#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1t60 n GLY 5 N 0.00 0.79 3.68 -1.41 0.00 -1.26 -5.10 105.19 101.88 1t60 n GLY 5 Ca 0.00 -0.63 -0.37 0.00 0.00 0.00 0.00 46.02 45.03 1t60 n GLY 5 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1t60 s PHE 6 N -1.63 3.34 -0.05 1.61 2.99 -1.23 -4.99 117.98 118.03 1t60 s PHE 6 Ca 0.00 0.32 -0.01 0.00 0.00 0.00 0.00 56.93 57.23 1t60 s PHE 6 Cb 0.00 -2.30 -0.04 0.00 0.00 0.00 0.00 43.02 40.69 1t60 s PHE 6 CO 0.00 0.10 0.04 -0.51 -0.00 0.00 0.00 175.22 174.85 1t60 s LEU 7 N 0.97 3.76 -0.09 -0.37 1.43 -1.26 0.17 118.68 123.29 1t60 s LEU 7 Ca 0.10 0.15 0.02 0.00 -1.03 0.00 0.00 54.13 53.37 1t60 s LEU 7 Cb -0.13 -2.04 0.01 0.00 0.03 0.00 0.00 46.19 44.06 1t60 s LEU 7 CO 0.04 0.33 -0.15 -0.69 0.23 0.00 0.00 176.35 176.11 1t60 s VAL 8 N -1.04 1.38 -0.10 -1.59 1.01 0.22 -4.88 120.40 115.39 1t60 s VAL 8 Ca 0.18 -0.60 0.00 0.00 0.00 0.00 0.00 61.98 61.56 1t60 s VAL 8 Cb -0.12 -1.25 -0.02 0.00 0.00 0.00 0.00 36.38 34.99 1t60 s VAL 8 CO 0.08 0.41 -0.10 -0.89 0.00 0.00 0.00 175.10 174.60 1t60 s THR 9 N 0.77 3.37 0.04 3.92 2.01 -1.25 0.31 115.64 124.82 1t60 s THR 9 Ca -0.12 -0.57 0.05 0.00 0.31 0.00 0.00 61.69 61.36 1t60 s THR 9 Cb -0.16 -2.40 -0.02 0.00 0.01 0.00 0.00 72.50 69.93 1t60 s THR 9 CO 0.02 0.55 -0.14 -0.60 -0.69 0.00 0.00 174.62 173.76 1t60 s ARG 10 N -0.15 0.93 -0.11 4.92 3.52 -0.67 -4.79 118.95 122.60 1t60 s ARG 10 Ca 0.01 -0.79 0.03 0.00 -0.13 0.00 0.00 55.73 54.85 1t60 s ARG 10 Cb -0.13 -0.94 0.01 0.00 -1.56 0.00 0.00 34.95 32.32 1t60 s ARG 10 CO 0.03 0.23 -0.20 -1.01 -0.81 0.00 0.00 175.30 173.54 1t60 s HIS 11 N -0.90 2.33 -0.15 5.12 3.76 -1.26 -1.16 115.29 123.03 1t60 s HIS 11 Ca 0.01 -1.03 0.18 0.00 -0.15 0.00 0.00 55.06 54.07 1t60 s HIS 11 Cb -0.08 -1.60 0.25 0.00 1.11 0.00 0.00 32.58 32.26 1t60 s HIS 11 CO 0.01 -0.45 1.53 0.66 -0.85 0.00 0.00 174.74 175.64 1t60 h SER 12 N 7.00 0.00 -2.27 1.40 4.64 -1.39 -3.46 113.55 119.47 1t60 h SER 12 Ca -0.26 0.00 -0.39 0.00 -0.47 0.00 0.00 61.79 60.67 1t60 h SER 12 Cb 1.21 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 63.25 1t60 h SER 12 CO 0.49 0.38 -0.46 0.00 -0.87 0.00 0.00 176.83 176.37 1t60 n GLN 13 N -3.24 -1.49 -4.07 4.77 6.02 -1.26 -4.95 117.38 113.17 1t60 n GLN 13 Ca 0.02 1.00 -0.13 0.00 -0.01 0.00 0.00 57.00 57.88 1t60 n GLN 13 Cb 0.65 -5.51 -0.05 0.00 1.02 0.00 0.00 30.24 26.36 1t60 n GLN 13 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1t60 s THR 14 N -2.90 0.00 -1.00 5.09 -4.23 -1.26 -4.12 115.64 107.22 1t60 s THR 14 Ca 0.00 -1.57 0.25 0.00 -1.18 0.00 0.00 61.69 59.19 1t60 s THR 14 Cb 0.00 -2.55 0.20 0.00 1.34 0.00 0.00 72.50 71.49 1t60 s THR 14 CO 0.00 0.00 1.79 0.35 -0.54 0.00 0.00 174.62 176.22 1t60 n THR 15 N -0.51 0.31 -3.47 3.99 -2.24 -1.26 -1.79 114.28 109.31 1t60 n THR 15 Ca 0.00 0.07 -0.35 0.00 -2.27 0.00 0.00 64.05 61.51 1t60 n THR 15 Cb 0.62 -0.65 -0.06 0.00 -2.10 0.00 0.00 70.33 68.14 1t60 n THR 15 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1t60 s ASP 16 N -3.01 6.73 0.42 3.42 1.01 -1.26 -4.79 116.67 119.18 1t60 s ASP 16 Ca 0.12 0.93 -0.26 0.00 0.71 0.00 0.00 52.55 54.05 1t60 s ASP 16 Cb 0.16 -2.23 -0.08 0.00 1.01 0.00 0.00 42.92 41.78 1t60 s ASP 16 CO 0.45 0.14 1.29 -1.81 0.21 0.00 0.00 175.17 175.45 1t60 s ASP 17 N -1.75 6.24 0.48 0.27 1.01 -1.26 -4.50 116.67 117.16 1t60 s ASP 17 Ca 0.35 2.63 -0.12 0.00 0.71 0.00 0.00 52.55 56.13 1t60 s ASP 17 Cb -0.14 -2.64 -0.06 0.00 1.01 0.00 0.00 42.92 41.09 1t60 s ASP 17 CO 0.19 -0.89 0.88 -2.16 0.21 0.00 0.00 175.17 173.39 1t60 s PRO 18 N -2.31 3.79 0.07 8.23 0.04 -1.26 -4.97 135.00 138.59 1t60 s PRO 18 Ca 0.58 0.65 -0.13 0.00 0.04 0.00 0.00 61.00 62.14 1t60 s PRO 18 Cb -0.37 -2.26 -0.06 0.00 0.04 0.00 0.00 34.50 31.84 1t60 s PRO 18 CO 0.48 -0.20 0.45 -0.65 0.04 0.00 0.00 177.00 177.12 1t60 s GLN 19 N -4.17 3.89 0.33 4.56 -0.21 -1.26 -4.69 119.66 118.11 1t60 s GLN 19 Ca 0.54 0.37 -0.29 0.00 0.02 0.00 0.00 55.36 56.00 1t60 s GLN 19 Cb -0.10 -3.07 -0.11 0.00 1.00 0.00 0.00 33.01 30.73 1t60 s GLN 19 CO 0.35 0.59 1.40 0.00 -2.12 0.00 0.00 175.29 175.52 1t60 s PRO 21 N -1.62 0.75 0.15 0.00 0.04 -1.26 -4.86 135.00 128.20 1t60 s PRO 21 Ca 0.53 1.29 -0.31 0.00 0.04 0.00 0.00 61.00 62.55 1t60 s PRO 21 Cb -0.43 -1.71 -0.11 0.00 0.04 0.00 0.00 34.50 32.29 1t60 s PRO 21 CO 0.55 -2.73 1.71 -1.25 0.04 0.00 0.00 177.00 175.32 1t60 s PRO 22 N -4.66 4.16 0.00 0.56 0.04 -1.26 -2.14 135.00 131.69 1t60 s PRO 22 Ca 0.66 2.51 0.00 0.00 0.04 0.00 0.00 61.00 64.22 1t60 s PRO 22 Cb -0.22 -3.32 0.00 0.00 0.04 0.00 0.00 34.50 30.99 1t60 s PRO 22 CO 0.59 -0.75 0.00 0.41 0.04 0.00 0.00 177.00 177.29 1t60 n GLY 23 N 4.01 0.62 3.18 0.56 0.00 -1.26 -5.02 105.19 107.28 1t60 n GLY 23 Ca 0.16 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.96 1t60 n GLY 23 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1t60 s THR 24 N -2.00 1.28 -0.10 2.61 -4.23 -0.91 -4.32 115.64 107.96 1t60 s THR 24 Ca 0.00 -1.06 -0.00 0.00 -1.18 0.00 0.00 61.69 59.44 1t60 s THR 24 Cb 0.00 -1.14 -0.03 0.00 1.34 0.00 0.00 72.50 72.67 1t60 s THR 24 CO 0.00 0.06 -0.07 -1.59 -0.54 0.00 0.00 174.62 172.47 1t60 s LYS 25 N -1.16 3.10 0.33 3.99 -2.85 -0.51 -4.71 119.74 117.93 1t60 s LYS 25 Ca 0.03 -0.57 -0.28 0.00 -1.00 0.00 0.00 55.97 54.15 1t60 s LYS 25 Cb -0.08 -2.68 -0.10 0.00 -2.06 0.00 0.00 37.83 32.91 1t60 s LYS 25 CO 0.01 0.47 1.24 -1.50 0.10 0.00 0.00 175.35 175.68 1t60 s ILE 26 N -0.30 2.94 -0.19 3.79 2.07 -1.26 0.66 121.20 128.92 1t60 s ILE 26 Ca 0.04 0.92 -0.01 0.00 -1.41 0.00 0.00 60.65 60.19 1t60 s ILE 26 Cb -0.13 -3.58 -0.11 0.00 0.13 0.00 0.00 42.46 38.78 1t60 s ILE 26 CO 0.02 0.20 -0.19 0.18 -1.91 0.00 0.00 174.94 173.25 1t60 n LEU 27 N 0.77 2.59 -3.60 8.50 4.77 0.71 -4.85 117.00 125.89 1t60 n LEU 27 Ca 0.00 -0.01 -0.03 0.00 -0.03 0.00 0.00 56.01 55.94 1t60 n LEU 27 Cb 0.43 -0.63 -0.02 0.00 -2.33 0.00 0.00 43.42 40.88 1t60 n LEU 27 CO 0.57 0.71 1.01 -0.72 -1.33 0.00 0.00 177.39 177.62 1t60 s TYR 28 N -2.37 -0.12 0.36 -1.77 -0.85 -1.18 -5.03 117.35 106.40 1t60 s TYR 28 Ca -0.25 0.05 0.08 0.00 -0.52 0.00 0.00 57.07 56.43 1t60 s TYR 28 Cb 0.07 0.52 -0.04 0.00 0.38 0.00 0.00 41.96 42.90 1t60 s TYR 28 CO 0.40 -0.24 0.18 -1.01 -1.52 0.00 0.00 175.55 173.37 1t60 s HIS 29 N -2.45 2.71 0.00 -3.49 3.76 -1.26 -1.16 115.29 113.39 1t60 s HIS 29 Ca 0.10 -0.41 0.00 0.00 -0.15 0.00 0.00 55.06 54.60 1t60 s HIS 29 Cb 0.00 -1.74 0.00 0.00 1.11 0.00 0.00 32.58 31.95 1t60 s HIS 29 CO -0.05 0.27 0.00 0.41 -0.85 0.00 0.00 174.74 174.52 1t60 n GLY 30 N -1.21 1.61 3.74 -2.22 0.00 -1.00 -4.60 105.19 101.50 1t60 n GLY 30 Ca -0.02 -0.72 -0.33 0.00 0.00 0.00 0.00 46.02 44.95 1t60 n GLY 30 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1t60 s TYR 31 N -3.08 3.20 -0.68 1.61 1.51 0.13 -1.24 117.35 118.79 1t60 s TYR 31 Ca 0.00 0.16 -0.27 0.00 -1.01 0.00 0.00 57.07 55.95 1t60 s TYR 31 Cb 0.00 -1.72 0.01 0.00 -0.11 0.00 0.00 41.96 40.14 1t60 s TYR 31 CO 0.00 0.51 1.51 -1.12 -1.11 0.00 0.00 175.55 175.34 1t60 s SER 32 N -1.61 5.82 -0.19 2.29 0.01 -0.68 -1.55 113.70 117.79 1t60 s SER 32 Ca 0.21 -0.12 -0.19 0.00 1.31 0.00 0.00 55.95 57.15 1t60 s SER 32 Cb -0.12 -2.55 -0.03 0.00 0.21 0.00 0.00 66.02 63.53 1t60 s SER 32 CO 0.12 -2.04 0.55 -0.22 0.41 0.00 0.00 173.24 172.06 1t60 s LEU 33 N 7.02 4.16 -0.17 2.44 2.96 0.62 -1.35 118.68 134.37 1t60 s LEU 33 Ca 0.48 0.75 -0.15 0.00 -0.22 0.00 0.00 54.13 54.99 1t60 s LEU 33 Cb -0.10 -2.77 -0.11 0.00 0.50 0.00 0.00 46.19 43.71 1t60 s LEU 33 CO 0.18 -0.19 0.03 0.25 -1.32 0.00 0.00 176.35 175.30 1t60 h LEU 34 N 7.87 0.00 -7.65 -0.68 5.85 -1.11 -3.41 115.31 116.17 1t60 h LEU 34 Ca -0.34 -0.26 0.20 0.00 0.84 0.00 0.00 57.88 58.32 1t60 h LEU 34 Cb 1.15 0.00 -0.08 0.00 0.37 0.00 0.00 40.66 42.11 1t60 h LEU 34 CO 0.75 1.09 0.57 -0.72 -0.34 0.00 0.00 178.44 179.79 1t60 s TYR 35 N -2.27 -0.07 0.29 1.25 1.13 -1.07 -2.24 117.35 114.36 1t60 s TYR 35 Ca -0.21 -0.22 0.04 0.00 -1.41 0.00 0.00 57.07 55.27 1t60 s TYR 35 Cb 0.04 0.64 -0.06 0.00 -1.10 0.00 0.00 41.96 41.47 1t60 s TYR 35 CO 0.40 -0.75 0.02 0.14 -2.51 0.00 0.00 175.55 172.84 1t60 s VAL 36 N -2.91 1.25 -0.14 -3.49 -7.23 -0.25 -0.19 120.40 107.44 1t60 s VAL 36 Ca 0.15 -2.03 -0.04 0.00 -1.81 0.00 0.00 61.98 58.24 1t60 s VAL 36 Cb -0.01 -2.62 0.06 0.00 0.56 0.00 0.00 36.38 34.37 1t60 s VAL 36 CO 0.02 -0.14 0.11 -1.58 -0.31 0.00 0.00 175.10 173.20 1t60 s GLN 37 N -3.85 0.05 -0.08 4.82 0.74 -0.28 -0.53 119.66 120.52 1t60 s GLN 37 Ca 0.33 0.14 0.03 0.00 0.05 0.00 0.00 55.36 55.91 1t60 s GLN 37 Cb 0.07 -1.26 0.01 0.00 1.10 0.00 0.00 33.01 32.92 1t60 s GLN 37 CO 0.13 -0.55 -0.18 0.20 -0.55 0.00 0.00 175.29 174.34 1t60 s GLY 38 N 2.19 1.05 -1.50 2.59 0.00 -0.33 -1.06 107.32 110.26 1t60 s GLY 38 Ca 0.04 -0.69 -0.11 0.00 0.00 0.00 0.00 44.72 43.96 1t60 s GLY 38 CO -0.08 -0.12 0.89 -2.01 0.00 0.00 0.00 173.10 171.78 1t60 n ASN 39 N 3.63 -3.76 -0.54 1.64 4.05 -1.26 -1.62 115.26 117.41 1t60 n ASN 39 Ca -0.21 -0.82 -0.07 0.00 0.45 0.00 0.00 54.58 53.93 1t60 n ASN 39 Cb 0.52 -3.78 -0.03 0.00 1.23 0.00 0.00 39.78 37.72 1t60 n ASN 39 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 1t60 n GLU 40 N -4.57 -0.88 -4.61 1.20 1.02 -1.26 -5.01 120.64 106.53 1t60 n GLU 40 Ca -0.04 0.66 -0.32 0.00 -0.02 0.00 0.00 57.16 57.44 1t60 n GLU 40 Cb 0.56 -4.56 -0.17 0.00 -0.02 0.00 0.00 31.44 27.25 1t60 n GLU 40 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 1t60 s ARG 41 N -2.24 2.88 0.29 3.49 3.52 -0.64 -5.04 118.95 121.21 1t60 s ARG 41 Ca 0.00 -0.80 -0.23 0.00 -0.13 0.00 0.00 55.73 54.57 1t60 s ARG 41 Cb 0.00 -2.34 -0.09 0.00 -1.56 0.00 0.00 34.95 30.95 1t60 s ARG 41 CO 0.00 -0.03 0.86 0.00 -0.81 0.00 0.00 175.30 175.32 1t60 s ALA 42 N 0.86 3.27 -0.18 6.12 0.00 -1.26 -1.19 121.76 129.38 1t60 s ALA 42 Ca -0.07 0.38 -0.04 0.00 0.00 0.00 0.00 51.96 52.23 1t60 s ALA 42 Cb -0.15 -3.05 0.09 0.00 0.00 0.00 0.00 23.12 20.01 1t60 s ALA 42 CO -0.02 0.23 0.28 -1.58 0.00 0.00 0.00 175.76 174.67 1t60 s HIS 43 N -1.63 -0.47 0.50 0.00 2.46 0.30 -4.93 115.29 111.53 1t60 s HIS 43 Ca 0.49 0.68 0.08 0.00 0.47 0.00 0.00 55.06 56.77 1t60 s HIS 43 Cb -0.17 -0.13 0.05 0.00 -0.13 0.00 0.00 32.58 32.19 1t60 s HIS 43 CO 0.22 -0.53 0.68 0.20 -2.47 0.00 0.00 174.74 172.84 1t60 s GLY 44 N 2.42 1.85 -0.16 1.59 0.00 -1.26 -1.09 107.32 110.66 1t60 s GLY 44 Ca 0.06 -1.84 0.00 0.00 0.00 0.00 0.00 44.72 42.95 1t60 s GLY 44 CO -0.12 -1.53 -0.12 1.20 0.00 0.00 0.00 173.10 172.54 1t60 s GLN 45 N -4.53 2.12 -0.12 2.90 -1.52 -0.95 -4.97 119.66 112.60 1t60 s GLN 45 Ca 0.58 -0.62 -0.37 0.00 -1.95 0.00 0.00 55.36 53.00 1t60 s GLN 45 Cb -0.08 -2.15 -0.15 0.00 -0.22 0.00 0.00 33.01 30.41 1t60 s GLN 45 CO 0.36 -0.30 1.68 -3.47 -0.25 0.00 0.00 175.29 173.31 1t60 n ASP 46 N 4.76 2.56 0.10 5.90 2.03 -1.26 -4.63 116.55 126.01 1t60 n ASP 46 Ca -0.16 1.06 0.06 0.00 0.52 0.00 0.00 54.79 56.27 1t60 n ASP 46 Cb 0.49 -1.23 0.33 0.00 -0.72 0.00 0.00 41.12 39.99 1t60 n ASP 46 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 1t60 n LEU 47 N 4.93 0.31 -0.26 -2.67 4.77 -1.26 -0.69 117.00 122.13 1t60 n LEU 47 Ca 0.23 0.61 0.12 0.00 -0.03 0.00 0.00 56.01 56.94 1t60 n LEU 47 Cb 0.19 -0.63 0.21 0.00 -2.33 0.00 0.00 43.42 40.86 1t60 n LEU 47 CO 0.74 -0.71 0.46 0.61 -1.33 0.00 0.00 177.39 177.16 1t60 n GLY 48 N -1.35 -0.55 3.85 -0.72 0.00 -1.26 -4.42 105.19 100.74 1t60 n GLY 48 Ca -0.01 -0.48 -0.24 0.00 0.00 0.00 0.00 46.02 45.29 1t60 n GLY 48 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1t60 s THR 49 N -2.61 4.68 0.57 2.61 -4.23 0.13 -3.85 115.64 112.95 1t60 s THR 49 Ca 0.19 -1.15 0.35 0.00 -1.18 0.00 0.00 61.69 59.91 1t60 s THR 49 Cb 0.18 -3.47 0.38 0.00 1.34 0.00 0.00 72.50 70.94 1t60 s THR 49 CO 0.59 -0.23 2.26 0.00 -0.54 0.00 0.00 174.62 176.70 1t60 h ALA 50 N 1.84 1.27 0.00 3.99 0.00 -1.91 -2.10 119.26 122.35 1t60 h ALA 50 Ca -0.49 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1t60 h ALA 50 Cb 1.22 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1t60 h ALA 50 CO 0.63 0.02 0.00 0.78 0.00 0.00 0.00 179.25 180.68 1t60 h GLY 51 N 0.23 0.00 -1.07 0.00 0.00 -1.95 0.99 103.07 101.27 1t60 h GLY 51 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1t60 h GLY 51 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.40 1t60 n SER 52 N -2.80 1.81 -3.86 0.19 3.41 -0.79 -4.63 113.62 106.95 1t60 n SER 52 Ca -0.02 -1.85 -0.30 0.00 -0.26 0.00 0.00 58.87 56.44 1t60 n SER 52 Cb 0.08 -0.17 -0.15 0.00 -0.26 0.00 0.00 64.21 63.71 1t60 n SER 52 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1t60 s LEU 54 N 1.09 4.41 0.45 0.00 1.02 -0.59 -4.80 118.68 120.26 1t60 s LEU 54 Ca 0.11 0.71 0.17 0.00 0.02 0.00 0.00 54.13 55.14 1t60 s LEU 54 Cb -0.19 -2.35 1.03 0.00 0.02 0.00 0.00 46.19 44.70 1t60 s LEU 54 CO -0.14 0.33 1.97 0.03 0.02 0.00 0.00 176.35 178.56 1t60 h ARG 55 N 5.07 0.00 -5.71 1.70 3.08 -1.88 0.38 114.38 117.02 1t60 h ARG 55 Ca -0.52 0.00 -0.54 0.00 0.07 0.00 0.00 59.98 58.99 1t60 h ARG 55 Cb 1.22 0.00 -0.28 0.00 0.08 0.00 0.00 29.97 30.98 1t60 h ARG 55 CO 0.62 0.22 -0.83 0.15 -1.07 0.00 0.00 179.97 179.05 1t60 s LYS 56 N -4.42 1.36 0.14 0.04 1.02 -1.26 -4.73 119.74 111.89 1t60 s LYS 56 Ca -0.03 -0.70 -0.01 0.00 0.02 0.00 0.00 55.97 55.24 1t60 s LYS 56 Cb 0.15 -1.35 -0.05 0.00 -0.52 0.00 0.00 37.83 36.06 1t60 s LYS 56 CO 0.68 0.36 0.33 0.12 -0.92 0.00 0.00 175.35 175.92 1t60 s PHE 57 N -0.53 3.49 -0.23 3.18 5.36 -1.26 -4.89 117.98 123.10 1t60 s PHE 57 Ca 0.06 0.36 -0.27 0.00 -0.96 0.00 0.00 56.93 56.12 1t60 s PHE 57 Cb -0.07 -1.86 0.12 0.00 -0.34 0.00 0.00 43.02 40.87 1t60 s PHE 57 CO 0.00 0.47 0.99 0.45 -1.46 0.00 0.00 175.22 175.67 1t60 s SER 58 N -2.77 -0.45 0.45 6.13 0.15 -1.26 -5.00 113.70 110.95 1t60 s SER 58 Ca 0.38 0.74 0.30 0.00 0.70 0.00 0.00 55.95 58.07 1t60 s SER 58 Cb -0.12 0.70 1.24 0.00 -1.71 0.00 0.00 66.02 66.14 1t60 s SER 58 CO 0.27 -0.24 1.89 0.71 1.20 0.00 0.00 173.24 177.07 1t60 h THR 59 N 3.25 0.00 -2.16 6.45 1.35 -1.95 -3.32 112.91 116.54 1t60 h THR 59 Ca -0.25 -0.40 -0.53 0.00 -0.55 0.00 0.00 66.41 64.68 1t60 h THR 59 Cb 1.17 1.30 -0.35 0.00 -1.73 0.00 0.00 68.15 68.54 1t60 h THR 59 CO 0.19 0.00 -0.91 0.80 -0.25 0.00 0.00 175.52 175.34 1t60 n MET 60 N -2.77 0.24 0.00 4.72 0.00 -1.26 -4.03 117.12 114.02 1t60 n MET 60 Ca 0.01 -3.01 0.00 0.00 -0.00 0.00 0.00 57.70 54.70 1t60 n MET 60 Cb 0.27 -1.63 0.00 0.00 0.00 0.00 0.00 33.22 31.86 1t60 n MET 60 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 175.97 175.62 1t60 n PRO 61 N 2.82 0.82 -4.05 2.12 -0.04 -1.25 -4.85 135.00 130.57 1t60 n PRO 61 Ca 0.28 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.64 1t60 n PRO 61 Cb 0.49 -1.11 -0.06 0.00 -0.04 0.00 0.00 33.50 32.77 1t60 n PRO 61 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1t60 s PHE 62 N -1.72 0.56 0.23 0.54 -0.71 -1.26 -5.09 117.98 110.54 1t60 s PHE 62 Ca 0.00 -0.89 0.00 0.00 -1.04 0.00 0.00 56.93 55.00 1t60 s PHE 62 Cb 0.00 0.01 -0.04 0.00 -1.21 0.00 0.00 43.02 41.79 1t60 s PHE 62 CO 0.00 -0.92 0.18 -0.48 -1.34 0.00 0.00 175.22 172.67 1t60 s LEU 63 N -3.06 1.25 0.14 -1.99 0.05 -1.26 -4.56 118.68 109.24 1t60 s LEU 63 Ca 0.26 -1.46 0.07 0.00 0.05 0.00 0.00 54.13 53.06 1t60 s LEU 63 Cb 0.01 0.50 -0.04 0.00 -2.05 0.00 0.00 46.19 44.61 1t60 s LEU 63 CO 0.10 -0.91 -0.15 0.72 -0.55 0.00 0.00 176.35 175.56 1t60 s PHE 64 N -3.97 1.54 0.01 3.48 -0.12 -0.94 -4.99 117.98 112.99 1t60 s PHE 64 Ca 0.39 -0.53 0.04 0.00 -0.05 0.00 0.00 56.93 56.78 1t60 s PHE 64 Cb 0.06 -0.79 -0.02 0.00 -0.63 0.00 0.00 43.02 41.64 1t60 s PHE 64 CO 0.16 0.21 -0.13 0.00 -0.05 0.00 0.00 175.22 175.40 1t60 s ASN 66 N -0.72 4.81 0.00 0.00 2.20 -0.24 -4.97 114.94 116.02 1t60 s ASN 66 Ca 0.03 -1.09 0.12 0.00 -0.94 0.00 0.00 52.86 50.98 1t60 s ASN 66 Cb -0.06 0.31 0.56 0.00 -2.00 0.00 0.00 41.25 40.06 1t60 s ASN 66 CO 0.00 -1.15 1.29 2.30 -2.94 0.00 0.00 177.10 176.61 1t60 n ILE 67 N -1.90 0.82 -0.39 0.54 -6.64 -1.26 -1.54 119.36 108.99 1t60 n ILE 67 Ca 0.04 0.21 0.10 0.00 -1.77 0.00 0.00 62.75 61.33 1t60 n ILE 67 Cb 0.63 -1.01 0.33 0.00 -1.44 0.00 0.00 39.64 38.15 1t60 n ILE 67 CO 0.00 0.00 0.00 0.59 -1.77 0.00 0.00 176.55 175.37 1t60 n ASN 68 N -1.33 4.24 -2.75 7.28 3.02 -1.26 -4.92 115.26 119.53 1t60 n ASN 68 Ca 0.05 -2.24 -0.20 0.00 -0.03 0.00 0.00 54.58 52.16 1t60 n ASN 68 Cb 0.10 -0.53 0.03 0.00 -0.61 0.00 0.00 39.78 38.78 1t60 n ASN 68 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1t60 n ASN 69 N 1.30 -5.77 -4.34 6.41 2.85 -0.59 -5.00 115.26 110.13 1t60 n ASN 69 Ca 0.24 -0.25 -0.32 0.00 -0.11 0.00 0.00 54.58 54.14 1t60 n ASN 69 Cb 0.74 -4.60 -0.15 0.00 1.24 0.00 0.00 39.78 37.01 1t60 n ASN 69 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 1t60 s VAL 70 N -3.12 2.68 0.11 3.44 1.01 -1.25 -4.94 120.40 118.32 1t60 s VAL 70 Ca 0.27 -0.81 0.07 0.00 0.00 0.00 0.00 61.98 61.51 1t60 s VAL 70 Cb -0.12 -2.07 -0.04 0.00 0.00 0.00 0.00 36.38 34.15 1t60 s VAL 70 CO 0.33 0.55 -0.11 0.00 0.00 0.00 0.00 175.10 175.87 1t60 s ASN 72 N -2.22 2.12 -0.17 0.00 0.01 0.42 -4.98 114.94 110.11 1t60 s ASN 72 Ca 0.21 -0.35 0.01 0.00 -0.71 0.00 0.00 52.86 52.02 1t60 s ASN 72 Cb -0.11 -0.67 0.02 0.00 0.41 0.00 0.00 41.25 40.90 1t60 s ASN 72 CO 0.13 0.13 -0.20 0.12 -1.51 0.00 0.00 177.10 175.77 1t60 s PHE 73 N 0.16 2.76 -1.20 2.20 5.36 -1.26 -2.23 117.98 123.76 1t60 s PHE 73 Ca -0.06 -1.61 0.00 0.00 -0.96 0.00 0.00 56.93 54.30 1t60 s PHE 73 Cb -0.12 -1.90 0.00 0.00 -0.34 0.00 0.00 43.02 40.65 1t60 s PHE 73 CO 0.03 -0.78 0.00 0.00 -1.46 0.00 0.00 175.22 173.00 1t60 n ALA 74 N 4.55 -0.51 0.04 11.12 0.00 -1.26 -4.82 120.51 129.63 1t60 n ALA 74 Ca -0.21 0.15 0.07 0.00 0.00 0.00 0.00 53.44 53.46 1t60 n ALA 74 Cb 0.50 -1.45 -0.08 0.00 0.00 0.00 0.00 19.45 18.42 1t60 n ALA 74 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1t60 n SER 75 N -1.19 0.51 -0.02 0.00 7.64 -1.26 -4.65 113.62 114.67 1t60 n SER 75 Ca -0.14 0.21 0.00 0.00 1.01 0.00 0.00 58.87 59.95 1t60 n SER 75 Cb 0.52 0.93 0.00 0.00 -1.01 0.00 0.00 64.21 64.66 1t60 n SER 75 CO 0.00 0.00 0.00 -1.14 -3.01 0.00 0.00 175.04 170.89 1t60 n ARG 76 N -2.59 3.15 -3.16 1.43 0.63 -1.26 -5.06 116.66 109.80 1t60 n ARG 76 Ca -0.06 0.00 -0.24 0.00 -0.92 0.00 0.00 57.85 56.63 1t60 n ARG 76 Cb 0.66 0.00 -0.05 0.00 0.45 0.00 0.00 32.46 33.52 1t60 n ARG 76 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 1t60 n ASN 77 N 0.00 2.74 -4.99 6.15 3.02 -1.26 -4.83 115.26 116.09 1t60 n ASN 77 Ca 0.00 -3.31 -0.18 0.00 -0.03 0.00 0.00 54.58 51.06 1t60 n ASN 77 Cb 0.00 -0.61 0.01 0.00 -0.61 0.00 0.00 39.78 38.57 1t60 n ASN 77 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1t60 s ASP 78 N -2.62 5.42 0.14 6.41 -0.00 -1.26 -4.88 116.67 119.89 1t60 s ASP 78 Ca 0.42 -0.58 0.03 0.00 -0.00 0.00 0.00 52.55 52.42 1t60 s ASP 78 Cb 0.25 -0.44 -0.04 0.00 -0.00 0.00 0.00 42.92 42.69 1t60 s ASP 78 CO -0.09 -0.86 -0.05 -0.31 -0.00 0.00 0.00 175.17 173.86 1t60 s TYR 79 N -2.44 1.15 0.01 4.23 1.51 -0.22 -2.58 117.35 119.00 1t60 s TYR 79 Ca 0.54 -0.90 0.01 0.00 -1.01 0.00 0.00 57.07 55.71 1t60 s TYR 79 Cb -0.08 -0.63 -0.01 0.00 -0.11 0.00 0.00 41.96 41.13 1t60 s TYR 79 CO 0.33 -0.09 -0.03 -1.54 -1.11 0.00 0.00 175.55 173.11 1t60 s SER 80 N -3.14 0.29 -0.05 2.29 1.04 -0.93 -1.12 113.70 112.08 1t60 s SER 80 Ca 0.18 -0.23 0.02 0.00 0.48 0.00 0.00 55.95 56.41 1t60 s SER 80 Cb 0.05 0.02 0.01 0.00 0.10 0.00 0.00 66.02 66.20 1t60 s SER 80 CO 0.00 -0.10 -0.12 -0.31 0.98 0.00 0.00 173.24 173.70 1t60 s TYR 81 N -0.61 1.36 0.03 5.02 2.02 0.73 -1.04 117.35 124.86 1t60 s TYR 81 Ca -0.05 -0.46 0.06 0.00 -0.37 0.00 0.00 57.07 56.25 1t60 s TYR 81 Cb -0.04 -0.99 -0.02 0.00 -0.40 0.00 0.00 41.96 40.51 1t60 s TYR 81 CO -0.00 -0.23 -0.18 -1.58 -1.57 0.00 0.00 175.55 172.00 1t60 s TRP 82 N 0.52 1.54 0.40 2.71 0.52 -1.00 -0.54 118.94 123.09 1t60 s TRP 82 Ca -0.11 -0.34 -0.27 0.00 0.02 0.00 0.00 56.10 55.39 1t60 s TRP 82 Cb -0.14 -0.93 -0.10 0.00 -1.15 0.00 0.00 33.47 31.15 1t60 s TRP 82 CO 0.03 0.05 1.47 -1.17 0.02 0.00 0.00 176.95 177.35 1t60 s LEU 83 N -0.99 4.25 0.51 2.99 2.96 -0.46 -0.86 118.68 127.08 1t60 s LEU 83 Ca 0.05 3.02 0.05 0.00 -0.22 0.00 0.00 54.13 57.04 1t60 s LEU 83 Cb -0.08 -3.76 0.01 0.00 0.50 0.00 0.00 46.19 42.86 1t60 s LEU 83 CO 0.01 -0.99 0.31 -0.94 -1.32 0.00 0.00 176.35 173.42 1t60 s SER 84 N -0.26 4.57 0.44 3.68 1.04 -0.13 -1.15 113.70 121.89 1t60 s SER 84 Ca 0.56 -1.22 0.06 0.00 0.48 0.00 0.00 55.95 55.82 1t60 s SER 84 Cb -0.46 0.18 0.06 0.00 0.10 0.00 0.00 66.02 65.90 1t60 s SER 84 CO 0.61 -0.93 0.46 0.35 0.98 0.00 0.00 173.24 174.71 1t60 n THR 85 N -1.59 0.00 1.35 2.02 -2.24 -0.74 -4.49 114.28 108.59 1t60 n THR 85 Ca -0.03 -1.63 0.12 0.00 -2.27 0.00 0.00 64.05 60.23 1t60 n THR 85 Cb 0.64 -0.34 0.67 0.00 -2.10 0.00 0.00 70.33 69.20 1t60 n THR 85 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 1t60 n PRO 86 N -1.72 0.59 -1.63 -0.78 -0.02 -1.26 -4.87 135.00 125.30 1t60 n PRO 86 Ca 0.05 0.03 -0.54 0.00 -2.02 0.00 0.00 63.50 61.02 1t60 n PRO 86 Cb 0.48 -1.50 -0.06 0.00 -0.02 0.00 0.00 33.50 32.40 1t60 n PRO 86 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1t60 n GLU 87 N -1.12 1.13 -2.64 -0.52 4.07 -1.26 -4.92 120.64 115.38 1t60 n GLU 87 Ca 0.15 0.41 -0.37 0.00 -0.06 0.00 0.00 57.16 57.29 1t60 n GLU 87 Cb 0.12 -2.06 -0.05 0.00 -0.06 0.00 0.00 31.44 29.39 1t60 n GLU 87 CO 0.00 0.00 0.00 -2.14 -0.06 0.00 0.00 177.13 174.93 1t60 s PRO 88 N 1.43 4.36 0.59 5.31 0.02 -1.26 -5.01 135.00 140.43 1t60 s PRO 88 Ca 0.89 1.45 -0.18 0.00 0.02 0.00 0.00 61.00 63.18 1t60 s PRO 88 Cb -1.00 -2.67 -0.04 0.00 0.02 0.00 0.00 34.50 30.82 1t60 s PRO 88 CO 0.53 0.04 1.12 -1.64 -0.33 0.00 0.00 177.00 176.72 1t60 s MET 89 N -2.29 3.15 0.72 5.54 -1.94 -1.26 -4.99 119.30 118.22 1t60 s MET 89 Ca 0.54 1.51 -0.13 0.00 -1.71 0.00 0.00 55.69 55.90 1t60 s MET 89 Cb -0.21 -1.99 0.03 0.00 2.01 0.00 0.00 34.83 34.67 1t60 s MET 89 CO 0.26 -0.99 1.11 -2.14 -0.01 0.00 0.00 175.02 173.25 1t60 s PRO 90 N -3.62 2.48 0.56 2.03 0.02 -1.26 -4.88 135.00 130.33 1t60 s PRO 90 Ca 0.70 1.34 0.27 0.00 0.02 0.00 0.00 61.00 63.33 1t60 s PRO 90 Cb -0.22 -1.91 1.64 0.00 0.02 0.00 0.00 34.50 34.02 1t60 s PRO 90 CO 0.33 -1.49 2.19 1.98 -0.33 0.00 0.00 177.00 179.68 1t60 h MET 91 N -0.49 0.00 -0.05 5.54 4.05 -1.98 -1.41 114.93 120.59 1t60 h MET 91 Ca -0.45 0.00 -0.08 0.00 -0.28 0.00 0.00 59.70 58.89 1t60 h MET 91 Cb 1.25 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 32.03 1t60 h MET 91 CO 0.52 0.04 -0.34 0.66 0.23 0.00 0.00 176.91 178.02 1t60 h SER 92 N 0.00 0.09 -0.12 1.39 4.64 -2.03 -3.46 113.55 114.06 1t60 h SER 92 Ca -0.00 -0.03 -0.05 0.00 -0.47 0.00 0.00 61.79 61.24 1t60 h SER 92 Cb 0.09 -0.02 -0.02 0.00 -0.31 0.00 0.00 62.40 62.14 1t60 h SER 92 CO 0.00 0.43 -0.05 0.23 -0.87 0.00 0.00 176.83 176.58 1t60 n MET 93 N -4.11 -1.31 -2.98 4.77 0.00 -0.53 -4.97 117.12 107.98 1t60 n MET 93 Ca -0.02 0.46 -0.33 0.00 0.00 0.00 0.00 57.70 57.82 1t60 n MET 93 Cb 0.40 -4.50 -0.06 0.00 0.00 0.00 0.00 33.22 29.05 1t60 n MET 93 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1t60 s ALA 94 N -1.53 3.20 0.36 3.04 0.00 -1.26 -4.97 121.76 120.60 1t60 s ALA 94 Ca 0.00 0.18 -0.24 0.00 0.00 0.00 0.00 51.96 51.91 1t60 s ALA 94 Cb 0.00 -2.93 -0.14 0.00 0.00 0.00 0.00 23.12 20.05 1t60 s ALA 94 CO 0.00 0.23 0.49 -2.30 0.00 0.00 0.00 175.76 174.18 1t60 n PRO 95 N -0.54 0.42 -3.85 0.00 -0.02 -1.26 -4.87 135.00 124.88 1t60 n PRO 95 Ca 0.05 0.15 -0.37 0.00 -2.02 0.00 0.00 63.50 61.31 1t60 n PRO 95 Cb 0.54 -1.34 -0.06 0.00 -0.02 0.00 0.00 33.50 32.62 1t60 n PRO 95 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1t60 s ILE 96 N -1.38 5.49 0.14 4.25 1.01 0.30 -4.90 121.20 126.11 1t60 s ILE 96 Ca 0.62 0.22 0.00 0.00 0.00 0.00 0.00 60.65 61.50 1t60 s ILE 96 Cb -0.68 -3.42 -0.04 0.00 0.01 0.00 0.00 42.46 38.33 1t60 s ILE 96 CO 0.59 0.60 0.03 0.42 0.00 0.00 0.00 174.94 176.58 1t60 s THR 97 N -0.89 0.35 0.00 2.92 -4.23 -1.26 -1.23 115.64 111.30 1t60 s THR 97 Ca 0.15 -1.93 0.00 0.00 -1.18 0.00 0.00 61.69 58.72 1t60 s THR 97 Cb -0.12 -2.05 0.00 0.00 1.34 0.00 0.00 72.50 71.67 1t60 s THR 97 CO 0.04 -0.50 0.00 0.61 -0.54 0.00 0.00 174.62 174.23 1t60 n GLY 98 N -0.14 2.61 0.31 3.99 0.00 -1.26 -2.22 105.19 108.47 1t60 n GLY 98 Ca -0.06 -0.33 0.18 0.00 0.00 0.00 0.00 46.02 45.82 1t60 n GLY 98 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1t60 h GLU 99 N 0.00 0.00 0.00 1.61 4.57 -1.99 -1.99 114.58 116.78 1t60 h GLU 99 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1t60 h GLU 99 Cb 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.59 1t60 h GLU 99 CO 0.00 0.03 0.00 0.09 -1.18 0.00 0.00 179.01 177.95 1t60 n ASN 100 N -3.36 0.33 0.05 1.04 3.02 -0.94 -2.52 115.26 112.87 1t60 n ASN 100 Ca -0.02 0.60 -0.18 0.00 -0.03 0.00 0.00 54.58 54.95 1t60 n ASN 100 Cb 0.14 -0.66 -0.09 0.00 -0.61 0.00 0.00 39.78 38.56 1t60 n ASN 100 CO 0.00 0.00 0.00 0.40 -2.62 0.00 0.00 177.26 175.04 1t60 h ILE 101 N 0.00 1.31 -0.86 2.41 2.04 -1.46 -3.37 117.51 117.58 1t60 h ILE 101 Ca 0.00 -2.29 0.16 0.00 1.00 0.00 0.00 64.86 63.72 1t60 h ILE 101 Cb 0.21 2.38 -0.15 0.00 -0.74 0.00 0.00 36.82 38.52 1t60 h ILE 101 CO 0.00 0.70 -0.27 -1.14 0.00 0.00 0.00 178.15 177.44 1t60 n ARG 102 N -3.83 -0.13 0.26 2.37 3.00 -1.05 -0.47 116.66 116.81 1t60 n ARG 102 Ca -0.10 1.34 0.16 0.00 -0.00 0.00 0.00 57.85 59.26 1t60 n ARG 102 Cb 0.87 -2.00 0.86 0.00 0.00 0.00 0.00 32.46 32.19 1t60 n ARG 102 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.63 176.28 1t60 h PRO 103 N 0.00 0.00 0.00 -0.14 0.11 -1.80 -2.47 132.00 127.70 1t60 h PRO 103 Ca 0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.47 1t60 h PRO 103 Cb 0.58 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.69 1t60 h PRO 103 CO -0.88 0.00 -0.81 1.19 -0.21 0.00 0.00 178.00 177.30 1t60 n PHE 104 N -2.67 0.13 -3.27 0.65 3.01 0.37 -4.60 117.46 111.09 1t60 n PHE 104 Ca -0.02 0.04 -0.38 0.00 1.01 0.00 0.00 57.45 58.09 1t60 n PHE 104 Cb 0.13 -0.29 -0.06 0.00 -0.01 0.00 0.00 39.48 39.25 1t60 n PHE 104 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 1t60 s ILE 105 N -3.08 5.15 0.56 4.37 -1.09 -0.93 -1.80 121.20 124.38 1t60 s ILE 105 Ca 0.07 1.01 -0.18 0.00 -2.23 0.00 0.00 60.65 59.32 1t60 s ILE 105 Cb 0.16 -3.85 -0.05 0.00 -1.58 0.00 0.00 42.46 37.14 1t60 s ILE 105 CO 0.77 0.28 1.09 -0.55 -1.23 0.00 0.00 174.94 175.30 1t60 s SER 106 N 0.77 5.74 0.25 3.58 0.15 -0.30 -4.41 113.70 119.48 1t60 s SER 106 Ca 0.27 2.01 0.07 0.00 0.70 0.00 0.00 55.95 59.01 1t60 s SER 106 Cb -0.15 -2.56 -0.04 0.00 -1.71 0.00 0.00 66.02 61.56 1t60 s SER 106 CO 0.11 -1.20 0.15 -0.13 1.20 0.00 0.00 173.24 173.37 1t60 s ARG 107 N -3.60 2.79 0.25 5.44 1.81 -0.74 -1.68 118.95 123.22 1t60 s ARG 107 Ca 0.69 -1.12 0.02 0.00 -1.72 0.00 0.00 55.73 53.60 1t60 s ARG 107 Cb -0.20 -2.48 -0.04 0.00 -0.45 0.00 0.00 34.95 31.78 1t60 s ARG 107 CO 0.30 0.40 0.19 0.00 -0.68 0.00 0.00 175.30 175.51 1t60 s ALA 109 N -3.87 -0.31 -0.28 0.00 0.00 -0.31 -2.39 121.76 114.60 1t60 s ALA 109 Ca 0.40 0.60 -0.09 0.00 0.00 0.00 0.00 51.96 52.87 1t60 s ALA 109 Cb 0.05 -0.39 -0.02 0.00 0.00 0.00 0.00 23.12 22.76 1t60 s ALA 109 CO 0.18 -0.13 0.13 0.08 0.00 0.00 0.00 175.76 176.02 1t60 s VAL 110 N 0.80 4.64 0.09 0.00 1.01 -0.31 -1.67 120.40 124.96 1t60 s VAL 110 Ca -0.06 -0.20 0.09 0.00 0.00 0.00 0.00 61.98 61.82 1t60 s VAL 110 Cb -0.08 -3.26 -0.04 0.00 0.00 0.00 0.00 36.38 33.01 1t60 s VAL 110 CO -0.04 0.21 -0.23 0.00 0.00 0.00 0.00 175.10 175.05 1t60 s GLU 112 N -1.79 4.19 0.20 0.00 2.12 0.21 0.72 118.70 124.34 1t60 s GLU 112 Ca 0.15 0.36 0.11 0.00 0.36 0.00 0.00 54.97 55.95 1t60 s GLU 112 Cb -0.10 -3.36 -0.04 0.00 0.26 0.00 0.00 34.13 30.88 1t60 s GLU 112 CO 0.06 0.35 -0.20 0.00 -0.54 0.00 0.00 175.26 174.93 1t60 s ALA 113 N 0.03 2.66 -0.18 6.30 0.00 0.45 -1.42 121.76 129.61 1t60 s ALA 113 Ca 0.23 -1.61 0.22 0.00 0.00 0.00 0.00 51.96 50.80 1t60 s ALA 113 Cb -0.15 -0.43 0.50 0.00 0.00 0.00 0.00 23.12 23.03 1t60 s ALA 113 CO 0.10 0.43 1.65 -1.00 0.00 0.00 0.00 175.76 176.94 1t60 h PRO 114 N 3.05 0.00 -4.58 0.00 0.13 -1.84 -3.26 132.00 125.50 1t60 h PRO 114 Ca -0.46 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.36 1t60 h PRO 114 Cb 1.21 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.21 1t60 h PRO 114 CO 0.50 0.19 -0.50 0.00 -0.23 0.00 0.00 178.00 177.97 1t60 s ALA 115 N -3.28 1.26 0.68 -0.56 0.00 -1.26 -4.67 121.76 113.93 1t60 s ALA 115 Ca 0.04 -1.75 -0.14 0.00 0.00 0.00 0.00 51.96 50.11 1t60 s ALA 115 Cb 0.07 1.37 0.01 0.00 0.00 0.00 0.00 23.12 24.57 1t60 s ALA 115 CO 0.67 -0.66 1.11 1.41 0.00 0.00 0.00 175.76 178.29 1t60 s MET 116 N -3.80 2.72 0.16 0.00 1.75 -1.26 -4.80 119.30 114.07 1t60 s MET 116 Ca 0.38 1.35 0.09 0.00 -1.25 0.00 0.00 55.69 56.26 1t60 s MET 116 Cb 0.04 -1.94 -0.04 0.00 2.84 0.00 0.00 34.83 35.73 1t60 s MET 116 CO 0.18 -1.31 -0.21 0.08 -0.65 0.00 0.00 175.02 173.11 1t60 s VAL 117 N -2.44 1.99 0.22 10.11 1.01 -1.26 -2.77 120.40 127.26 1t60 s VAL 117 Ca 0.66 -1.89 -0.13 0.00 0.00 0.00 0.00 61.98 60.62 1t60 s VAL 117 Cb -0.20 -1.89 0.00 0.00 0.00 0.00 0.00 36.38 34.29 1t60 s VAL 117 CO 0.44 -0.19 0.44 0.00 0.00 0.00 0.00 175.10 175.79 1t60 s MET 118 N -2.58 1.42 0.07 2.72 0.23 0.24 -4.89 119.30 116.51 1t60 s MET 118 Ca 0.16 -1.15 0.09 0.00 -1.03 0.00 0.00 55.69 53.76 1t60 s MET 118 Cb -0.07 0.46 -0.03 0.00 -1.53 0.00 0.00 34.83 33.65 1t60 s MET 118 CO 0.07 -0.58 -0.25 0.00 -2.03 0.00 0.00 175.02 172.23 1t60 s ALA 119 N -3.97 2.15 0.04 3.16 0.00 -0.73 -0.31 121.76 122.11 1t60 s ALA 119 Ca 0.18 -1.28 0.05 0.00 0.00 0.00 0.00 51.96 50.92 1t60 s ALA 119 Cb 0.00 -0.41 -0.02 0.00 0.00 0.00 0.00 23.12 22.69 1t60 s ALA 119 CO 0.04 0.49 -0.16 0.14 0.00 0.00 0.00 175.76 176.28 1t60 s VAL 120 N -0.90 1.25 -0.00 0.00 -7.23 -0.55 -4.59 120.40 108.38 1t60 s VAL 120 Ca 0.11 -1.08 0.06 0.00 -1.81 0.00 0.00 61.98 59.26 1t60 s VAL 120 Cb -0.10 -1.12 -0.02 0.00 0.56 0.00 0.00 36.38 35.70 1t60 s VAL 120 CO 0.03 0.03 -0.19 -1.00 -0.31 0.00 0.00 175.10 173.66 1t60 s HIS 121 N -0.88 1.73 -0.09 2.82 3.76 -1.26 -1.59 115.29 119.77 1t60 s HIS 121 Ca 0.03 -0.34 0.15 0.00 -0.15 0.00 0.00 55.06 54.75 1t60 s HIS 121 Cb -0.08 -1.09 -0.23 0.00 1.11 0.00 0.00 32.58 32.28 1t60 s HIS 121 CO 0.02 -0.00 0.49 -1.13 -0.85 0.00 0.00 174.74 173.27 1t60 n SER 122 N 2.43 0.60 -1.50 1.40 3.41 -0.90 -4.94 113.62 114.13 1t60 n SER 122 Ca -0.16 0.29 -0.14 0.00 -0.26 0.00 0.00 58.87 58.60 1t60 n SER 122 Cb 0.53 0.29 -0.02 0.00 -0.26 0.00 0.00 64.21 64.75 1t60 n SER 122 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1t60 n GLN 123 N -2.94 -1.11 -4.05 4.33 6.02 -1.26 -4.92 117.38 113.45 1t60 n GLN 123 Ca -0.21 0.79 -0.14 0.00 -0.01 0.00 0.00 57.00 57.43 1t60 n GLN 123 Cb 1.07 -5.04 -0.03 0.00 1.02 0.00 0.00 30.24 27.26 1t60 n GLN 123 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 1t60 s THR 124 N -2.67 0.00 -1.87 5.09 -4.23 -1.26 0.29 115.64 110.99 1t60 s THR 124 Ca 0.00 -1.51 0.30 0.00 -1.18 0.00 0.00 61.69 59.30 1t60 s THR 124 Cb 0.00 -2.65 0.66 0.00 1.34 0.00 0.00 72.50 71.85 1t60 s THR 124 CO 0.00 0.00 2.02 2.30 -0.54 0.00 0.00 174.62 178.40 1t60 n ILE 125 N -0.55 0.00 -2.69 2.99 -5.35 -1.26 -2.04 119.36 110.46 1t60 n ILE 125 Ca -0.00 -0.05 -0.35 0.00 -0.27 0.00 0.00 62.75 62.07 1t60 n ILE 125 Cb 0.61 -0.24 -0.05 0.00 -1.74 0.00 0.00 39.64 38.22 1t60 n ILE 125 CO 0.00 0.00 0.00 -1.10 -1.76 0.00 0.00 176.55 173.69 1t60 s GLN 126 N -2.24 4.27 -0.20 6.28 -0.21 -1.26 -4.83 119.66 121.47 1t60 s GLN 126 Ca 0.38 1.34 -0.26 0.00 0.02 0.00 0.00 55.36 56.84 1t60 s GLN 126 Cb 0.21 -2.48 -0.01 0.00 1.00 0.00 0.00 33.01 31.73 1t60 s GLN 126 CO 0.41 -0.02 0.86 0.42 -2.12 0.00 0.00 175.29 174.84 1t60 s ILE 127 N -1.81 4.84 0.13 1.08 -1.09 -1.26 -4.47 121.20 118.61 1t60 s ILE 127 Ca 0.58 1.67 -0.31 0.00 -2.23 0.00 0.00 60.65 60.36 1t60 s ILE 127 Cb -0.17 -4.16 -0.08 0.00 -1.58 0.00 0.00 42.46 36.47 1t60 s ILE 127 CO 0.22 -0.03 1.45 -2.16 -1.23 0.00 0.00 174.94 173.18 1t60 s PRO 128 N 2.50 4.29 0.51 2.79 0.04 -1.26 -4.98 135.00 138.88 1t60 s PRO 128 Ca 0.38 2.16 -0.20 0.00 0.04 0.00 0.00 61.00 63.38 1t60 s PRO 128 Cb -0.16 -3.23 -0.07 0.00 0.04 0.00 0.00 34.50 31.08 1t60 s PRO 128 CO 0.10 -0.49 1.10 -0.65 0.04 0.00 0.00 177.00 177.10 1t60 s GLN 129 N 1.17 3.57 0.67 4.56 -0.21 -1.26 -4.51 119.66 123.65 1t60 s GLN 129 Ca 0.66 1.54 -0.13 0.00 0.02 0.00 0.00 55.36 57.45 1t60 s GLN 129 Cb -0.39 -2.09 0.00 0.00 1.00 0.00 0.00 33.01 31.54 1t60 s GLN 129 CO 0.30 -0.66 1.08 0.00 -2.12 0.00 0.00 175.29 173.89 1t60 s PRO 131 N -4.47 2.17 0.09 0.00 0.02 -1.26 -4.86 135.00 126.68 1t60 s PRO 131 Ca 0.63 1.49 -0.31 0.00 0.02 0.00 0.00 61.00 62.83 1t60 s PRO 131 Cb -0.17 -1.86 -0.10 0.00 0.02 0.00 0.00 34.50 32.39 1t60 s PRO 131 CO 0.46 -1.76 1.85 0.99 -0.33 0.00 0.00 177.00 178.21 1t60 s THR 132 N -2.40 2.76 0.00 0.99 2.01 -1.26 -1.35 115.64 116.40 1t60 s THR 132 Ca 0.68 0.10 0.00 0.00 0.31 0.00 0.00 61.69 62.78 1t60 s THR 132 Cb -0.23 -3.06 0.00 0.00 0.01 0.00 0.00 72.50 69.22 1t60 s THR 132 CO 0.48 -0.00 0.00 0.61 -0.69 0.00 0.00 174.62 175.02 1t60 n GLY 133 N 4.31 0.92 3.20 4.40 0.00 -1.26 -5.09 105.19 111.67 1t60 n GLY 133 Ca 0.18 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 1t60 n GLY 133 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1t60 s TRP 134 N -2.00 2.17 0.29 1.61 0.52 -0.46 -4.54 118.94 116.54 1t60 s TRP 134 Ca 0.00 -0.71 0.00 0.00 0.02 0.00 0.00 56.10 55.41 1t60 s TRP 134 Cb 0.00 -1.45 -0.04 0.00 -1.15 0.00 0.00 33.47 30.83 1t60 s TRP 134 CO 0.00 -0.25 0.49 -1.12 0.02 0.00 0.00 176.95 176.09 1t60 s SER 135 N 0.08 6.33 0.06 2.95 0.01 0.20 -4.67 113.70 118.65 1t60 s SER 135 Ca -0.08 0.41 -0.19 0.00 1.31 0.00 0.00 55.95 57.41 1t60 s SER 135 Cb -0.14 -2.01 -0.06 0.00 0.21 0.00 0.00 66.02 64.01 1t60 s SER 135 CO 0.04 -0.20 0.54 -0.55 0.41 0.00 0.00 173.24 173.49 1t60 s SER 136 N -3.75 7.02 -0.15 2.44 0.15 -1.26 -0.42 113.70 117.73 1t60 s SER 136 Ca 0.39 1.21 0.04 0.00 0.70 0.00 0.00 55.95 58.29 1t60 s SER 136 Cb -0.10 -2.34 -0.12 0.00 -1.71 0.00 0.00 66.02 61.75 1t60 s SER 136 CO 0.33 0.28 -0.09 0.18 1.20 0.00 0.00 173.24 175.13 1t60 n LEU 137 N 1.79 2.14 -3.61 3.45 4.77 0.05 -4.91 117.00 120.68 1t60 n LEU 137 Ca -0.11 -0.06 -0.02 0.00 -0.03 0.00 0.00 56.01 55.79 1t60 n LEU 137 Cb 0.51 -0.32 -0.02 0.00 -2.33 0.00 0.00 43.42 41.27 1t60 n LEU 137 CO 0.41 0.64 1.11 -1.66 -1.33 0.00 0.00 177.39 176.56 1t60 s TRP 138 N -2.32 -0.06 0.26 -1.77 -2.14 -1.21 -4.87 118.94 106.83 1t60 s TRP 138 Ca -0.17 0.02 0.11 0.00 2.66 0.00 0.00 56.10 58.72 1t60 s TRP 138 Cb 0.05 0.51 -0.05 0.00 -3.10 0.00 0.00 33.47 30.89 1t60 s TRP 138 CO 0.41 -0.12 -0.14 0.96 -2.66 0.00 0.00 176.95 175.41 1t60 s ILE 139 N -2.22 2.81 0.00 0.66 -4.36 -1.26 0.15 121.20 116.98 1t60 s ILE 139 Ca 0.12 -2.15 0.00 0.00 -0.26 0.00 0.00 60.65 58.36 1t60 s ILE 139 Cb 0.01 -2.46 0.00 0.00 1.25 0.00 0.00 42.46 41.26 1t60 s ILE 139 CO -0.04 -0.33 0.00 0.61 0.24 0.00 0.00 174.94 175.42 1t60 n GLY 140 N -0.52 2.79 3.34 6.27 0.00 -0.25 -4.44 105.19 112.38 1t60 n GLY 140 Ca -0.07 -0.54 -0.31 0.00 0.00 0.00 0.00 46.02 45.10 1t60 n GLY 140 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1t60 s TYR 141 N -1.73 2.39 -0.53 1.61 1.51 0.15 -1.43 117.35 119.32 1t60 s TYR 141 Ca 0.00 -0.39 -0.27 0.00 -1.01 0.00 0.00 57.07 55.40 1t60 s TYR 141 Cb 0.00 -1.50 -0.03 0.00 -0.11 0.00 0.00 41.96 40.33 1t60 s TYR 141 CO 0.00 0.03 1.93 -1.12 -1.11 0.00 0.00 175.55 175.28 1t60 s SER 142 N -0.77 5.29 -0.30 2.29 0.01 -0.19 -2.15 113.70 117.87 1t60 s SER 142 Ca 0.11 0.68 -0.11 0.00 1.31 0.00 0.00 55.95 57.93 1t60 s SER 142 Cb -0.10 -2.52 -0.03 0.00 0.21 0.00 0.00 66.02 63.57 1t60 s SER 142 CO -0.00 -2.30 0.19 0.12 0.41 0.00 0.00 173.24 171.67 1t60 s PHE 143 N 9.04 3.21 -0.25 2.43 5.36 -0.03 -1.54 117.98 136.19 1t60 s PHE 143 Ca 0.75 -0.12 -0.15 0.00 -0.96 0.00 0.00 56.93 56.45 1t60 s PHE 143 Cb -0.16 -2.40 -0.10 0.00 -0.34 0.00 0.00 43.02 40.02 1t60 s PHE 143 CO 0.24 -0.28 -0.35 0.28 -1.46 0.00 0.00 175.22 173.65 1t60 n VAL 144 N 5.06 1.51 -3.61 3.12 0.31 -0.39 -4.41 118.33 119.91 1t60 n VAL 144 Ca -0.14 -0.26 -0.06 0.00 -0.01 0.00 0.00 64.34 63.87 1t60 n VAL 144 Cb 0.51 -1.99 0.02 0.00 -0.91 0.00 0.00 33.84 31.47 1t60 n VAL 144 CO 0.00 0.00 0.00 1.15 -1.32 0.00 0.00 176.83 176.66 1t60 n MET 145 N -4.29 0.84 -3.51 5.55 0.00 -1.14 -1.13 117.12 113.44 1t60 n MET 145 Ca -0.45 -1.65 -0.09 0.00 0.00 0.00 0.00 57.70 55.51 1t60 n MET 145 Cb 0.80 2.07 -0.02 0.00 0.00 0.00 0.00 33.22 36.06 1t60 n MET 145 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 175.97 172.59 1t60 s HIS 146 N -3.80 -0.39 0.05 3.17 -3.43 -0.81 -0.75 115.29 109.34 1t60 s HIS 146 Ca 0.12 0.20 -0.04 0.00 -0.80 0.00 0.00 55.06 54.54 1t60 s HIS 146 Cb -0.04 0.56 -0.02 0.00 -1.43 0.00 0.00 32.58 31.66 1t60 s HIS 146 CO 0.09 -0.71 0.07 0.95 -2.00 0.00 0.00 174.74 173.13 1t60 s THR 147 N -3.39 0.16 0.00 -5.38 -4.23 -0.69 -2.91 115.64 99.20 1t60 s THR 147 Ca 0.04 -1.34 0.00 0.00 -1.18 0.00 0.00 61.69 59.21 1t60 s THR 147 Cb -0.01 -1.16 0.00 0.00 1.34 0.00 0.00 72.50 72.66 1t60 s THR 147 CO -0.09 -0.74 0.00 -0.24 -0.54 0.00 0.00 174.62 173.01 1t60 n SER 148 N 0.42 0.00 -4.66 3.99 2.88 -0.26 -1.08 113.62 114.91 1t60 n SER 148 Ca -0.17 0.00 -0.46 0.00 -1.33 0.00 0.00 58.87 56.91 1t60 n SER 148 Cb 0.60 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 64.02 1t60 n SER 148 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1t60 n ALA 149 N -3.00 0.95 -1.62 -1.46 0.00 -1.26 -0.98 120.51 113.14 1t60 n ALA 149 Ca 0.00 0.45 -0.20 0.00 0.00 0.00 0.00 53.44 53.68 1t60 n ALA 149 Cb 0.00 -2.29 -0.08 0.00 0.00 0.00 0.00 19.45 17.08 1t60 n ALA 149 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1t60 n GLY 150 N 2.94 1.87 2.44 0.00 0.00 -1.26 -1.79 105.19 109.39 1t60 n GLY 150 Ca 0.16 -0.03 -0.19 0.00 0.00 0.00 0.00 46.02 45.96 1t60 n GLY 150 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1t60 n ALA 151 N 1.26 -0.36 -2.16 4.61 0.00 -0.15 -4.97 120.51 118.74 1t60 n ALA 151 Ca -0.21 0.27 -0.27 0.00 0.00 0.00 0.00 53.44 53.23 1t60 n ALA 151 Cb 0.67 -1.91 0.01 0.00 0.00 0.00 0.00 19.45 18.22 1t60 n ALA 151 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1t60 s GLU 152 N -3.88 3.31 0.00 0.00 0.41 -0.74 -4.71 118.70 113.09 1t60 s GLU 152 Ca 0.00 0.17 0.00 0.00 -0.41 0.00 0.00 54.97 54.73 1t60 s GLU 152 Cb 0.00 -2.31 0.00 0.00 -1.78 0.00 0.00 34.13 30.04 1t60 s GLU 152 CO 0.00 -0.43 0.00 0.41 -0.49 0.00 0.00 175.26 174.75 1t60 n GLY 153 N -2.43 -0.94 1.33 -1.39 0.00 -1.26 -1.11 105.19 99.40 1t60 n GLY 153 Ca 0.03 -0.82 -0.04 0.00 0.00 0.00 0.00 46.02 45.18 1t60 n GLY 153 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1t60 n SER 154 N 0.39 -0.70 -2.38 1.61 3.41 -1.15 -4.70 113.62 110.11 1t60 n SER 154 Ca 0.00 -1.64 -0.09 0.00 -0.26 0.00 0.00 58.87 56.88 1t60 n SER 154 Cb 0.00 1.21 -0.01 0.00 -0.26 0.00 0.00 64.21 65.15 1t60 n SER 154 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1t60 n GLY 155 N -0.21 2.08 3.60 5.00 0.00 -1.26 -1.92 105.19 112.49 1t60 n GLY 155 Ca -0.02 -1.45 -0.27 0.00 0.00 0.00 0.00 46.02 44.29 1t60 n GLY 155 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1t60 s GLN 156 N -2.43 2.17 -0.11 1.61 -1.52 -0.28 -4.77 119.66 114.33 1t60 s GLN 156 Ca 0.18 -1.19 -0.27 0.00 -1.95 0.00 0.00 55.36 52.13 1t60 s GLN 156 Cb -0.01 -2.24 -0.02 0.00 -0.22 0.00 0.00 33.01 30.52 1t60 s GLN 156 CO 0.13 0.45 0.90 0.00 -0.25 0.00 0.00 175.29 176.52 1t60 s ALA 157 N -1.65 3.40 -0.68 6.09 0.00 -1.26 -4.90 121.76 122.76 1t60 s ALA 157 Ca 0.25 0.24 0.16 0.00 0.00 0.00 0.00 51.96 52.61 1t60 s ALA 157 Cb -0.09 -3.28 0.73 0.00 0.00 0.00 0.00 23.12 20.47 1t60 s ALA 157 CO 0.16 -0.50 1.50 1.28 0.00 0.00 0.00 175.76 178.19 1t60 n LEU 158 N 4.77 0.32 -0.35 0.00 4.77 -1.26 -1.13 117.00 124.12 1t60 n LEU 158 Ca 0.05 0.60 0.12 0.00 -0.03 0.00 0.00 56.01 56.76 1t60 n LEU 158 Cb 0.49 -0.59 0.26 0.00 -2.33 0.00 0.00 43.42 41.25 1t60 n LEU 158 CO 0.50 -0.53 0.55 0.00 -1.33 0.00 0.00 177.39 176.58 1t60 n ALA 159 N -1.64 3.19 -2.87 -1.18 0.00 -1.26 -4.61 120.51 112.13 1t60 n ALA 159 Ca 0.01 -0.49 -0.30 0.00 0.00 0.00 0.00 53.44 52.66 1t60 n ALA 159 Cb 0.13 -1.02 -0.04 0.00 0.00 0.00 0.00 19.45 18.52 1t60 n ALA 159 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1t60 s SER 160 N -2.46 6.38 0.64 0.00 0.15 -0.28 -1.77 113.70 116.37 1t60 s SER 160 Ca 0.23 0.32 0.41 0.00 0.70 0.00 0.00 55.95 57.62 1t60 s SER 160 Cb 0.19 -1.98 2.24 0.00 -1.71 0.00 0.00 66.02 64.76 1t60 s SER 160 CO 0.52 0.13 2.32 -0.65 1.20 0.00 0.00 173.24 176.76 1t60 h PRO 161 N 2.89 0.00 0.00 5.44 0.11 -1.85 -1.76 132.00 136.82 1t60 h PRO 161 Ca -0.46 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.64 1t60 h PRO 161 Cb 1.17 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.27 1t60 h PRO 161 CO 0.74 0.00 -0.05 0.78 -0.21 0.00 0.00 178.00 179.27 1t60 h GLY 162 N 0.21 0.00 -0.65 -0.55 0.00 -1.84 0.04 103.07 100.28 1t60 h GLY 162 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1t60 h GLY 162 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 176.54 175.40 1t60 n SER 163 N -3.31 1.28 -3.76 0.19 3.41 -0.66 -4.49 113.62 106.27 1t60 n SER 163 Ca -0.01 -1.79 -0.28 0.00 -0.26 0.00 0.00 58.87 56.53 1t60 n SER 163 Cb 0.22 -0.12 -0.12 0.00 -0.26 0.00 0.00 64.21 63.93 1t60 n SER 163 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1t60 s LEU 165 N -0.70 4.44 0.36 0.00 1.43 -0.92 -4.69 118.68 118.61 1t60 s LEU 165 Ca 0.25 1.82 0.17 0.00 -1.03 0.00 0.00 54.13 55.34 1t60 s LEU 165 Cb -0.08 -3.58 0.65 0.00 0.03 0.00 0.00 46.19 43.21 1t60 s LEU 165 CO -0.13 -0.20 1.73 -0.33 0.23 0.00 0.00 176.35 177.65 1t60 h GLU 166 N 6.06 0.00 -5.00 1.70 5.08 -1.88 0.42 114.58 120.97 1t60 h GLU 166 Ca -0.42 0.00 -0.67 0.00 -1.00 0.00 0.00 59.36 57.27 1t60 h GLU 166 Cb 1.21 0.00 -0.35 0.00 0.50 0.00 0.00 28.75 30.11 1t60 h GLU 166 CO 0.74 0.41 -0.83 -1.21 -1.00 0.00 0.00 179.01 177.11 1t60 s GLU 167 N -3.66 2.76 0.12 2.33 0.41 -1.26 -4.76 118.70 114.64 1t60 s GLU 167 Ca -0.00 -0.99 -0.30 0.00 -0.41 0.00 0.00 54.97 53.26 1t60 s GLU 167 Cb 0.12 -2.69 -0.07 0.00 -1.78 0.00 0.00 34.13 29.71 1t60 s GLU 167 CO 0.70 -0.33 1.21 0.12 -0.49 0.00 0.00 175.26 176.47 1t60 s PHE 168 N 1.24 3.43 -0.03 1.61 2.19 -1.26 -4.98 117.98 120.17 1t60 s PHE 168 Ca 0.01 1.34 -0.01 0.00 0.33 0.00 0.00 56.93 58.60 1t60 s PHE 168 Cb -0.15 -3.44 0.03 0.00 -1.31 0.00 0.00 43.02 38.15 1t60 s PHE 168 CO -0.10 -1.30 0.05 1.03 1.83 0.00 0.00 175.22 176.73 1t60 s ARG 169 N 0.47 -0.03 0.30 10.12 1.81 -1.26 -5.03 118.95 125.34 1t60 s ARG 169 Ca 0.56 0.25 -0.00 0.00 -1.72 0.00 0.00 55.73 54.82 1t60 s ARG 169 Cb -0.31 -0.28 0.48 0.00 -0.45 0.00 0.00 34.95 34.39 1t60 s ARG 169 CO 0.32 -0.20 1.89 0.66 -0.68 0.00 0.00 175.30 177.30 1t60 h SER 170 N 7.48 0.76 -3.09 0.23 4.64 -1.99 -3.24 113.55 118.34 1t60 h SER 170 Ca -0.40 -0.09 -0.62 0.00 -0.47 0.00 0.00 61.79 60.21 1t60 h SER 170 Cb 1.12 -0.20 -0.42 0.00 -0.31 0.00 0.00 62.40 62.60 1t60 h SER 170 CO 0.42 0.68 -0.61 0.00 -0.87 0.00 0.00 176.83 176.45 1t60 s ALA 171 N -5.41 3.60 -1.00 5.18 0.00 -1.26 -4.31 121.76 118.55 1t60 s ALA 171 Ca -0.10 -3.71 0.19 0.00 0.00 0.00 0.00 51.96 48.34 1t60 s ALA 171 Cb 0.16 -2.12 0.80 0.00 0.00 0.00 0.00 23.12 21.97 1t60 s ALA 171 CO 0.79 -2.09 1.60 -0.35 0.00 0.00 0.00 175.76 175.72 1t60 n PRO 172 N 2.08 0.00 -4.20 0.00 -0.04 -1.23 -4.88 135.00 126.74 1t60 n PRO 172 Ca 0.20 0.18 -0.12 0.00 -0.04 0.00 0.00 63.50 63.72 1t60 n PRO 172 Cb 0.36 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.22 1t60 n PRO 172 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1t60 s PHE 173 N -3.00 1.08 0.12 0.54 -0.71 -1.26 -0.95 117.98 113.79 1t60 s PHE 173 Ca 0.09 -1.19 0.09 0.00 -1.04 0.00 0.00 56.93 54.88 1t60 s PHE 173 Cb 0.12 -0.60 -0.04 0.00 -1.21 0.00 0.00 43.02 41.30 1t60 s PHE 173 CO 0.34 -0.43 -0.23 -1.50 -1.34 0.00 0.00 175.22 172.06 1t60 s ILE 174 N -3.93 1.94 -0.20 -4.49 2.07 -0.04 -4.78 121.20 111.78 1t60 s ILE 174 Ca 0.28 -1.64 -0.10 0.00 -1.41 0.00 0.00 60.65 57.78 1t60 s ILE 174 Cb 0.07 -1.75 -0.05 0.00 0.13 0.00 0.00 42.46 40.87 1t60 s ILE 174 CO 0.05 -0.01 0.12 -0.70 -1.91 0.00 0.00 174.94 172.50 1t60 s GLU 175 N -1.99 4.15 0.21 3.50 2.12 -0.84 -2.37 118.70 123.48 1t60 s GLU 175 Ca 0.10 -0.24 0.11 0.00 0.36 0.00 0.00 54.97 55.29 1t60 s GLU 175 Cb -0.10 -3.40 -0.05 0.00 0.26 0.00 0.00 34.13 30.85 1t60 s GLU 175 CO 0.05 0.28 -0.21 0.00 -0.54 0.00 0.00 175.26 174.85 1t60 s HIS 177 N -2.08 1.99 0.61 0.00 0.09 0.17 -2.18 115.29 113.88 1t60 s HIS 177 Ca 0.22 -0.45 0.33 0.00 -0.00 0.00 0.00 55.06 55.16 1t60 s HIS 177 Cb -0.06 -0.91 1.95 0.00 -0.00 0.00 0.00 32.58 33.56 1t60 s HIS 177 CO 0.10 0.50 2.27 0.78 -0.00 0.00 0.00 174.74 178.39 1t60 h GLY 178 N 2.63 0.00 2.00 -2.22 0.00 -1.67 -0.53 103.07 103.28 1t60 h GLY 178 Ca -0.40 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.93 1t60 h GLY 178 CO 0.58 0.00 0.00 -0.09 0.00 0.00 0.00 176.54 177.03 1t60 h ARG 179 N 0.00 0.00 0.00 4.80 2.43 -1.88 -3.45 114.38 116.28 1t60 h ARG 179 Ca 0.01 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 1t60 h ARG 179 Cb 0.05 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.60 1t60 h ARG 179 CO -0.00 0.00 0.00 0.41 -1.51 0.00 0.00 179.97 178.87 1t60 n GLY 180 N 0.17 0.78 3.89 2.80 0.00 -0.21 -5.08 105.19 107.55 1t60 n GLY 180 Ca 0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 1t60 n GLY 180 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1t60 s THR 181 N -2.00 5.30 0.08 2.61 -4.23 -1.25 -4.00 115.64 112.15 1t60 s THR 181 Ca 0.00 0.02 0.01 0.00 -1.18 0.00 0.00 61.69 60.54 1t60 s THR 181 Cb 0.00 -3.58 -0.04 0.00 1.34 0.00 0.00 72.50 70.21 1t60 s THR 181 CO 0.00 0.26 -0.05 0.00 -0.54 0.00 0.00 174.62 174.29 1t60 n ASN 183 N 0.09 0.00 -4.70 0.00 5.15 0.30 -0.54 115.26 115.57 1t60 n ASN 183 Ca -0.13 0.00 -0.35 0.00 -0.60 0.00 0.00 54.58 53.49 1t60 n ASN 183 Cb 0.61 0.00 -0.09 0.00 -0.53 0.00 0.00 39.78 39.77 1t60 n ASN 183 CO 0.00 0.00 0.00 -0.31 1.40 0.00 0.00 177.26 178.35 1t60 s TYR 184 N -2.00 3.36 0.12 1.20 1.51 -1.26 -1.98 117.35 118.29 1t60 s TYR 184 Ca 0.00 0.26 0.08 0.00 -1.01 0.00 0.00 57.07 56.40 1t60 s TYR 184 Cb 0.00 -2.18 -0.04 0.00 -0.11 0.00 0.00 41.96 39.63 1t60 s TYR 184 CO 0.00 0.21 -0.12 0.71 -1.11 0.00 0.00 175.55 175.24 1t60 s TYR 185 N 0.57 2.68 0.48 2.71 1.51 -1.26 -5.03 117.35 119.01 1t60 s TYR 185 Ca 0.07 -0.19 0.19 0.00 -1.01 0.00 0.00 57.07 56.14 1t60 s TYR 185 Cb -0.12 -1.40 1.21 0.00 -0.11 0.00 0.00 41.96 41.54 1t60 s TYR 185 CO 0.00 0.43 1.99 0.00 -1.11 0.00 0.00 175.55 176.86 1t60 h ALA 186 N 3.56 2.24 -0.07 3.71 0.00 -2.03 -2.31 119.26 124.36 1t60 h ALA 186 Ca -0.49 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1t60 h ALA 186 Cb 1.17 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1t60 h ALA 186 CO 0.51 -0.38 0.00 0.27 0.00 0.00 0.00 179.25 179.65 1t60 n ASN 187 N -4.44 0.69 -4.73 0.00 6.94 -1.26 -4.86 115.26 107.60 1t60 n ASN 187 Ca 0.10 -1.55 -0.41 0.00 -0.02 0.00 0.00 54.58 52.69 1t60 n ASN 187 Cb 0.48 -0.04 -0.04 0.00 -2.36 0.00 0.00 39.78 37.82 1t60 n ASN 187 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1t60 s ALA 188 N -1.91 3.36 0.00 -2.53 0.00 -0.87 -4.54 121.76 115.27 1t60 s ALA 188 Ca 0.29 0.79 0.03 0.00 0.00 0.00 0.00 51.96 53.08 1t60 s ALA 188 Cb 0.14 -3.36 -0.01 0.00 0.00 0.00 0.00 23.12 19.89 1t60 s ALA 188 CO 0.23 -0.23 -0.11 0.71 0.00 0.00 0.00 175.76 176.36 1t60 s TYR 189 N -0.01 0.97 -0.10 0.00 4.12 -0.24 -5.00 117.35 117.10 1t60 s TYR 189 Ca 0.51 -0.22 0.03 0.00 0.02 0.00 0.00 57.07 57.40 1t60 s TYR 189 Cb -0.29 -0.61 -0.01 0.00 -1.52 0.00 0.00 41.96 39.53 1t60 s TYR 189 CO 0.34 -0.01 -0.20 -1.54 0.02 0.00 0.00 175.55 174.15 1t60 s SER 190 N -0.48 3.41 -0.10 2.29 1.04 -1.26 -1.70 113.70 116.90 1t60 s SER 190 Ca 0.03 -0.46 -0.00 0.00 0.48 0.00 0.00 55.95 55.99 1t60 s SER 190 Cb -0.05 -1.34 -0.03 0.00 0.10 0.00 0.00 66.02 64.70 1t60 s SER 190 CO -0.00 0.19 -0.08 -0.36 0.98 0.00 0.00 173.24 173.96 1t60 s PHE 191 N 0.20 2.90 0.12 5.02 0.08 0.08 -5.00 117.98 121.38 1t60 s PHE 191 Ca -0.12 -0.23 0.04 0.00 0.12 0.00 0.00 56.93 56.74 1t60 s PHE 191 Cb -0.16 -1.79 -0.04 0.00 -0.57 0.00 0.00 43.02 40.46 1t60 s PHE 191 CO 0.07 0.10 -0.10 -1.58 -0.10 0.00 0.00 175.22 173.61 1t60 s TRP 192 N -0.25 1.17 0.24 0.36 0.52 -1.26 -1.27 118.94 118.45 1t60 s TRP 192 Ca 0.03 -0.70 -0.30 0.00 0.02 0.00 0.00 56.10 55.15 1t60 s TRP 192 Cb -0.13 -0.62 -0.10 0.00 -1.15 0.00 0.00 33.47 31.48 1t60 s TRP 192 CO 0.03 0.04 1.35 -0.51 0.02 0.00 0.00 176.95 177.88 1t60 s LEU 193 N -2.76 4.41 0.47 2.99 1.43 -0.59 -4.87 118.68 119.77 1t60 s LEU 193 Ca 0.10 2.55 -0.05 0.00 -1.03 0.00 0.00 54.13 55.70 1t60 s LEU 193 Cb -0.01 -3.62 -0.04 0.00 0.03 0.00 0.00 46.19 42.55 1t60 s LEU 193 CO 0.00 -0.58 0.77 0.00 0.23 0.00 0.00 176.35 176.77 1t60 s ALA 194 N -0.18 3.42 -0.01 4.21 0.00 -1.26 -0.91 121.76 127.02 1t60 s ALA 194 Ca 0.56 -0.51 -0.25 0.00 0.00 0.00 0.00 51.96 51.76 1t60 s ALA 194 Cb -0.39 -2.57 -0.04 0.00 0.00 0.00 0.00 23.12 20.12 1t60 s ALA 194 CO 0.43 -0.31 0.78 0.95 0.00 0.00 0.00 175.76 177.61 1t60 s THR 195 N -2.70 4.90 -0.08 0.00 -4.23 -0.70 -4.46 115.64 108.37 1t60 s THR 195 Ca 0.47 1.64 0.05 0.00 -1.18 0.00 0.00 61.69 62.67 1t60 s THR 195 Cb -0.10 -4.13 -0.00 0.00 1.34 0.00 0.00 72.50 69.61 1t60 s THR 195 CO 0.44 0.27 -0.24 -0.63 -0.54 0.00 0.00 174.62 173.92 1t60 s ILE 196 N 0.54 2.01 0.00 2.99 -1.09 0.15 -4.95 121.20 120.86 1t60 s ILE 196 Ca 0.41 -1.01 -0.26 0.00 -2.23 0.00 0.00 60.65 57.55 1t60 s ILE 196 Cb -0.19 -1.72 -0.04 0.00 -1.58 0.00 0.00 42.46 38.92 1t60 s ILE 196 CO 0.22 0.55 0.82 -1.61 -1.23 0.00 0.00 174.94 173.70 1t60 s GLU 197 N 0.14 4.52 0.29 2.79 0.41 -1.26 -4.77 118.70 120.81 1t60 s GLU 197 Ca -0.12 1.14 0.01 0.00 -0.41 0.00 0.00 54.97 55.59 1t60 s GLU 197 Cb -0.16 -3.42 0.70 0.00 -1.78 0.00 0.00 34.13 29.47 1t60 s GLU 197 CO 0.07 0.12 1.62 -0.09 -0.49 0.00 0.00 175.26 176.49 1t60 h ARG 198 N 6.31 0.13 0.00 1.61 2.43 -1.99 1.02 114.38 123.90 1t60 h ARG 198 Ca -0.42 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 58.74 1t60 h ARG 198 Cb 1.21 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.73 1t60 h ARG 198 CO 0.74 0.09 0.00 -1.13 -1.51 0.00 0.00 179.97 178.15 1t60 n SER 199 N -5.31 0.00 -0.00 -3.80 3.41 -1.26 -2.88 113.62 103.78 1t60 n SER 199 Ca 0.21 -0.23 0.08 0.00 -0.26 0.00 0.00 58.87 58.67 1t60 n SER 199 Cb 0.69 -0.19 -0.10 0.00 -0.26 0.00 0.00 64.21 64.36 1t60 n SER 199 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1t60 n GLU 200 N -1.19 1.56 -0.28 4.33 1.02 0.35 -4.66 120.64 121.78 1t60 n GLU 200 Ca 0.12 -0.03 -0.02 0.00 -0.02 0.00 0.00 57.16 57.21 1t60 n GLU 200 Cb 0.13 -1.27 0.05 0.00 -0.02 0.00 0.00 31.44 30.33 1t60 n GLU 200 CO 0.00 0.00 0.00 0.52 1.18 0.00 0.00 177.13 178.83 1t60 h MET 201 N 0.00 -0.07 -1.52 3.49 2.86 -1.33 -1.36 114.93 117.00 1t60 h MET 201 Ca 0.00 0.00 -0.69 0.00 -2.06 0.00 0.00 59.70 56.96 1t60 h MET 201 Cb 0.44 0.02 -0.32 0.00 0.06 0.00 0.00 31.60 31.79 1t60 h MET 201 CO 0.00 -0.04 0.43 1.19 1.06 0.00 0.00 176.91 179.55 1t60 n PHE 202 N -5.48 3.11 -4.12 -0.22 3.01 -1.26 -4.93 117.46 107.57 1t60 n PHE 202 Ca 0.08 -2.65 -0.14 0.00 1.01 0.00 0.00 57.45 55.76 1t60 n PHE 202 Cb 0.39 -0.92 -0.11 0.00 -0.01 0.00 0.00 39.48 38.82 1t60 n PHE 202 CO 0.00 0.00 0.00 0.15 1.01 0.00 0.00 176.76 177.92 1t60 s LYS 203 N -3.85 0.68 -0.00 -1.08 1.02 -0.51 -5.10 119.74 110.88 1t60 s LYS 203 Ca 0.54 -0.93 -0.35 0.00 0.02 0.00 0.00 55.97 55.24 1t60 s LYS 203 Cb 0.44 -0.43 -0.14 0.00 -0.52 0.00 0.00 37.83 37.19 1t60 s LYS 203 CO -0.22 0.07 1.67 1.17 -0.92 0.00 0.00 175.35 177.12 1t60 n LYS 204 N 1.09 1.84 -1.72 1.68 4.81 -1.26 -4.87 118.16 119.72 1t60 n LYS 204 Ca -0.20 0.67 -0.40 0.00 -0.87 0.00 0.00 58.31 57.50 1t60 n LYS 204 Cb 0.56 -2.43 0.02 0.00 0.02 0.00 0.00 35.03 33.20 1t60 n LYS 204 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 1t60 n PRO 205 N 4.66 2.01 -3.12 1.64 -0.02 -1.26 -4.94 135.00 133.97 1t60 n PRO 205 Ca 0.21 0.72 -0.43 0.00 -2.02 0.00 0.00 63.50 61.97 1t60 n PRO 205 Cb 0.25 -2.48 -0.07 0.00 -0.02 0.00 0.00 33.50 31.18 1t60 n PRO 205 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1t60 s THR 206 N -1.21 4.83 0.42 3.45 2.01 -1.26 -5.03 115.64 118.85 1t60 s THR 206 Ca 0.62 -0.10 -0.24 0.00 0.31 0.00 0.00 61.69 62.28 1t60 s THR 206 Cb -0.48 -4.25 -0.11 0.00 0.01 0.00 0.00 72.50 67.68 1t60 s THR 206 CO 0.57 -0.69 0.97 -2.65 -0.69 0.00 0.00 174.62 172.13 1t60 n PRO 207 N 6.28 1.27 -3.75 4.92 -0.02 -1.26 -5.00 135.00 137.45 1t60 n PRO 207 Ca -0.03 0.46 -0.12 0.00 -2.02 0.00 0.00 63.50 61.78 1t60 n PRO 207 Cb 0.47 -2.00 -0.11 0.00 -0.02 0.00 0.00 33.50 31.84 1t60 n PRO 207 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1t60 s SER 208 N -0.77 -0.35 -0.26 2.55 0.15 -1.26 -5.12 113.70 108.64 1t60 s SER 208 Ca 0.63 0.66 0.02 0.00 0.70 0.00 0.00 55.95 57.97 1t60 s SER 208 Cb -0.56 0.63 0.05 0.00 -1.71 0.00 0.00 66.02 64.43 1t60 s SER 208 CO 0.57 -0.13 -0.09 -0.89 1.20 0.00 0.00 173.24 173.89 1t60 s THR 209 N 0.56 2.33 -0.15 6.45 2.01 -1.26 -5.10 115.64 120.48 1t60 s THR 209 Ca -0.03 -1.53 -0.06 0.00 0.31 0.00 0.00 61.69 60.39 1t60 s THR 209 Cb -0.05 -2.34 -0.04 0.00 0.01 0.00 0.00 72.50 70.09 1t60 s THR 209 CO -0.03 0.00 0.04 -0.76 -0.69 0.00 0.00 174.62 173.18 1t60 s LEU 210 N 1.15 3.74 0.37 4.42 1.43 -1.26 -5.11 118.68 123.42 1t60 s LEU 210 Ca -0.07 0.10 0.07 0.00 -1.03 0.00 0.00 54.13 53.20 1t60 s LEU 210 Cb -0.19 -1.92 -0.01 0.00 0.03 0.00 0.00 46.19 44.10 1t60 s LEU 210 CO -0.05 0.24 0.48 -0.54 0.23 0.00 0.00 176.35 176.71 1t60 s LYS 211 N -0.02 2.94 0.47 1.70 1.02 -1.26 -4.77 119.74 119.81 1t60 s LYS 211 Ca 0.05 -1.16 -0.20 0.00 0.02 0.00 0.00 55.97 54.69 1t60 s LYS 211 Cb -0.12 -2.73 -0.14 0.00 -0.52 0.00 0.00 37.83 34.31 1t60 s LYS 211 CO 0.01 -0.06 0.09 0.00 -0.92 0.00 0.00 175.35 174.47 1t60 n ALA 212 N -1.67 -2.67 -1.13 5.17 0.00 -1.26 -2.22 120.51 116.74 1t60 n ALA 212 Ca 0.03 0.04 -0.04 0.00 0.00 0.00 0.00 53.44 53.46 1t60 n ALA 212 Cb 0.59 -1.52 -0.02 0.00 0.00 0.00 0.00 19.45 18.50 1t60 n ALA 212 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1t60 n GLY 213 N 2.29 0.69 0.00 0.00 0.00 -1.26 -4.68 105.19 102.23 1t60 n GLY 213 Ca 0.10 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.69 1t60 n GLY 213 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1t60 n GLU 214 N -2.31 0.71 -0.14 1.61 2.13 -0.94 -4.95 120.64 116.74 1t60 n GLU 214 Ca -0.04 0.00 -0.04 0.00 0.66 0.00 0.00 57.16 57.73 1t60 n GLU 214 Cb 0.21 -0.06 0.02 0.00 0.27 0.00 0.00 31.44 31.89 1t60 n GLU 214 CO 0.00 0.00 0.00 -0.07 -0.41 0.00 0.00 177.13 176.65 1t60 h LEU 215 N 0.00 -0.59 -1.53 4.31 3.38 -1.82 -1.68 115.31 117.37 1t60 h LEU 215 Ca 0.00 0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1t60 h LEU 215 Cb 0.00 0.35 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1t60 h LEU 215 CO 0.00 -0.20 0.00 0.03 0.09 0.00 0.00 178.44 178.36 1t60 h ARG 216 N -0.07 0.00 0.00 1.13 3.08 -1.93 -2.94 114.38 113.65 1t60 h ARG 216 Ca 0.22 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.26 1t60 h ARG 216 Cb 0.41 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.46 1t60 h ARG 216 CO -0.51 0.00 -0.03 1.79 -1.07 0.00 0.00 179.97 180.15 1t60 h THR 217 N 0.00 0.34 -0.19 2.04 1.35 -1.69 -2.58 112.91 112.18 1t60 h THR 217 Ca 0.00 -0.20 0.00 0.00 -0.55 0.00 0.00 66.41 65.66 1t60 h THR 217 Cb 0.10 1.14 0.00 0.00 -1.73 0.00 0.00 68.15 67.66 1t60 h THR 217 CO 0.00 0.03 0.00 1.41 -0.25 0.00 0.00 175.52 176.71 1t60 n HIS 218 N -3.50 0.31 -3.76 4.73 8.25 -1.11 -4.89 115.22 115.25 1t60 n HIS 218 Ca -0.02 -0.58 -0.36 0.00 -0.26 0.00 0.00 57.72 56.49 1t60 n HIS 218 Cb 0.14 -0.08 -0.11 0.00 1.12 0.00 0.00 29.99 31.07 1t60 n HIS 218 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1t60 s VAL 219 N -1.35 4.95 0.43 1.59 1.01 -0.97 -1.72 120.40 124.33 1t60 s VAL 219 Ca 0.18 0.04 -0.26 0.00 0.00 0.00 0.00 61.98 61.93 1t60 s VAL 219 Cb 0.11 -3.30 -0.09 0.00 0.00 0.00 0.00 36.38 33.10 1t60 s VAL 219 CO 0.08 0.36 1.46 -0.24 0.00 0.00 0.00 175.10 176.76 1t60 n SER 220 N 4.39 3.54 -4.95 3.32 2.88 -0.09 -4.67 113.62 118.04 1t60 n SER 220 Ca -0.15 1.16 -0.23 0.00 -1.33 0.00 0.00 58.87 58.31 1t60 n SER 220 Cb 0.52 -1.62 -0.02 0.00 -0.75 0.00 0.00 64.21 62.34 1t60 n SER 220 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 1t60 s ARG 221 N -2.34 3.47 0.19 -1.46 1.81 -0.87 -1.02 118.95 118.74 1t60 s ARG 221 Ca 0.58 -0.50 -0.05 0.00 -1.72 0.00 0.00 55.73 54.05 1t60 s ARG 221 Cb -0.46 -2.78 -0.03 0.00 -0.45 0.00 0.00 34.95 31.24 1t60 s ARG 221 CO 0.60 0.29 0.22 0.00 -0.68 0.00 0.00 175.30 175.73 1t60 s GLN 223 N -4.08 0.15 -0.21 0.00 0.74 -0.62 -1.09 119.66 114.54 1t60 s GLN 223 Ca 0.30 0.24 -0.11 0.00 0.05 0.00 0.00 55.36 55.84 1t60 s GLN 223 Cb 0.05 0.01 -0.05 0.00 1.10 0.00 0.00 33.01 34.12 1t60 s GLN 223 CO 0.08 -0.06 0.19 0.08 -0.55 0.00 0.00 175.29 175.03 1t60 s VAL 224 N 0.36 5.36 0.14 1.34 1.01 0.12 -1.48 120.40 127.25 1t60 s VAL 224 Ca -0.02 0.28 0.08 0.00 0.00 0.00 0.00 61.98 62.31 1t60 s VAL 224 Cb -0.04 -3.53 -0.04 0.00 0.00 0.00 0.00 36.38 32.78 1t60 s VAL 224 CO -0.01 0.37 -0.18 0.00 0.00 0.00 0.00 175.10 175.28 1t60 s MET 226 N -2.52 1.14 0.00 0.00 -2.45 0.44 -0.59 119.30 115.32 1t60 s MET 226 Ca 0.12 -0.43 0.30 0.00 -1.25 0.00 0.00 55.69 54.42 1t60 s MET 226 Cb -0.07 -1.07 1.79 0.00 1.25 0.00 0.00 34.83 36.73 1t60 s MET 226 CO 0.05 0.22 2.12 -2.13 1.05 0.00 0.00 175.02 176.33