175.87 1sfl s VAL 163 N 0.51 1.05 -0.26 0.00 -7.23 0.42 -0.69 120.40 114.20 1sfl s VAL 163 Ca -0.12 -1.99 -0.09 0.00 -1.81 0.00 0.00 61.98 57.97 1sfl s VAL 163 Cb -0.16 -1.76 -0.04 0.00 0.56 0.00 0.00 36.38 34.98 1sfl s VAL 163 CO 0.05 -0.75 0.12 -0.32 -0.31 0.00 0.00 175.10 173.88 1sfl s MET 164 N -3.66 3.79 0.31 4.82 1.75 -0.69 -0.48 119.30 125.14 1sfl s MET 164 Ca 0.14 -0.41 -0.20 0.00 -1.25 0.00 0.00 55.69 53.98 1sfl s MET 164 Cb 0.03 -3.45 -0.09 0.00 2.84 0.00 0.00 34.83 34.15 1sfl s MET 164 CO -0.01 -0.16 0.82 -1.25 -0.65 0.00 0.00 175.02 173.77 1sfl s PRO 165 N 1.61 4.25 0.00 4.11 0.04 -1.26 -1.74 135.00 142.01 1sfl s PRO 165 Ca 0.06 0.96 0.04 0.00 0.04 0.00 0.00 61.00 62.11 1sfl s PRO 165 Cb -0.15 -2.61 -0.04 0.00 0.04 0.00 0.00 34.50 31.74 1sfl s PRO 165 CO 0.06 0.23 0.22 0.72 0.04 0.00 0.00 177.00 178.27 1sfl n HIS 166 N 0.14 0.00 -3.82 0.56 8.25 -1.26 -4.99 115.22 114.10 1sfl n HIS 166 Ca 0.02 0.00 -0.06 0.00 -0.26 0.00 0.00 57.72 57.42 1sfl n HIS 166 Cb 0.52 0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.63 1sfl n HIS 166 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1sfl s ASN 167 N -1.32 -0.12 0.25 0.41 2.20 -1.26 -5.04 114.94 110.05 1sfl s ASN 167 Ca 0.02 -0.72 -0.06 0.00 -0.94 0.00 0.00 52.86 51.16 1sfl s ASN 167 Cb 0.03 0.67 0.26 0.00 -2.00 0.00 0.00 41.25 40.21 1sfl s ASN 167 CO 0.17 -1.28 1.89 0.11 -2.94 0.00 0.00 177.10 175.05 1sfl h LYS 168 N 2.00 1.25 -0.28 3.55 1.57 -1.97 -2.51 116.57 120.17 1sfl h LYS 168 Ca -0.25 -0.12 -0.01 0.00 -1.87 0.00 0.00 60.65 58.40 1sfl h LYS 168 Cb 1.24 -0.26 -0.01 0.00 0.08 0.00 0.00 32.23 33.28 1sfl h LYS 168 CO 0.31 0.88 0.14 -0.91 -0.57 0.00 0.00 179.45 179.29 1sfl h ASN 169 N 1.27 0.34 -0.40 0.86 2.35 -1.99 -1.30 115.58 116.71 1sfl h ASN 169 Ca 0.33 -0.02 -0.06 0.00 -0.55 0.00 0.00 56.30 55.99 1sfl h ASN 169 Cb -0.04 -0.09 -0.02 0.00 0.05 0.00 0.00 38.32 38.22 1sfl h ASN 169 CO -0.06 0.29 0.04 0.44 -1.65 0.00 0.00 177.43 176.49 1sfl h ASP 170 N 0.39 0.73 -0.13 5.81 3.32 -1.84 0.98 116.42 125.69 1sfl h ASP 170 Ca 0.10 -0.16 -0.05 0.00 0.02 0.00 0.00 57.03 56.94 1sfl h ASP 170 Cb 0.04 -0.19 -0.00 0.00 0.22 0.00 0.00 39.33 39.39 1sfl h ASP 170 CO -0.01 0.78 -0.11 0.58 -1.72 0.00 0.00 179.24 178.75 1sfl h VAL 171 N 0.73 1.34 -0.87 -1.35 2.07 -1.24 -2.46 116.25 114.47 1sfl h VAL 171 Ca 0.15 -1.24 0.00 0.00 0.82 0.00 0.00 66.70 66.43 1sfl h VAL 171 Cb 0.39 1.87 -0.04 0.00 -1.52 0.00 0.00 31.29 31.99 1sfl h VAL 171 CO 0.01 0.36 0.56 -0.07 0.02 0.00 0.00 177.57 178.45 1sfl h LEU 172 N -0.06 1.01 -0.62 2.57 3.38 -0.99 -1.14 115.31 119.46 1sfl h LEU 172 Ca 0.02 -0.04 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 1sfl h LEU 172 Cb 0.62 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.09 1sfl h LEU 172 CO 0.03 0.75 0.29 0.78 0.09 0.00 0.00 178.44 180.38 1sfl h ASN 173 N 1.18 0.82 -0.34 -0.43 -0.26 -0.79 0.17 115.58 115.94 1sfl h ASN 173 Ca 0.32 -0.14 -0.01 0.00 -0.56 0.00 0.00 56.30 55.91 1sfl h ASN 173 Cb -0.11 -0.21 -0.02 0.00 -1.06 0.00 0.00 38.32 36.93 1sfl h ASN 173 CO -0.07 0.73 0.18 0.25 -1.06 0.00 0.00 177.43 177.46 1sfl h LEU 174 N 0.86 0.42 -0.64 1.61 7.12 -0.99 0.11 115.31 123.80 1sfl h LEU 174 Ca 0.21 -0.10 0.00 0.00 0.13 0.00 0.00 57.88 58.13 1sfl h LEU 174 Cb 0.13 -0.11 -0.03 0.00 -0.53 0.00 0.00 40.66 40.12 1sfl h LEU 174 CO -0.03 0.40 0.41 -0.07 -0.13 0.00 0.00 178.44 179.02 1sfl h LEU 175 N 0.42 0.76 -0.47 2.25 3.38 -0.84 -1.86 115.31 118.93 1sfl h LEU 175 Ca 0.12 -0.04 -0.04 0.00 0.09 0.00 0.00 57.88 58.00 1sfl h LEU 175 Cb 0.07 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.61 1sfl h LEU 175 CO -0.02 0.57 0.12 -0.61 0.09 0.00 0.00 178.44 178.60 1sfl h GLN 176 N 0.87 0.75 -0.84 1.13 5.75 -0.28 0.20 115.11 122.70 1sfl h GLN 176 Ca 0.23 -0.18 0.00 0.00 -0.15 0.00 0.00 58.65 58.56 1sfl h GLN 176 Cb -0.06 -0.10 -0.04 0.00 1.07 0.00 0.00 27.48 28.35 1sfl h GLN 176 CO -0.05 0.73 0.53 0.00 -2.65 0.00 0.00 178.83 177.39 1sfl h ALA 177 N 0.99 1.06 -0.25 3.38 0.00 -0.54 0.11 119.26 124.02 1sfl h ALA 177 Ca 0.15 -0.08 -0.10 0.00 0.00 0.00 0.00 54.91 54.88 1sfl h ALA 177 Cb 0.31 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 1sfl h ALA 177 CO 0.00 0.50 -0.25 1.98 0.00 0.00 0.00 179.25 181.48 1sfl h MET 178 N 1.14 0.61 -0.19 0.00 1.85 -1.17 -2.11 114.93 115.06 1sfl h MET 178 Ca 0.30 -0.32 -0.01 0.00 -0.61 0.00 0.00 59.70 59.06 1sfl h MET 178 Cb -0.08 0.01 -0.01 0.00 0.43 0.00 0.00 31.60 31.95 1sfl h MET 178 CO -0.06 0.92 0.10 1.03 -0.40 0.00 0.00 176.91 178.50 1sfl h SER 179 N 0.32 0.25 -0.56 1.39 0.87 -0.60 0.32 113.55 115.54 1sfl h SER 179 Ca 0.04 -0.11 -0.05 0.00 -1.23 0.00 0.00 61.79 60.44 1sfl h SER 179 Cb 0.81 -0.06 -0.03 0.00 -0.44 0.00 0.00 62.40 62.68 1sfl h SER 179 CO 0.06 0.29 0.17 0.74 -0.53 0.00 0.00 176.83 177.56 1sfl h THR 180 N 0.19 1.23 -0.19 2.23 2.02 -0.83 -2.27 112.91 115.29 1sfl h THR 180 Ca 0.07 -0.82 -0.02 0.00 0.77 0.00 0.00 66.41 66.40 1sfl h THR 180 Cb 0.10 0.59 -0.01 0.00 -1.74 0.00 0.00 68.15 67.09 1sfl h THR 180 CO -0.01 0.31 0.03 0.15 0.37 0.00 0.00 175.52 176.37 1sfl h PHE 181 N 0.89 0.34 -0.83 3.16 3.57 -1.14 -2.80 116.94 120.12 1sfl h PHE 181 Ca 0.20 -0.05 0.18 0.00 3.53 0.00 0.00 57.97 61.82 1sfl h PHE 181 Cb 0.28 -0.09 -0.06 0.00 2.79 0.00 0.00 35.95 38.87 1sfl h PHE 181 CO 0.02 0.48 0.55 1.03 -2.23 0.00 0.00 178.31 178.16 1sfl h SER 182 N 0.11 0.40 1.08 0.41 0.87 -0.55 0.00 113.55 115.87 1sfl h SER 182 Ca 0.06 0.03 -0.16 0.00 -1.23 0.00 0.00 61.79 60.48 1sfl h SER 182 Cb 0.32 -0.05 -0.02 0.00 -0.44 0.00 0.00 62.40 62.21 1sfl h SER 182 CO 0.00 0.19 -0.78 0.44 -0.53 0.00 0.00 176.83 176.15 1sfl h ASP 183 N 0.42 0.00 0.00 6.23 3.32 -1.17 -3.40 116.42 121.82 1sfl h ASP 183 Ca 0.42 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 57.35 1sfl h ASP 183 Cb 1.01 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.53 1sfl h ASP 183 CO -0.15 0.78 -1.45 0.35 -1.72 0.00 0.00 179.24 177.06 1sfl n THR 184 N -3.38 0.45 -2.08 0.35 -2.24 -0.82 -5.06 114.28 101.50 1sfl n THR 184 Ca 0.00 -0.25 -0.29 0.00 -2.27 0.00 0.00 64.05 61.24 1sfl n THR 184 Cb 0.82 -0.82 0.03 0.00 -2.10 0.00 0.00 70.33 68.26 1sfl n THR 184 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 1sfl s MET 185 N -2.16 3.19 0.18 -0.78 -1.94 -0.08 -5.02 119.30 112.69 1sfl s MET 185 Ca -0.05 0.42 0.22 0.00 -1.71 0.00 0.00 55.69 54.58 1sfl s MET 185 Cb 0.02 -2.13 -0.03 0.00 2.01 0.00 0.00 34.83 34.70 1sfl s MET 185 CO 0.25 -0.72 1.00 -0.25 -0.01 0.00 0.00 175.02 175.28 1sfl n ASP 186 N -2.75 0.79 -4.98 3.03 9.92 -1.26 -4.89 116.55 116.41 1sfl n ASP 186 Ca 0.05 0.31 -0.19 0.00 -0.53 0.00 0.00 54.79 54.43 1sfl n ASP 186 Cb 0.56 0.54 -0.01 0.00 -0.64 0.00 0.00 41.12 41.57 1sfl n ASP 186 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1sfl s LYS 188 N -4.14 3.08 0.03 0.00 1.02 -0.92 -4.92 119.74 113.89 1sfl s LYS 188 Ca 0.43 1.44 0.05 0.00 0.02 0.00 0.00 55.97 57.92 1sfl s LYS 188 Cb -0.09 -1.98 -0.02 0.00 -0.52 0.00 0.00 37.83 35.21 1sfl s LYS 188 CO 0.31 -1.04 -0.15 0.54 -0.92 0.00 0.00 175.35 174.09 1sfl s VAL 189 N -2.15 1.21 -0.14 3.17 0.11 -1.26 -1.42 120.40 119.92 1sfl s VAL 189 Ca 0.69 -0.96 -0.00 0.00 -2.93 0.00 0.00 61.98 58.77 1sfl s VAL 189 Cb -0.21 -1.07 0.03 0.00 -1.53 0.00 0.00 36.38 33.60 1sfl s VAL 189 CO 0.35 0.10 -0.07 -0.69 -3.33 0.00 0.00 175.10 171.46 1sfl s VAL 190 N -0.74 1.11 -0.16 2.04 1.01 -0.08 -0.08 120.40 123.50 1sfl s VAL 190 Ca 0.03 -0.47 0.00 0.00 0.00 0.00 0.00 61.98 61.54 1sfl s VAL 190 Cb -0.08 -1.19 0.00 0.00 0.00 0.00 0.00 36.38 35.11 1sfl s VAL 190 CO 0.01 0.27 -0.16 -0.83 0.00 0.00 0.00 175.10 174.38 1sfl s GLY 191 N 1.66 1.46 -0.10 4.51 0.00 -1.26 -1.25 107.32 112.34 1sfl s GLY 191 Ca 0.03 -1.08 0.01 0.00 0.00 0.00 0.00 44.72 43.68 1sfl s GLY 191 CO -0.08 0.07 -0.10 -0.42 0.00 0.00 0.00 173.10 172.57 1sfl s ILE 192 N 0.91 1.14 -0.29 0.90 1.01 0.35 -4.73 121.20 120.49 1sfl s ILE 192 Ca -0.04 -0.41 -0.07 0.00 0.00 0.00 0.00 60.65 60.13 1sfl s ILE 192 Cb -0.15 -1.10 0.00 0.00 0.01 0.00 0.00 42.46 41.22 1sfl s ILE 192 CO -0.02 0.37 0.07 -0.55 0.00 0.00 0.00 174.94 174.82 1sfl s SER 193 N 1.24 5.10 0.97 3.58 0.15 -1.26 -0.43 113.70 123.04 1sfl s SER 193 Ca -0.03 -0.62 -0.15 0.00 0.70 0.00 0.00 55.95 55.85 1sfl s SER 193 Cb -0.14 -1.88 0.18 0.00 -1.71 0.00 0.00 66.02 62.47 1sfl s SER 193 CO -0.03 -0.16 1.20 -0.04 1.20 0.00 0.00 173.24 175.40 1sfl s MET 194 N 1.52 0.64 0.15 5.44 1.00 0.37 -4.14 119.30 124.27 1sfl s MET 194 Ca 0.03 -0.02 0.00 0.00 0.00 0.00 0.00 55.69 55.70 1sfl s MET 194 Cb -0.17 -1.81 0.00 0.00 0.00 0.00 0.00 34.83 32.85 1sfl s MET 194 CO 0.02 -2.48 0.00 -1.13 0.00 0.00 0.00 175.02 171.44 1sfl n SER 195 N -3.90 -3.03 0.07 3.03 3.41 -1.26 -2.79 113.62 109.14 1sfl n SER 195 Ca 0.11 0.29 0.00 0.00 -0.26 0.00 0.00 58.87 59.01 1sfl n SER 195 Cb 0.60 -1.59 0.31 0.00 -0.26 0.00 0.00 64.21 63.27 1sfl n SER 195 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 1sfl h LYS 196 N -0.48 0.35 -1.00 4.33 3.64 -1.93 -2.37 116.57 119.11 1sfl h LYS 196 Ca -0.01 -0.10 0.12 0.00 -1.27 0.00 0.00 60.65 59.39 1sfl h LYS 196 Cb 0.47 -0.04 -0.08 0.00 -0.41 0.00 0.00 32.23 32.17 1sfl h LYS 196 CO 0.01 0.50 0.63 1.25 -2.27 0.00 0.00 179.45 179.57 1sfl h LEU 197 N 0.33 0.92 -1.86 5.20 6.46 -1.94 -1.62 115.31 122.80 1sfl h LEU 197 Ca 0.06 0.05 0.00 0.00 -0.12 0.00 0.00 57.88 57.87 1sfl h LEU 197 Cb 0.46 -0.14 0.00 0.00 -0.73 0.00 0.00 40.66 40.25 1sfl h LEU 197 CO 0.03 0.49 0.00 0.61 -0.62 0.00 0.00 178.44 178.95 1sfl n GLY 198 N -1.35 1.37 0.32 3.75 0.00 -0.90 -4.55 105.19 103.82 1sfl n GLY 198 Ca 0.19 -0.53 0.15 0.00 0.00 0.00 0.00 46.02 45.82 1sfl n GLY 198 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1sfl h LEU 199 N 2.84 0.45 -1.79 0.99 5.85 -1.19 -1.53 115.31 120.93 1sfl h LEU 199 Ca 0.00 0.15 0.21 0.00 0.84 0.00 0.00 57.88 59.08 1sfl h LEU 199 Cb 0.71 0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.79 1sfl h LEU 199 CO 0.02 0.03 0.56 -0.29 -0.34 0.00 0.00 178.44 178.43 1sfl h ILE 200 N 0.46 0.65 -0.17 4.05 -0.00 -1.83 -0.81 117.51 119.86 1sfl h ILE 200 Ca 0.59 -0.06 -0.08 0.00 -0.00 0.00 0.00 64.86 65.31 1sfl h ILE 200 Cb 1.13 0.46 -0.01 0.00 -0.00 0.00 0.00 36.82 38.40 1sfl h ILE 200 CO -0.51 0.03 -0.26 0.77 -0.00 0.00 0.00 178.15 178.18 1sfl h SER 201 N 0.18 0.32 0.35 2.19 4.64 -1.58 -0.26 113.55 119.39 1sfl h SER 201 Ca 0.40 -0.10 -0.32 0.00 -0.47 0.00 0.00 61.79 61.30 1sfl h SER 201 Cb 1.30 -0.09 0.02 0.00 -0.31 0.00 0.00 62.40 63.33 1sfl h SER 201 CO -0.08 0.58 -1.48 0.03 -0.87 0.00 0.00 176.83 175.02 1sfl h ARG 202 N 0.29 0.44 0.17 4.77 3.08 -1.29 -2.64 114.38 119.19 1sfl h ARG 202 Ca 0.04 -0.75 -0.30 0.00 0.07 0.00 0.00 59.98 59.05 1sfl h ARG 202 Cb 0.61 0.28 0.03 0.00 0.08 0.00 0.00 29.97 30.97 1sfl h ARG 202 CO 0.04 1.35 -1.29 1.79 -1.07 0.00 0.00 179.97 180.80 1sfl h THR 203 N 0.12 1.30 -0.70 2.04 1.35 -1.44 -3.32 112.91 112.26 1sfl h THR 203 Ca -0.24 -2.54 -0.29 0.00 -0.55 0.00 0.00 66.41 62.79 1sfl h THR 203 Cb 2.11 2.86 -0.17 0.00 -1.73 0.00 0.00 68.15 71.21 1sfl h THR 203 CO 0.24 0.76 0.30 0.00 -0.25 0.00 0.00 175.52 176.57 1sfl n ALA 204 N -2.69 4.73 -0.27 6.62 0.00 -0.11 -4.29 120.51 124.49 1sfl n ALA 204 Ca -0.15 -2.70 0.08 0.00 0.00 0.00 0.00 53.44 50.67 1sfl n ALA 204 Cb 1.01 -1.16 0.22 0.00 0.00 0.00 0.00 19.45 19.52 1sfl n ALA 204 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 1sfl h GLN 205 N 1.68 0.25 0.00 0.00 5.75 -1.57 -1.20 115.11 120.03 1sfl h GLN 205 Ca 0.36 -0.02 -0.06 0.00 -0.15 0.00 0.00 58.65 58.78 1sfl h GLN 205 Cb 2.30 -0.06 -0.01 0.00 1.07 0.00 0.00 27.48 30.78 1sfl h GLN 205 CO 0.74 0.17 -0.30 0.78 -2.65 0.00 0.00 178.83 177.57 1sfl h GLY 206 N 0.26 0.00 1.67 2.39 0.00 -1.84 -0.29 103.07 105.26 1sfl h GLY 206 Ca 0.47 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.75 1sfl h GLY 206 CO -0.56 0.00 -0.03 -2.08 0.00 0.00 0.00 176.54 173.87 1sfl h VAL 207 N 0.00 1.18 -0.77 4.60 2.07 -1.56 -2.90 116.25 118.87 1sfl h VAL 207 Ca -0.00 -0.73 -0.42 0.00 0.82 0.00 0.00 66.70 66.36 1sfl h VAL 207 Cb 0.59 1.01 -0.24 0.00 -1.52 0.00 0.00 31.29 31.13 1sfl h VAL 207 CO 0.04 0.24 0.38 0.49 0.02 0.00 0.00 177.57 178.74 1sfl n PHE 208 N -4.29 2.42 -0.94 1.57 3.72 -1.05 -4.91 117.46 113.97 1sfl n PHE 208 Ca 0.01 -1.90 0.00 0.00 -0.05 0.00 0.00 57.45 55.50 1sfl n PHE 208 Cb 0.24 -0.83 0.00 0.00 -0.94 0.00 0.00 39.48 37.95 1sfl n PHE 208 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1sfl n GLY 209 N -1.11 0.92 3.76 1.37 0.00 -1.10 -3.10 105.19 105.94 1sfl n GLY 209 Ca 0.51 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.18 1sfl n GLY 209 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1sfl s GLY 210 N -1.95 2.45 -0.06 -0.02 0.00 -0.15 -4.57 107.32 103.02 1sfl s GLY 210 Ca 0.00 0.78 0.13 0.00 0.00 0.00 0.00 44.72 45.63 1sfl s GLY 210 CO 0.00 1.15 0.20 0.00 0.00 0.00 0.00 173.10 174.45 1sfl n ALA 211 N -1.99 2.18 -2.79 3.20 0.00 0.88 -4.25 120.51 117.74 1sfl n ALA 211 Ca 0.12 -0.53 -0.15 0.00 0.00 0.00 0.00 53.44 52.88 1sfl n ALA 211 Cb 0.51 -0.29 -0.12 0.00 0.00 0.00 0.00 19.45 19.55 1sfl n ALA 211 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1sfl s LEU 212 N -4.34 2.23 -0.05 0.00 1.02 -1.26 -1.25 118.68 115.03 1sfl s LEU 212 Ca -0.05 -0.51 -0.02 0.00 0.02 0.00 0.00 54.13 53.56 1sfl s LEU 212 Cb 0.07 -0.30 0.04 0.00 0.02 0.00 0.00 46.19 46.01 1sfl s LEU 212 CO 0.55 -0.12 0.09 0.28 0.02 0.00 0.00 176.35 177.17 1sfl s THR 213 N -1.18 -0.12 -0.02 5.49 -1.32 -0.91 -4.81 115.64 112.78 1sfl s THR 213 Ca -0.06 0.31 -0.16 0.00 -1.21 0.00 0.00 61.69 60.57 1sfl s THR 213 Cb -0.09 -0.18 -0.06 0.00 -1.51 0.00 0.00 72.50 70.66 1sfl s THR 213 CO 0.01 0.13 0.44 -0.31 -2.21 0.00 0.00 174.62 172.67 1sfl s TYR 214 N 1.71 3.69 0.31 9.09 1.51 -1.26 -0.93 117.35 131.47 1sfl s TYR 214 Ca -0.02 1.00 0.05 0.00 -1.01 0.00 0.00 57.07 57.09 1sfl s TYR 214 Cb -0.12 -2.36 -0.03 0.00 -0.11 0.00 0.00 41.96 39.33 1sfl s TYR 214 CO -0.04 0.54 0.22 0.20 -1.11 0.00 0.00 175.55 175.36 1sfl s GLY 215 N -0.74 2.16 0.52 0.71 0.00 0.16 -4.66 107.32 105.47 1sfl s GLY 215 Ca 0.24 -1.89 0.02 0.00 0.00 0.00 0.00 44.72 43.09 1sfl s GLY 215 CO 0.13 -1.51 0.07 0.00 0.00 0.00 0.00 173.10 171.80 1sfl n ILE 217 N -1.36 0.63 0.11 0.00 -0.00 -1.26 -1.72 119.36 115.76 1sfl n ILE 217 Ca -0.17 -0.52 0.00 0.00 -0.00 0.00 0.00 62.75 62.07 1sfl n ILE 217 Cb 0.67 -0.35 0.00 0.00 -0.00 0.00 0.00 39.64 39.96 1sfl n ILE 217 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 1sfl n GLY 218 N 1.94 -0.23 3.14 7.39 0.00 -1.26 -4.95 105.19 111.22 1sfl n GLY 218 Ca -0.16 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.68 1sfl n GLY 218 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1sfl s GLU 219 N -2.00 0.78 0.13 1.61 2.56 -1.26 -4.96 118.70 115.57 1sfl s GLU 219 Ca 0.00 -0.86 -0.34 0.00 0.00 0.00 0.00 54.97 53.77 1sfl s GLU 219 Cb 0.00 -0.74 -0.17 0.00 2.00 0.00 0.00 34.13 35.22 1sfl s GLU 219 CO 0.00 0.17 0.99 -2.30 -0.56 0.00 0.00 175.26 173.56 1sfl n PRO 220 N 1.48 0.59 0.00 4.30 -0.02 -1.26 -4.81 135.00 135.28 1sfl n PRO 220 Ca -0.21 0.21 0.04 0.00 -2.02 0.00 0.00 63.50 61.52 1sfl n PRO 220 Cb 0.54 -1.60 0.03 0.00 -0.02 0.00 0.00 33.50 32.46 1sfl n PRO 220 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 1sfl n GLN 221 N 1.50 0.29 -3.96 -0.52 -0.06 -1.26 -4.80 117.38 108.58 1sfl n GLN 221 Ca 0.17 -0.91 -0.12 0.00 -2.00 0.00 0.00 57.00 54.14 1sfl n GLN 221 Cb 0.20 -1.13 -0.01 0.00 -4.06 0.00 0.00 30.24 25.24 1sfl n GLN 221 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1sfl s ALA 222 N -0.69 0.06 -0.85 1.69 0.00 -1.26 -5.05 121.76 115.66 1sfl s ALA 222 Ca 0.09 -1.16 -0.16 0.00 0.00 0.00 0.00 51.96 50.73 1sfl s ALA 222 Cb 0.06 0.94 -0.25 0.00 0.00 0.00 0.00 23.12 23.87 1sfl s ALA 222 CO 0.10 -0.88 2.04 -2.30 0.00 0.00 0.00 175.76 174.72 1sfl n PRO 223 N -0.55 0.00 -3.47 0.00 -0.02 -1.26 -2.70 135.00 127.00 1sfl n PRO 223 Ca -0.03 0.00 -0.31 0.00 -2.02 0.00 0.00 63.50 61.14 1sfl n PRO 223 Cb 0.61 -1.04 0.03 0.00 -0.02 0.00 0.00 33.50 33.08 1sfl n PRO 223 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1sfl n GLY 224 N 5.06 -0.39 3.80 -1.23 0.00 -1.26 -4.64 105.19 106.54 1sfl n GLY 224 Ca 0.57 1.03 -0.31 0.00 0.00 0.00 0.00 46.02 47.32 1sfl n GLY 224 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1sfl s GLN 225 N -3.03 2.67 0.08 1.61 -0.21 -1.10 -4.98 119.66 114.70 1sfl s GLN 225 Ca 0.27 1.01 0.06 0.00 0.02 0.00 0.00 55.36 56.72 1sfl s GLN 225 Cb -0.03 -1.95 -0.04 0.00 1.00 0.00 0.00 33.01 31.98 1sfl s GLN 225 CO 0.86 -1.31 -0.09 0.42 -2.12 0.00 0.00 175.29 173.06 1sfl s ILE 226 N -3.00 3.46 0.33 1.08 1.01 -1.26 -4.40 121.20 118.41 1sfl s ILE 226 Ca 0.59 -1.15 -0.29 0.00 0.00 0.00 0.00 60.65 59.80 1sfl s ILE 226 Cb -0.15 -2.60 -0.11 0.00 0.01 0.00 0.00 42.46 39.62 1sfl s ILE 226 CO 0.55 0.17 1.41 -0.62 0.00 0.00 0.00 174.94 176.46 1sfl s ASP 227 N -2.05 6.56 0.56 3.58 2.15 -1.26 -1.04 116.67 125.17 1sfl s ASP 227 Ca 0.21 2.84 0.26 0.00 0.43 0.00 0.00 52.55 56.29 1sfl s ASP 227 Cb -0.11 -2.65 1.53 0.00 -0.30 0.00 0.00 42.92 41.39 1sfl s ASP 227 CO 0.13 -0.71 2.08 -0.37 -0.17 0.00 0.00 175.17 176.12 1sfl h VAL 228 N 3.11 0.61 -0.49 1.11 -1.51 -1.64 -0.85 116.25 116.59 1sfl h VAL 228 Ca -0.49 0.00 -0.07 0.00 -1.23 0.00 0.00 66.70 64.91 1sfl h VAL 228 Cb 1.23 0.83 -0.02 0.00 -2.13 0.00 0.00 31.29 31.20 1sfl h VAL 228 CO 0.68 0.00 0.03 0.74 -1.23 0.00 0.00 177.57 177.79 1sfl h THR 229 N 0.00 1.26 -0.13 7.19 2.02 -1.88 0.69 112.91 122.06 1sfl h THR 229 Ca 0.12 -1.01 -0.17 0.00 0.77 0.00 0.00 66.41 66.12 1sfl h THR 229 Cb 0.57 0.96 -0.01 0.00 -1.74 0.00 0.00 68.15 67.93 1sfl h THR 229 CO -0.00 0.36 -0.63 0.44 0.37 0.00 0.00 175.52 176.05 1sfl h ASP 230 N 0.70 0.56 -0.47 4.18 3.32 -1.61 -2.23 116.42 120.87 1sfl h ASP 230 Ca 0.14 -0.33 -0.13 0.00 0.02 0.00 0.00 57.03 56.74 1sfl h ASP 230 Cb 0.46 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.84 1sfl h ASP 230 CO 0.02 1.05 -0.19 0.25 -1.72 0.00 0.00 179.24 178.65 1sfl h LEU 231 N 0.36 1.00 -0.81 1.55 5.85 -0.87 -0.75 115.31 121.64 1sfl h LEU 231 Ca -0.01 -0.36 -0.01 0.00 0.84 0.00 0.00 57.88 58.33 1sfl h LEU 231 Cb 1.19 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 41.90 1sfl h LEU 231 CO 0.11 1.15 0.46 0.50 -0.34 0.00 0.00 178.44 180.33 1sfl h LYS 232 N 0.85 1.12 -0.88 1.25 1.63 0.51 -0.33 116.57 120.72 1sfl h LYS 232 Ca 0.12 -0.12 -0.01 0.00 -0.85 0.00 0.00 60.65 59.79 1sfl h LYS 232 Cb 0.76 -0.22 -0.04 0.00 -0.60 0.00 0.00 32.23 32.12 1sfl h LYS 232 CO 0.06 0.81 0.53 0.00 -3.45 0.00 0.00 179.45 177.40 1sfl h ALA 233 N 1.24 1.28 0.20 5.00 0.00 -0.94 -1.26 119.26 124.79 1sfl h ALA 233 Ca 0.29 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 55.09 1sfl h ALA 233 Cb 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.44 1sfl h ALA 233 CO -0.05 0.62 -0.10 1.96 0.00 0.00 0.00 179.25 181.69 1sfl h GLN 234 N 1.21 -0.26 -0.72 0.00 1.08 -0.05 -1.63 115.11 114.74 1sfl h GLN 234 Ca 0.32 0.02 0.09 0.00 -1.45 0.00 0.00 58.65 57.63 1sfl h GLN 234 Cb -0.05 0.06 -0.05 0.00 -0.05 0.00 0.00 27.48 27.39 1sfl h GLN 234 CO -0.06 -0.05 0.47 0.28 -0.95 0.00 0.00 178.83 178.52 1sfl h VAL 235 N -0.43 0.93 0.00 -0.54 2.07 -0.86 -0.53 116.25 116.88 1sfl h VAL 235 Ca -0.03 -0.21 -0.09 0.00 0.82 0.00 0.00 66.70 67.20 1sfl h VAL 235 Cb 0.33 0.27 -0.01 0.00 -1.52 0.00 0.00 31.29 30.36 1sfl h VAL 235 CO 0.05 0.11 -0.42 0.74 0.02 0.00 0.00 177.57 178.07 1sfl h THR 236 N 0.61 0.97 -0.07 2.57 2.02 -1.00 -3.17 112.91 114.84 1sfl h THR 236 Ca 0.33 -1.63 -0.17 0.00 0.77 0.00 0.00 66.41 65.70 1sfl h THR 236 Cb 0.47 1.98 -0.01 0.00 -1.74 0.00 0.00 68.15 68.85 1sfl h THR 236 CO -0.11 0.41 -0.71 0.25 0.37 0.00 0.00 175.52 175.73 1sfl h LEU 237 N 0.00 0.40 -1.92 2.58 5.85 -0.11 -3.51 115.31 118.60 1sfl h LEU 237 Ca -0.00 -0.26 0.00 0.00 0.84 0.00 0.00 57.88 58.46 1sfl h LEU 237 Cb 0.94 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.85 1sfl h LEU 237 CO 0.05 0.98 0.00 -1.22 -0.34 0.00 0.00 178.44 177.92