#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 12e8 s ILE 2 N 0.00 4.95 -0.16 0.53 1.01 -1.26 -5.03 121.20 121.25 12e8 s ILE 2 Ca 0.00 1.55 -0.19 0.00 0.00 0.00 0.00 60.65 62.01 12e8 s ILE 2 Cb 0.00 -4.10 -0.03 0.00 0.01 0.00 0.00 42.46 38.34 12e8 s ILE 2 CO 0.00 0.13 0.55 -0.69 0.00 0.00 0.00 174.94 174.92 12e8 s VAL 3 N 1.55 5.11 -0.35 2.92 1.01 -1.26 -4.73 120.40 124.64 12e8 s VAL 3 Ca 0.38 1.05 -0.09 0.00 0.00 0.00 0.00 61.98 63.33 12e8 s VAL 3 Cb -0.17 -3.88 0.03 0.00 0.00 0.00 0.00 36.38 32.36 12e8 s VAL 3 CO 0.15 0.22 0.16 -0.04 0.00 0.00 0.00 175.10 175.60 12e8 s MET 4 N 1.24 2.78 -0.25 2.72 -1.94 -1.26 -1.28 119.30 121.31 12e8 s MET 4 Ca 0.27 -1.09 -0.10 0.00 -1.71 0.00 0.00 55.69 53.06 12e8 s MET 4 Cb -0.16 -3.60 -0.04 0.00 2.01 0.00 0.00 34.83 33.04 12e8 s MET 4 CO 0.11 -0.66 0.14 0.99 -0.01 0.00 0.00 175.02 175.59 12e8 s THR 5 N 1.50 5.01 -0.51 2.05 2.01 0.12 -3.99 115.64 121.83 12e8 s THR 5 Ca 0.01 0.06 -0.03 0.00 0.31 0.00 0.00 61.69 62.05 12e8 s THR 5 Cb -0.19 -3.35 0.13 0.00 0.01 0.00 0.00 72.50 69.10 12e8 s THR 5 CO 0.05 0.32 0.31 -1.10 -0.69 0.00 0.00 174.62 173.51 12e8 s GLN 6 N 1.43 2.25 0.56 4.92 -0.21 -1.26 -0.62 119.66 126.71 12e8 s GLN 6 Ca 0.06 -2.17 0.24 0.00 0.02 0.00 0.00 55.36 53.52 12e8 s GLN 6 Cb -0.15 -3.64 1.53 0.00 1.00 0.00 0.00 33.01 31.75 12e8 s GLN 6 CO 0.07 -1.12 2.15 0.66 -2.12 0.00 0.00 175.29 174.93 12e8 h SER 7 N 7.54 0.00 -3.55 5.90 4.64 -1.94 -3.41 113.55 122.72 12e8 h SER 7 Ca -0.08 0.00 -0.71 0.00 -0.47 0.00 0.00 61.79 60.54 12e8 h SER 7 Cb 1.00 0.00 -0.20 0.00 -0.31 0.00 0.00 62.40 62.89 12e8 h SER 7 CO 0.70 0.00 -0.41 -1.10 -0.87 0.00 0.00 176.83 175.16 12e8 s GLN 8 N -4.84 3.11 0.15 4.77 -1.52 -1.26 -4.95 119.66 115.12 12e8 s GLN 8 Ca -0.05 -0.89 -0.04 0.00 -1.95 0.00 0.00 55.36 52.43 12e8 s GLN 8 Cb 0.16 -3.94 -0.03 0.00 -0.22 0.00 0.00 33.01 28.99 12e8 s GLN 8 CO 0.62 -0.69 1.37 0.87 -0.25 0.00 0.00 175.29 177.20 12e8 h LYS 9 N 8.61 0.48 -4.54 2.91 6.56 -1.79 -3.38 116.57 125.40 12e8 h LYS 9 Ca -0.28 -0.43 -0.26 0.00 -1.06 0.00 0.00 60.65 58.62 12e8 h LYS 9 Cb 1.13 0.10 -0.20 0.00 -0.57 0.00 0.00 32.23 32.69 12e8 h LYS 9 CO 0.72 1.07 -0.73 -0.06 -2.06 0.00 0.00 179.45 178.39 12e8 s PHE 10 N -3.52 0.68 -0.11 -1.35 0.08 -1.26 -0.45 117.98 112.04 12e8 s PHE 10 Ca -0.07 -0.56 -0.05 0.00 0.12 0.00 0.00 56.93 56.37 12e8 s PHE 10 Cb 0.10 -0.41 0.05 0.00 -0.57 0.00 0.00 43.02 42.19 12e8 s PHE 10 CO 0.86 -0.10 0.25 -1.64 -0.10 0.00 0.00 175.22 174.49 12e8 s MET 11 N -1.90 0.17 0.08 0.44 -1.94 -0.66 -4.90 119.30 110.58 12e8 s MET 11 Ca -0.07 0.63 -0.24 0.00 -1.71 0.00 0.00 55.69 54.30 12e8 s MET 11 Cb -0.08 -0.09 -0.06 0.00 2.01 0.00 0.00 34.83 36.61 12e8 s MET 11 CO -0.01 -0.23 0.72 -1.54 -0.01 0.00 0.00 175.02 173.96 12e8 s SER 12 N 1.85 7.22 0.25 3.03 1.04 -1.26 -0.70 113.70 125.12 12e8 s SER 12 Ca -0.04 1.45 0.00 0.00 0.48 0.00 0.00 55.95 57.84 12e8 s SER 12 Cb -0.11 -2.45 -0.03 0.00 0.10 0.00 0.00 66.02 63.52 12e8 s SER 12 CO -0.08 0.12 0.22 0.42 0.98 0.00 0.00 173.24 174.89 12e8 s THR 13 N -0.54 0.00 0.03 2.02 -4.23 0.10 -4.90 115.64 108.12 12e8 s THR 13 Ca 0.35 -1.93 0.02 0.00 -1.18 0.00 0.00 61.69 58.95 12e8 s THR 13 Cb -0.21 -2.49 -0.02 0.00 1.34 0.00 0.00 72.50 71.13 12e8 s THR 13 CO 0.23 0.00 -0.07 -0.44 -0.54 0.00 0.00 174.62 173.80 12e8 s SER 14 N -3.21 0.76 0.14 3.99 0.01 -1.26 -1.14 113.70 112.99 12e8 s SER 14 Ca 0.38 -0.41 -0.34 0.00 1.31 0.00 0.00 55.95 56.89 12e8 s SER 14 Cb 0.05 0.01 -0.14 0.00 0.21 0.00 0.00 66.02 66.15 12e8 s SER 14 CO 0.16 -0.13 1.61 0.52 0.41 0.00 0.00 173.24 175.82 12e8 n VAL 15 N 1.90 0.05 0.00 3.43 0.31 -1.26 -1.32 118.33 121.44 12e8 n VAL 15 Ca -0.20 -0.01 0.00 0.00 -0.01 0.00 0.00 64.34 64.12 12e8 n VAL 15 Cb 0.56 -1.60 0.00 0.00 -0.91 0.00 0.00 33.84 31.89 12e8 n VAL 15 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 12e8 n GLY 16 N 3.53 2.92 3.81 2.92 0.00 0.05 -4.93 105.19 113.49 12e8 n GLY 16 Ca 0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 12e8 n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 12e8 s ASP 17 N -1.31 5.64 -0.24 1.61 1.01 -0.44 -4.17 116.67 118.77 12e8 s ASP 17 Ca 0.00 1.76 -0.11 0.00 0.71 0.00 0.00 52.55 54.91 12e8 s ASP 17 Cb 0.00 -2.52 -0.05 0.00 1.01 0.00 0.00 42.92 41.36 12e8 s ASP 17 CO 0.00 -1.26 0.18 -0.60 0.21 0.00 0.00 175.17 173.70 12e8 s ARG 18 N -4.36 4.07 -0.02 8.23 3.52 -1.26 -0.81 118.95 128.32 12e8 s ARG 18 Ca 0.62 -0.23 0.06 0.00 -0.13 0.00 0.00 55.73 56.05 12e8 s ARG 18 Cb -0.15 -3.55 -0.01 0.00 -1.56 0.00 0.00 34.95 29.68 12e8 s ARG 18 CO 0.42 0.04 -0.21 0.54 -0.81 0.00 0.00 175.30 175.29 12e8 s VAL 19 N 1.12 1.64 -0.04 7.11 0.11 0.62 -4.97 120.40 126.00 12e8 s VAL 19 Ca 0.09 -0.87 0.05 0.00 -2.93 0.00 0.00 61.98 58.31 12e8 s VAL 19 Cb -0.14 -1.37 -0.01 0.00 -1.53 0.00 0.00 36.38 33.33 12e8 s VAL 19 CO 0.05 0.46 -0.19 -0.44 -3.33 0.00 0.00 175.10 171.65 12e8 s SER 20 N -0.38 2.34 -0.10 3.54 0.01 -1.26 -0.21 113.70 117.63 12e8 s SER 20 Ca 0.05 -0.38 0.03 0.00 1.31 0.00 0.00 55.95 56.97 12e8 s SER 20 Cb -0.09 -0.51 0.01 0.00 0.21 0.00 0.00 66.02 65.63 12e8 s SER 20 CO 0.00 0.20 -0.20 -0.63 0.41 0.00 0.00 173.24 173.02 12e8 s ILE 21 N -0.17 1.78 0.16 1.44 1.01 0.43 -4.96 121.20 120.89 12e8 s ILE 21 Ca 0.00 -0.84 0.01 0.00 0.00 0.00 0.00 60.65 59.82 12e8 s ILE 21 Cb -0.10 -1.57 -0.04 0.00 0.01 0.00 0.00 42.46 40.76 12e8 s ILE 21 CO 0.01 0.50 0.31 0.42 0.00 0.00 0.00 174.94 176.18 12e8 s THR 22 N 0.59 5.29 -0.15 2.92 -4.23 -1.26 -0.84 115.64 117.96 12e8 s THR 22 Ca -0.14 -0.56 -0.07 0.00 -1.18 0.00 0.00 61.69 59.74 12e8 s THR 22 Cb -0.17 -3.73 0.06 0.00 1.34 0.00 0.00 72.50 70.00 12e8 s THR 22 CO 0.04 -0.10 0.35 0.00 -0.54 0.00 0.00 174.62 174.37 12e8 s LYS 24 N 1.62 2.78 0.01 0.00 2.20 0.20 -1.00 119.74 125.54 12e8 s LYS 24 Ca -0.07 -0.83 -0.04 0.00 -0.36 0.00 0.00 55.97 54.67 12e8 s LYS 24 Cb -0.10 -2.30 -0.04 0.00 -1.51 0.00 0.00 37.83 33.88 12e8 s LYS 24 CO -0.11 0.35 0.22 0.00 -0.36 0.00 0.00 175.35 175.45 12e8 s ALA 25 N -0.07 3.93 -0.96 3.13 0.00 0.70 0.16 121.76 128.64 12e8 s ALA 25 Ca -0.05 -0.71 0.28 0.00 0.00 0.00 0.00 51.96 51.48 12e8 s ALA 25 Cb -0.14 -1.94 1.15 0.00 0.00 0.00 0.00 23.12 22.18 12e8 s ALA 25 CO 0.04 0.72 1.88 -1.13 0.00 0.00 0.00 175.76 177.28 12e8 n SER 26 N 0.90 0.13 -4.12 0.00 3.41 -0.40 -4.75 113.62 108.79 12e8 n SER 26 Ca -0.10 0.47 -0.08 0.00 -0.26 0.00 0.00 58.87 58.90 12e8 n SER 26 Cb 0.52 -0.50 -0.10 0.00 -0.26 0.00 0.00 64.21 63.88 12e8 n SER 26 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 12e8 s GLN 27 N -3.01 0.75 -0.20 4.33 -0.21 -1.26 -4.98 119.66 115.08 12e8 s GLN 27 Ca 0.13 -1.31 -0.29 0.00 0.02 0.00 0.00 55.36 53.91 12e8 s GLN 27 Cb 0.18 0.16 -0.04 0.00 1.00 0.00 0.00 33.01 34.32 12e8 s GLN 27 CO 0.55 -0.15 1.74 1.21 -2.12 0.00 0.00 175.29 176.52 12e8 s ASN 28 N -2.98 6.25 0.00 5.90 2.47 -1.26 -4.60 114.94 120.71 12e8 s ASN 28 Ca 0.14 1.76 0.12 0.00 0.42 0.00 0.00 52.86 55.29 12e8 s ASN 28 Cb 0.08 -2.53 0.31 0.00 -1.45 0.00 0.00 41.25 37.66 12e8 s ASN 28 CO -0.05 -1.34 1.24 1.33 -3.72 0.00 0.00 177.10 174.55 12e8 n VAL 29 N 6.52 0.88 0.00 -5.21 0.24 -0.50 -5.02 118.33 115.24 12e8 n VAL 29 Ca 0.20 -0.94 0.00 0.00 -2.04 0.00 0.00 64.34 61.57 12e8 n VAL 29 Cb 0.45 0.59 0.00 0.00 -1.47 0.00 0.00 33.84 33.41 12e8 n VAL 29 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 12e8 n GLY 30 N 0.64 2.86 0.35 7.63 0.00 -1.26 -1.78 105.19 113.63 12e8 n GLY 30 Ca 0.12 -0.23 0.07 0.00 0.00 0.00 0.00 46.02 45.99 12e8 n GLY 30 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 12e8 n THR 31 N 0.00 1.69 -1.35 2.61 -2.24 -1.26 -1.47 114.28 112.25 12e8 n THR 31 Ca 0.00 -1.73 -0.38 0.00 -2.27 0.00 0.00 64.05 59.67 12e8 n THR 31 Cb 0.00 0.01 -0.02 0.00 -2.10 0.00 0.00 70.33 68.22 12e8 n THR 31 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 12e8 n ALA 32 N -0.73 6.24 -2.80 6.98 0.00 -0.73 -1.68 120.51 127.79 12e8 n ALA 32 Ca 0.13 -3.42 -0.15 0.00 0.00 0.00 0.00 53.44 50.01 12e8 n ALA 32 Cb 0.60 -3.40 -0.13 0.00 0.00 0.00 0.00 19.45 16.52 12e8 n ALA 32 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 12e8 s VAL 33 N 2.87 0.54 0.11 0.00 1.01 -1.26 -1.53 120.40 122.14 12e8 s VAL 33 Ca 0.58 -0.72 0.05 0.00 0.00 0.00 0.00 61.98 61.89 12e8 s VAL 33 Cb 0.15 -0.54 -0.04 0.00 0.00 0.00 0.00 36.38 35.96 12e8 s VAL 33 CO -0.05 -0.14 -0.13 0.00 0.00 0.00 0.00 175.10 174.77 12e8 s ALA 34 N -0.82 1.37 -0.03 5.51 0.00 -0.33 -0.83 121.76 126.62 12e8 s ALA 34 Ca -0.04 -1.25 0.07 0.00 0.00 0.00 0.00 51.96 50.74 12e8 s ALA 34 Cb -0.07 -0.05 -0.01 0.00 0.00 0.00 0.00 23.12 22.99 12e8 s ALA 34 CO 0.00 0.06 -0.24 -1.58 0.00 0.00 0.00 175.76 174.00 12e8 s TRP 35 N -2.20 2.27 0.09 0.00 0.52 0.57 -1.28 118.94 118.92 12e8 s TRP 35 Ca 0.07 -0.54 0.09 0.00 0.02 0.00 0.00 56.10 55.75 12e8 s TRP 35 Cb -0.04 -1.48 -0.03 0.00 -1.15 0.00 0.00 33.47 30.76 12e8 s TRP 35 CO 0.02 -0.11 -0.23 0.71 0.02 0.00 0.00 176.95 177.35 12e8 s TYR 36 N -0.39 2.02 -0.09 -1.98 2.02 0.10 -0.62 117.35 118.41 12e8 s TYR 36 Ca 0.04 -0.40 0.00 0.00 -0.37 0.00 0.00 57.07 56.34 12e8 s TYR 36 Cb -0.11 -1.13 -0.03 0.00 -0.40 0.00 0.00 41.96 40.29 12e8 s TYR 36 CO 0.01 0.22 -0.09 -1.14 -1.57 0.00 0.00 175.55 172.98 12e8 s GLN 37 N -1.75 3.01 -0.01 -0.62 0.74 -0.09 -1.29 119.66 119.66 12e8 s GLN 37 Ca 0.10 -0.60 0.00 0.00 0.05 0.00 0.00 55.36 54.91 12e8 s GLN 37 Cb -0.10 -2.62 0.01 0.00 1.10 0.00 0.00 33.01 31.40 12e8 s GLN 37 CO 0.04 0.48 0.01 -1.14 -0.55 0.00 0.00 175.29 174.13 12e8 s GLN 38 N -0.32 0.04 0.24 1.67 0.74 0.58 -0.56 119.66 122.05 12e8 s GLN 38 Ca 0.04 0.05 0.10 0.00 0.05 0.00 0.00 55.36 55.60 12e8 s GLN 38 Cb -0.13 -0.14 -0.04 0.00 1.10 0.00 0.00 33.01 33.80 12e8 s GLN 38 CO 0.02 -0.05 -0.10 0.15 -0.55 0.00 0.00 175.29 174.76 12e8 s LYS 39 N 0.39 2.02 0.08 1.67 1.02 -1.26 -0.62 119.74 123.04 12e8 s LYS 39 Ca -0.03 -1.48 -0.34 0.00 0.02 0.00 0.00 55.97 54.14 12e8 s LYS 39 Cb -0.05 -2.04 -0.13 0.00 -0.52 0.00 0.00 37.83 35.09 12e8 s LYS 39 CO -0.01 0.38 1.67 -2.30 -0.92 0.00 0.00 175.35 174.16 12e8 n PRO 40 N -0.49 2.14 -1.10 -1.68 -0.02 -1.26 -1.85 135.00 130.74 12e8 n PRO 40 Ca -0.08 0.77 -0.04 0.00 -2.02 0.00 0.00 63.50 62.14 12e8 n PRO 40 Cb 0.58 -2.56 -0.02 0.00 -0.02 0.00 0.00 33.50 31.48 12e8 n PRO 40 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 12e8 n GLY 41 N 3.70 0.47 3.56 -1.23 0.00 -1.26 -4.98 105.19 105.45 12e8 n GLY 41 Ca 0.19 -0.07 -0.24 0.00 0.00 0.00 0.00 46.02 45.89 12e8 n GLY 41 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 12e8 s GLN 42 N -1.86 1.96 0.29 1.61 -0.21 -0.77 -5.11 119.66 115.58 12e8 s GLN 42 Ca 0.00 -1.68 -0.29 0.00 0.02 0.00 0.00 55.36 53.41 12e8 s GLN 42 Cb 0.00 -1.91 -0.11 0.00 1.00 0.00 0.00 33.01 31.99 12e8 s GLN 42 CO 0.00 0.28 1.45 -1.12 -2.12 0.00 0.00 175.29 173.78 12e8 s SER 43 N -3.61 6.57 0.94 5.90 0.01 -1.26 -4.57 113.70 117.67 12e8 s SER 43 Ca 0.32 2.79 -0.12 0.00 1.31 0.00 0.00 55.95 60.25 12e8 s SER 43 Cb -0.04 -2.64 0.09 0.00 0.21 0.00 0.00 66.02 63.64 12e8 s SER 43 CO 0.18 -0.74 0.72 -2.65 0.41 0.00 0.00 173.24 171.15 12e8 n PRO 44 N 1.71 -0.40 -4.07 12.44 -0.02 -1.26 -4.68 135.00 138.72 12e8 n PRO 44 Ca 0.05 -0.06 -0.15 0.00 -2.02 0.00 0.00 63.50 61.31 12e8 n PRO 44 Cb 0.40 -2.08 -0.14 0.00 -0.02 0.00 0.00 33.50 31.65 12e8 n PRO 44 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 12e8 s LYS 45 N -4.07 0.31 -0.04 -0.52 1.02 0.28 -4.94 119.74 111.79 12e8 s LYS 45 Ca 0.61 -0.12 -0.30 0.00 0.02 0.00 0.00 55.97 56.19 12e8 s LYS 45 Cb -0.22 -0.32 -0.04 0.00 -0.52 0.00 0.00 37.83 36.73 12e8 s LYS 45 CO 0.63 0.06 1.31 -1.17 -0.92 0.00 0.00 175.35 175.27 12e8 s LEU 46 N 0.02 4.29 -0.12 3.17 2.96 -1.26 -0.91 118.68 126.83 12e8 s LEU 46 Ca 0.00 1.96 -0.07 0.00 -0.22 0.00 0.00 54.13 55.81 12e8 s LEU 46 Cb -0.03 -3.56 -0.05 0.00 0.50 0.00 0.00 46.19 43.05 12e8 s LEU 46 CO -0.00 -0.67 -0.17 0.23 -1.32 0.00 0.00 176.35 174.42 12e8 n MET 47 N 5.45 0.27 -4.29 1.98 2.81 0.21 -4.72 117.12 118.83 12e8 n MET 47 Ca 0.12 0.12 -0.19 0.00 -1.81 0.00 0.00 57.70 55.94 12e8 n MET 47 Cb 0.45 -0.95 -0.13 0.00 -0.71 0.00 0.00 33.22 31.87 12e8 n MET 47 CO 0.00 0.00 0.00 0.42 1.51 0.00 0.00 175.97 177.90 12e8 s ILE 48 N -2.24 1.05 0.09 2.02 -1.09 -1.09 -1.33 121.20 118.60 12e8 s ILE 48 Ca -0.18 -1.03 -0.04 0.00 -2.23 0.00 0.00 60.65 57.17 12e8 s ILE 48 Cb 0.07 -0.97 -0.03 0.00 -1.58 0.00 0.00 42.46 39.95 12e8 s ILE 48 CO 0.22 -0.06 0.07 -0.72 -1.23 0.00 0.00 174.94 173.23 12e8 s TYR 49 N -0.93 0.47 -1.47 3.97 -0.85 0.20 -0.31 117.35 118.43 12e8 s TYR 49 Ca 0.00 -0.94 -0.06 0.00 -0.52 0.00 0.00 57.07 55.55 12e8 s TYR 49 Cb -0.08 -0.29 0.03 0.00 0.38 0.00 0.00 41.96 42.00 12e8 s TYR 49 CO 0.01 -0.48 0.60 0.43 -1.52 0.00 0.00 175.55 174.59 12e8 n SER 50 N -0.00 -5.40 0.00 -0.18 7.64 -0.31 -1.11 113.62 114.26 12e8 n SER 50 Ca -0.12 -0.33 0.00 0.00 1.01 0.00 0.00 58.87 59.43 12e8 n SER 50 Cb 0.62 -4.38 0.00 0.00 -1.01 0.00 0.00 64.21 59.44 12e8 n SER 50 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 12e8 n ALA 51 N -3.61 0.00 -0.86 -0.43 0.00 -0.01 -4.24 120.51 111.36 12e8 n ALA 51 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.36 12e8 n ALA 51 Cb 0.59 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.04 12e8 n ALA 51 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 12e8 n SER 52 N 0.23 0.20 -4.78 0.00 3.41 -1.17 -2.44 113.62 109.07 12e8 n SER 52 Ca 0.00 -1.06 -0.37 0.00 -0.26 0.00 0.00 58.87 57.19 12e8 n SER 52 Cb 0.00 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 63.88 12e8 n SER 52 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 12e8 s ASN 53 N -0.06 6.45 0.01 4.04 0.01 -0.27 -4.40 114.94 120.73 12e8 s ASN 53 Ca 0.00 0.53 -0.28 0.00 -0.71 0.00 0.00 52.86 52.41 12e8 s ASN 53 Cb 0.00 -2.16 -0.04 0.00 0.41 0.00 0.00 41.25 39.46 12e8 s ASN 53 CO 0.00 0.21 0.87 -0.60 -1.51 0.00 0.00 177.10 176.07 12e8 s ARG 54 N -0.11 4.54 0.59 -0.60 3.52 -1.26 -0.63 118.95 125.01 12e8 s ARG 54 Ca 0.16 1.23 -0.16 0.00 -0.13 0.00 0.00 55.73 56.83 12e8 s ARG 54 Cb -0.13 -3.43 -0.04 0.00 -1.56 0.00 0.00 34.95 29.79 12e8 s ARG 54 CO 0.05 0.07 1.07 -0.47 -0.81 0.00 0.00 175.30 175.21 12e8 s TYR 55 N 0.64 2.89 0.22 5.12 5.04 -0.44 -4.91 117.35 125.90 12e8 s TYR 55 Ca 0.45 1.53 -0.31 0.00 -2.44 0.00 0.00 57.07 56.31 12e8 s TYR 55 Cb -0.20 -3.07 -0.15 0.00 0.35 0.00 0.00 41.96 38.88 12e8 s TYR 55 CO 0.25 -1.24 1.09 2.41 -1.34 0.00 0.00 175.55 176.72 12e8 n THR 56 N -1.93 1.38 0.00 4.34 -1.04 -1.26 -2.30 114.28 113.47 12e8 n THR 56 Ca 0.09 -0.34 0.00 0.00 -2.04 0.00 0.00 64.05 61.76 12e8 n THR 56 Cb 0.52 -0.90 0.00 0.00 -1.82 0.00 0.00 70.33 68.13 12e8 n THR 56 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 12e8 n GLY 57 N 1.71 2.87 3.76 3.41 0.00 -1.26 -5.00 105.19 110.68 12e8 n GLY 57 Ca 0.13 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 12e8 n GLY 57 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 12e8 s VAL 58 N -1.56 3.65 0.74 1.61 0.11 -0.97 -4.98 120.40 118.99 12e8 s VAL 58 Ca 0.00 1.64 -0.14 0.00 -2.93 0.00 0.00 61.98 60.55 12e8 s VAL 58 Cb 0.00 -4.04 0.04 0.00 -1.53 0.00 0.00 36.38 30.86 12e8 s VAL 58 CO 0.00 0.38 1.18 -2.84 -3.33 0.00 0.00 175.10 170.49 12e8 s PRO 59 N -1.42 2.13 0.00 1.54 0.02 -1.26 -4.87 135.00 131.14 12e8 s PRO 59 Ca 0.44 1.66 0.11 0.00 0.02 0.00 0.00 61.00 63.23 12e8 s PRO 59 Cb -0.30 -1.84 0.55 0.00 0.02 0.00 0.00 34.50 32.92 12e8 s PRO 59 CO 0.38 -1.82 1.27 -0.25 -0.33 0.00 0.00 177.00 176.26 12e8 n ASP 60 N -2.85 0.00 0.00 2.53 8.00 -1.26 -2.68 116.55 120.29 12e8 n ASP 60 Ca 0.13 0.19 0.13 0.00 0.71 0.00 0.00 54.79 55.95 12e8 n ASP 60 Cb 0.51 -0.32 0.63 0.00 -0.02 0.00 0.00 41.12 41.91 12e8 n ASP 60 CO 0.00 0.00 0.00 -2.11 -0.39 0.00 0.00 177.20 174.70 12e8 n ARG 61 N -1.32 0.15 -3.59 -1.24 1.85 -1.26 -4.70 116.66 106.54 12e8 n ARG 61 Ca 0.05 0.03 -0.36 0.00 -1.00 0.00 0.00 57.85 56.56 12e8 n ARG 61 Cb 0.10 -1.50 -0.07 0.00 -1.05 0.00 0.00 32.46 29.93 12e8 n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 12e8 s PHE 62 N -2.85 3.45 0.13 2.89 0.08 -1.09 -0.89 117.98 119.71 12e8 s PHE 62 Ca 0.18 0.53 -0.02 0.00 0.12 0.00 0.00 56.93 57.74 12e8 s PHE 62 Cb 0.18 -2.29 -0.04 0.00 -0.57 0.00 0.00 43.02 40.30 12e8 s PHE 62 CO 0.47 0.26 0.08 0.95 -0.10 0.00 0.00 175.22 176.88 12e8 s THR 63 N 0.42 0.10 0.05 0.64 -4.23 -0.25 -4.89 115.64 107.48 12e8 s THR 63 Ca 0.14 -1.83 -0.05 0.00 -1.18 0.00 0.00 61.69 58.78 12e8 s THR 63 Cb -0.12 -1.98 -0.02 0.00 1.34 0.00 0.00 72.50 71.72 12e8 s THR 63 CO 0.02 -0.47 0.08 -0.83 -0.54 0.00 0.00 174.62 172.88 12e8 s GLY 64 N -3.03 0.24 0.29 3.99 0.00 -1.26 -0.54 107.32 107.02 12e8 s GLY 64 Ca 0.22 -0.77 -0.13 0.00 0.00 0.00 0.00 44.72 44.05 12e8 s GLY 64 CO 0.01 -0.91 0.57 -1.35 0.00 0.00 0.00 173.10 171.42 12e8 s SER 65 N -2.54 0.10 0.00 1.64 1.04 -0.35 -4.15 113.70 109.43 12e8 s SER 65 Ca 0.01 -1.03 0.00 0.00 0.48 0.00 0.00 55.95 55.41 12e8 s SER 65 Cb 0.03 0.67 0.00 0.00 0.10 0.00 0.00 66.02 66.82 12e8 s SER 65 CO -0.08 -1.30 0.00 0.61 0.98 0.00 0.00 173.24 173.45 12e8 n GLY 66 N -0.46 1.73 3.61 7.32 0.00 -1.26 -1.37 105.19 114.76 12e8 n GLY 66 Ca -0.03 -2.15 0.00 0.00 0.00 0.00 0.00 46.02 43.84 12e8 n GLY 66 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 12e8 s SER 67 N 0.00 -0.06 0.19 1.61 1.04 -0.91 -4.87 113.70 110.70 12e8 s SER 67 Ca 0.00 -0.06 0.00 0.00 0.48 0.00 0.00 55.95 56.37 12e8 s SER 67 Cb 0.00 0.11 0.00 0.00 0.10 0.00 0.00 66.02 66.23 12e8 s SER 67 CO 0.00 -0.20 0.00 0.61 0.98 0.00 0.00 173.24 174.63 12e8 n GLY 68 N -0.33 1.59 0.00 7.32 0.00 -0.54 -3.13 105.19 110.09 12e8 n GLY 68 Ca -0.05 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.12 12e8 n GLY 68 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 12e8 n THR 69 N 0.00 0.00 -4.25 2.61 -2.24 -1.26 -1.41 114.28 107.73 12e8 n THR 69 Ca 0.00 -0.23 -0.34 0.00 -2.27 0.00 0.00 64.05 61.21 12e8 n THR 69 Cb 0.00 0.90 -0.15 0.00 -2.10 0.00 0.00 70.33 68.98 12e8 n THR 69 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 12e8 s ASP 70 N -0.61 3.65 0.10 3.42 1.01 -1.18 -0.22 116.67 122.84 12e8 s ASP 70 Ca 0.00 -0.51 0.06 0.00 0.71 0.00 0.00 52.55 52.81 12e8 s ASP 70 Cb 0.00 -1.58 -0.03 0.00 1.01 0.00 0.00 42.92 42.32 12e8 s ASP 70 CO 0.00 0.03 -0.14 -0.36 0.21 0.00 0.00 175.17 174.91 12e8 s PHE 71 N 1.12 1.35 -0.07 4.23 0.40 -0.17 -2.15 117.98 122.70 12e8 s PHE 71 Ca 0.01 -0.52 -0.04 0.00 -0.60 0.00 0.00 56.93 55.78 12e8 s PHE 71 Cb -0.14 -0.73 0.03 0.00 0.51 0.00 0.00 43.02 42.70 12e8 s PHE 71 CO -0.05 0.11 0.16 0.99 0.70 0.00 0.00 175.22 177.14 12e8 s THR 72 N -1.82 -0.04 -0.20 0.64 2.01 -0.47 -1.25 115.64 114.51 12e8 s THR 72 Ca 0.05 0.14 -0.08 0.00 0.31 0.00 0.00 61.69 62.10 12e8 s THR 72 Cb -0.07 -0.26 -0.04 0.00 0.01 0.00 0.00 72.50 72.14 12e8 s THR 72 CO 0.03 0.06 0.09 -0.22 -0.69 0.00 0.00 174.62 173.88 12e8 s LEU 73 N 0.94 3.88 -0.09 4.42 2.96 -0.02 -1.21 118.68 129.56 12e8 s LEU 73 Ca -0.07 0.08 0.04 0.00 -0.22 0.00 0.00 54.13 53.96 12e8 s LEU 73 Cb -0.09 -2.00 -0.00 0.00 0.50 0.00 0.00 46.19 44.60 12e8 s LEU 73 CO -0.05 0.14 -0.24 -0.89 -1.32 0.00 0.00 176.35 173.99 12e8 s THR 74 N 0.60 2.03 -0.24 3.68 2.01 0.30 -0.43 115.64 123.59 12e8 s THR 74 Ca 0.05 -1.01 -0.04 0.00 0.31 0.00 0.00 61.69 60.99 12e8 s THR 74 Cb -0.13 -1.75 0.00 0.00 0.01 0.00 0.00 72.50 70.63 12e8 s THR 74 CO 0.01 0.56 -0.01 -0.63 -0.69 0.00 0.00 174.62 173.85 12e8 s ILE 75 N 0.28 3.45 0.04 1.82 1.01 0.70 -1.09 121.20 127.41 12e8 s ILE 75 Ca -0.17 -0.62 -0.13 0.00 0.00 0.00 0.00 60.65 59.73 12e8 s ILE 75 Cb -0.17 -2.65 -0.06 0.00 0.01 0.00 0.00 42.46 39.59 12e8 s ILE 75 CO 0.08 0.30 0.41 -0.44 0.00 0.00 0.00 174.94 175.30 12e8 s SER 76 N 1.46 6.74 -1.08 3.58 0.01 -0.07 -0.28 113.70 124.06 12e8 s SER 76 Ca 0.04 0.90 -0.18 0.00 1.31 0.00 0.00 55.95 58.01 12e8 s SER 76 Cb -0.15 -2.22 -0.00 0.00 0.21 0.00 0.00 66.02 63.85 12e8 s SER 76 CO -0.02 0.24 0.76 -3.20 0.41 0.00 0.00 173.24 171.43 12e8 n ASN 77 N 1.35 -5.40 -4.62 2.44 5.15 -1.17 -4.77 115.26 108.24 12e8 n ASN 77 Ca -0.11 -0.96 -0.43 0.00 -0.60 0.00 0.00 54.58 52.48 12e8 n ASN 77 Cb 0.52 -3.21 -0.00 0.00 -0.53 0.00 0.00 39.78 36.56 12e8 n ASN 77 CO 0.00 0.00 0.00 0.80 1.40 0.00 0.00 177.26 179.46 12e8 n MET 78 N -3.91 1.54 -4.36 1.20 0.00 0.01 -4.54 117.12 107.07 12e8 n MET 78 Ca -0.11 0.55 -0.24 0.00 -0.00 0.00 0.00 57.70 57.89 12e8 n MET 78 Cb 0.59 -2.04 -0.09 0.00 0.00 0.00 0.00 33.22 31.69 12e8 n MET 78 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 175.97 175.32 12e8 s GLN 79 N -1.81 2.05 0.28 2.12 -1.52 -1.26 -0.77 119.66 118.74 12e8 s GLN 79 Ca 0.59 -1.68 0.00 0.00 -1.95 0.00 0.00 55.36 52.32 12e8 s GLN 79 Cb -0.61 -1.94 0.53 0.00 -0.22 0.00 0.00 33.01 30.77 12e8 s GLN 79 CO 0.59 0.22 1.82 0.77 -0.25 0.00 0.00 175.29 178.45 12e8 h SER 80 N 1.91 0.86 0.35 5.90 0.02 -1.98 0.06 113.55 120.68 12e8 h SER 80 Ca -0.43 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.58 12e8 h SER 80 Cb 1.25 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 63.68 12e8 h SER 80 CO 0.64 0.45 0.00 1.05 -1.14 0.00 0.00 176.83 177.83 12e8 h GLU 81 N 0.93 0.00 0.00 3.45 4.11 -2.02 -2.56 114.58 118.49 12e8 h GLU 81 Ca 0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.91 12e8 h GLU 81 Cb 0.49 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.74 12e8 h GLU 81 CO -0.27 0.00 0.00 -0.25 0.07 0.00 0.00 179.01 178.56 12e8 n ASP 82 N -2.69 0.00 -4.61 3.06 8.00 0.01 -4.71 116.55 115.61 12e8 n ASP 82 Ca -0.01 0.19 -0.43 0.00 0.71 0.00 0.00 54.79 55.25 12e8 n ASP 82 Cb 0.14 -0.38 -0.02 0.00 -0.02 0.00 0.00 41.12 40.84 12e8 n ASP 82 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 12e8 s LEU 83 N -2.76 3.69 0.00 0.64 1.43 -0.97 -4.86 118.68 115.86 12e8 s LEU 83 Ca 0.18 1.19 -0.23 0.00 -1.03 0.00 0.00 54.13 54.24 12e8 s LEU 83 Cb 0.16 -3.53 0.08 0.00 0.03 0.00 0.00 46.19 42.92 12e8 s LEU 83 CO 0.39 -1.39 1.05 0.00 0.23 0.00 0.00 176.35 176.63 12e8 n ALA 84 N 8.85 -2.93 -2.45 4.21 0.00 -1.24 -4.97 120.51 121.98 12e8 n ALA 84 Ca 0.18 -0.74 -0.35 0.00 0.00 0.00 0.00 53.44 52.53 12e8 n ALA 84 Cb 0.47 0.21 -0.06 0.00 0.00 0.00 0.00 19.45 20.07 12e8 n ALA 84 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 12e8 s ASP 85 N -3.37 6.76 -0.01 0.00 1.11 0.21 -1.19 116.67 120.18 12e8 s ASP 85 Ca 0.25 0.96 0.05 0.00 0.18 0.00 0.00 52.55 53.99 12e8 s ASP 85 Cb -0.01 -2.24 -0.01 0.00 1.07 0.00 0.00 42.92 41.72 12e8 s ASP 85 CO 0.01 0.14 -0.15 -0.31 1.18 0.00 0.00 175.17 176.04 12e8 s TYR 86 N -1.42 1.33 -0.06 4.23 1.51 0.05 -0.30 117.35 122.69 12e8 s TYR 86 Ca 0.35 -0.26 -0.07 0.00 -1.01 0.00 0.00 57.07 56.08 12e8 s TYR 86 Cb -0.15 -0.86 0.02 0.00 -0.11 0.00 0.00 41.96 40.86 12e8 s TYR 86 CO 0.18 -0.02 0.20 -0.59 -1.11 0.00 0.00 175.55 174.21 12e8 s PHE 87 N -0.38 -0.17 0.49 2.71 -0.71 -0.41 -1.02 117.98 118.49 12e8 s PHE 87 Ca 0.06 0.40 0.00 0.00 -1.04 0.00 0.00 56.93 56.35 12e8 s PHE 87 Cb -0.06 0.05 0.01 0.00 -1.21 0.00 0.00 43.02 41.81 12e8 s PHE 87 CO -0.00 -0.16 0.72 0.00 -1.34 0.00 0.00 175.22 174.44 12e8 s GLN 89 N -4.66 0.58 0.04 0.00 0.74 -0.41 -1.05 119.66 114.90 12e8 s GLN 89 Ca 0.52 0.67 0.01 0.00 0.05 0.00 0.00 55.36 56.61 12e8 s GLN 89 Cb -0.10 0.28 -0.04 0.00 1.10 0.00 0.00 33.01 34.25 12e8 s GLN 89 CO 0.39 -0.07 0.08 1.14 -0.55 0.00 0.00 175.29 176.27 12e8 s GLN 90 N 0.23 2.98 -0.12 1.67 1.03 -0.80 -1.19 119.66 123.46 12e8 s GLN 90 Ca -0.00 -0.58 0.21 0.00 0.04 0.00 0.00 55.36 55.02 12e8 s GLN 90 Cb -0.03 -2.79 0.45 0.00 0.03 0.00 0.00 33.01 30.66 12e8 s GLN 90 CO 0.01 0.61 1.17 2.48 -2.54 0.00 0.00 175.29 177.02 12e8 n TYR 91 N 0.84 0.46 -0.13 9.60 0.18 -0.58 -3.56 117.16 123.97 12e8 n TYR 91 Ca -0.11 -1.16 -0.12 0.00 1.88 0.00 0.00 57.90 58.39 12e8 n TYR 91 Cb 0.52 -0.20 -0.02 0.00 -0.38 0.00 0.00 39.34 39.26 12e8 n TYR 91 CO 0.00 0.00 0.00 1.03 -2.08 0.00 0.00 176.86 175.81 12e8 h SER 92 N 1.40 0.85 -5.18 9.48 0.87 -1.85 -3.47 113.55 115.64 12e8 h SER 92 Ca -0.12 -0.41 0.12 0.00 -1.23 0.00 0.00 61.79 60.16 12e8 h SER 92 Cb 1.56 -0.23 -0.06 0.00 -0.44 0.00 0.00 62.40 63.22 12e8 h SER 92 CO 0.15 1.07 0.38 -0.94 -0.53 0.00 0.00 176.83 176.95 12e8 s SER 93 N -6.54 -0.19 0.35 6.23 1.04 -1.26 -5.13 113.70 108.20 12e8 s SER 93 Ca -0.12 -0.54 -0.10 0.00 0.48 0.00 0.00 55.95 55.66 12e8 s SER 93 Cb 0.10 0.61 -0.07 0.00 0.10 0.00 0.00 66.02 66.76 12e8 s SER 93 CO 0.84 -1.13 0.71 -0.31 0.98 0.00 0.00 173.24 174.32 12e8 s TYR 94 N -3.43 3.45 0.44 5.02 2.02 -1.26 -3.89 117.35 119.69 12e8 s TYR 94 Ca 0.12 1.00 -0.22 0.00 -0.37 0.00 0.00 57.07 57.60 12e8 s TYR 94 Cb -0.03 -2.39 -0.09 0.00 -0.40 0.00 0.00 41.96 39.05 12e8 s TYR 94 CO 0.05 0.02 1.03 -1.25 -1.57 0.00 0.00 175.55 173.82 12e8 s PRO 95 N -3.52 4.04 0.35 -1.71 0.04 -1.26 -4.92 135.00 128.02 12e8 s PRO 95 Ca 0.50 1.39 -0.29 0.00 0.04 0.00 0.00 61.00 62.65 12e8 s PRO 95 Cb -0.10 -2.32 -0.11 0.00 0.04 0.00 0.00 34.50 32.01 12e8 s PRO 95 CO 0.27 -0.23 1.43 -0.51 0.04 0.00 0.00 177.00 178.00 12e8 s LEU 96 N -3.04 4.36 0.08 -3.56 1.43 -1.25 -4.66 118.68 112.04 12e8 s LEU 96 Ca 0.62 2.89 0.03 0.00 -1.03 0.00 0.00 54.13 56.64 12e8 s LEU 96 Cb -0.18 -3.66 -0.03 0.00 0.03 0.00 0.00 46.19 42.35 12e8 s LEU 96 CO 0.22 -0.75 -0.09 0.42 0.23 0.00 0.00 176.35 176.39 12e8 s THR 97 N -0.98 0.79 0.20 5.49 -4.23 -1.23 -5.03 115.64 110.64 12e8 s THR 97 Ca 0.52 -1.49 0.10 0.00 -1.18 0.00 0.00 61.69 59.65 12e8 s THR 97 Cb -0.44 -1.16 -0.04 0.00 1.34 0.00 0.00 72.50 72.20 12e8 s THR 97 CO 0.57 -0.53 -0.21 -0.36 -0.54 0.00 0.00 174.62 173.55 12e8 s PHE 98 N -2.22 2.11 0.77 3.99 0.40 -1.26 -1.91 117.98 119.86 12e8 s PHE 98 Ca 0.01 -0.40 -0.12 0.00 -0.60 0.00 0.00 56.93 55.82 12e8 s PHE 98 Cb -0.04 -1.02 0.06 0.00 0.51 0.00 0.00 43.02 42.52 12e8 s PHE 98 CO -0.01 0.47 1.11 0.20 0.70 0.00 0.00 175.22 177.70 12e8 s GLY 99 N -2.84 1.62 0.00 4.36 0.00 -0.21 -4.46 107.32 105.78 12e8 s GLY 99 Ca 0.21 -0.31 0.31 0.00 0.00 0.00 0.00 44.72 44.93 12e8 s GLY 99 CO 0.09 0.11 2.13 0.00 0.00 0.00 0.00 173.10 175.44 12e8 n ALA 100 N -3.29 2.65 0.00 3.20 0.00 -1.26 -4.68 120.51 117.12 12e8 n ALA 100 Ca 0.07 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.29 12e8 n ALA 100 Cb 0.57 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.55 12e8 n ALA 100 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 12e8 n GLY 101 N 1.09 0.33 2.94 0.00 0.00 -1.26 -5.04 105.19 103.24 12e8 n GLY 101 Ca 0.21 -1.58 -0.24 0.00 0.00 0.00 0.00 46.02 44.41 12e8 n GLY 101 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 12e8 s THR 102 N -2.76 0.91 -0.24 2.61 2.01 -0.19 -4.52 115.64 113.46 12e8 s THR 102 Ca 0.00 -0.29 -0.10 0.00 0.31 0.00 0.00 61.69 61.61 12e8 s THR 102 Cb 0.00 -0.90 -0.05 0.00 0.01 0.00 0.00 72.50 71.57 12e8 s THR 102 CO 0.00 0.32 0.14 -0.75 -0.69 0.00 0.00 174.62 173.64 12e8 s LYS 103 N 1.17 3.98 -0.18 4.92 2.20 0.41 -0.77 119.74 131.47 12e8 s LYS 103 Ca -0.06 -0.32 -0.25 0.00 -0.36 0.00 0.00 55.97 54.99 12e8 s LYS 103 Cb -0.14 -3.48 -0.01 0.00 -1.51 0.00 0.00 37.83 32.69 12e8 s LYS 103 CO -0.02 0.02 0.82 -0.51 -0.36 0.00 0.00 175.35 175.30 12e8 s LEU 104 N 1.14 4.16 0.35 5.43 1.02 -0.33 -1.66 118.68 128.79 12e8 s LEU 104 Ca 0.07 1.14 0.09 0.00 0.02 0.00 0.00 54.13 55.44 12e8 s LEU 104 Cb -0.14 -3.21 -0.07 0.00 0.02 0.00 0.00 46.19 42.79 12e8 s LEU 104 CO 0.05 -0.40 -0.08 -1.61 0.02 0.00 0.00 176.35 174.33 12e8 s GLU 105 N 2.20 1.81 0.01 1.70 2.02 0.12 -3.69 118.70 122.88 12e8 s GLU 105 Ca 0.37 -1.95 -0.15 0.00 0.02 0.00 0.00 54.97 53.26 12e8 s GLU 105 Cb -0.16 -1.64 -0.06 0.00 0.10 0.00 0.00 34.13 32.37 12e8 s GLU 105 CO 0.12 0.10 0.44 -1.17 0.02 0.00 0.00 175.26 174.76 12e8 s LEU 106 N -3.61 4.49 0.02 1.80 2.96 -1.26 0.02 118.68 123.09 12e8 s LEU 106 Ca 0.33 1.02 -0.13 0.00 -0.22 0.00 0.00 54.13 55.13 12e8 s LEU 106 Cb 0.04 -2.64 -0.06 0.00 0.50 0.00 0.00 46.19 44.03 12e8 s LEU 106 CO 0.16 0.32 0.40 -0.54 -1.32 0.00 0.00 176.35 175.36 12e8 s LYS 107 N -1.09 3.85 0.18 1.98 1.02 -0.30 -4.77 119.74 120.62 12e8 s LYS 107 Ca 0.25 0.32 -0.01 0.00 0.02 0.00 0.00 55.97 56.54 12e8 s LYS 107 Cb -0.17 -3.15 0.01 0.00 -0.52 0.00 0.00 37.83 34.00 12e8 s LYS 107 CO 0.14 0.65 0.26 2.89 -0.92 0.00 0.00 175.35 178.38 12e8 n ARG 108 N 1.53 0.38 -2.36 1.68 1.85 -1.26 -4.96 116.66 113.52 12e8 n ARG 108 Ca -0.12 -1.44 -0.39 0.00 -1.00 0.00 0.00 57.85 54.90 12e8 n ARG 108 Cb 0.52 1.41 -0.03 0.00 -1.05 0.00 0.00 32.46 33.31 12e8 n ARG 108 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 12e8 s ALA 109 N -2.16 3.22 0.47 2.89 0.00 -1.26 -4.99 121.76 119.93 12e8 s ALA 109 Ca 0.15 0.93 -0.25 0.00 0.00 0.00 0.00 51.96 52.79 12e8 s ALA 109 Cb -0.01 -3.36 -0.08 0.00 0.00 0.00 0.00 23.12 19.68 12e8 s ALA 109 CO 0.11 -0.41 1.44 -0.51 0.00 0.00 0.00 175.76 176.38 12e8 s ASP 110 N -1.10 5.76 -0.01 0.00 1.01 -1.26 -4.77 116.67 116.30 12e8 s ASP 110 Ca 0.54 2.94 0.00 0.00 0.71 0.00 0.00 52.55 56.74 12e8 s ASP 110 Cb -0.30 -2.65 0.01 0.00 1.01 0.00 0.00 42.92 40.98 12e8 s ASP 110 CO 0.38 -1.26 -0.00 0.00 0.21 0.00 0.00 175.17 174.50 12e8 s ALA 111 N -1.20 0.14 0.22 5.23 0.00 0.59 -4.89 121.76 121.85 12e8 s ALA 111 Ca 0.63 0.06 -0.27 0.00 0.00 0.00 0.00 51.96 52.37 12e8 s ALA 111 Cb -0.44 -0.13 -0.09 0.00 0.00 0.00 0.00 23.12 22.47 12e8 s ALA 111 CO 0.56 -0.02 0.87 0.00 0.00 0.00 0.00 175.76 177.17 12e8 s ALA 112 N 0.39 3.37 0.52 0.00 0.00 -1.26 -1.21 121.76 123.57 12e8 s ALA 112 Ca -0.03 0.49 -0.19 0.00 0.00 0.00 0.00 51.96 52.23 12e8 s ALA 112 Cb -0.05 -3.09 -0.07 0.00 0.00 0.00 0.00 23.12 19.90 12e8 s ALA 112 CO -0.01 0.24 1.07 -1.25 0.00 0.00 0.00 175.76 175.81 12e8 s PRO 113 N -1.30 3.57 -0.39 0.00 0.04 -1.26 -4.62 135.00 131.03 12e8 s PRO 113 Ca 0.40 1.41 -0.17 0.00 0.04 0.00 0.00 61.00 62.68 12e8 s PRO 113 Cb -0.24 -2.05 0.01 0.00 0.04 0.00 0.00 34.50 32.26 12e8 s PRO 113 CO 0.28 -0.63 0.43 0.99 0.04 0.00 0.00 177.00 178.11 12e8 s THR 114 N -2.01 5.09 -0.13 1.26 2.01 0.08 -4.86 115.64 117.08 12e8 s THR 114 Ca 0.68 -0.14 -0.07 0.00 0.31 0.00 0.00 61.69 62.47 12e8 s THR 114 Cb -0.19 -3.98 -0.04 0.00 0.01 0.00 0.00 72.50 68.31 12e8 s THR 114 CO 0.25 -0.31 0.12 -0.69 -0.69 0.00 0.00 174.62 173.30 12e8 s VAL 115 N 2.16 5.36 -0.06 3.82 1.01 -1.26 -1.40 120.40 130.05 12e8 s VAL 115 Ca 0.13 0.16 -0.04 0.00 0.00 0.00 0.00 61.98 62.23 12e8 s VAL 115 Cb -0.17 -3.35 0.02 0.00 0.00 0.00 0.00 36.38 32.88 12e8 s VAL 115 CO 0.13 0.58 0.14 -0.44 0.00 0.00 0.00 175.10 175.51 12e8 s SER 116 N -0.70 -0.13 0.06 3.32 0.01 -0.75 -4.98 113.70 110.52 12e8 s SER 116 Ca 0.13 0.28 0.09 0.00 1.31 0.00 0.00 55.95 57.77 12e8 s SER 116 Cb -0.12 0.25 -0.03 0.00 0.21 0.00 0.00 66.02 66.34 12e8 s SER 116 CO 0.03 -0.07 -0.26 -0.51 0.41 0.00 0.00 173.24 172.83 12e8 s ILE 117 N 0.37 2.10 -0.04 1.44 2.07 -1.26 -1.02 121.20 124.86 12e8 s ILE 117 Ca -0.02 -1.42 0.02 0.00 -1.41 0.00 0.00 60.65 57.81 12e8 s ILE 117 Cb -0.04 -1.81 0.02 0.00 0.13 0.00 0.00 42.46 40.76 12e8 s ILE 117 CO -0.02 0.30 -0.07 -0.36 -1.91 0.00 0.00 174.94 172.89 12e8 s PHE 118 N -0.85 0.93 0.93 3.50 0.40 0.24 -5.00 117.98 118.12 12e8 s PHE 118 Ca 0.11 -0.28 -0.11 0.00 -0.60 0.00 0.00 56.93 56.05 12e8 s PHE 118 Cb -0.10 -0.74 0.15 0.00 0.51 0.00 0.00 43.02 42.84 12e8 s PHE 118 CO 0.03 -0.19 1.09 -2.14 0.70 0.00 0.00 175.22 174.71 12e8 s PRO 119 N 0.70 1.00 0.34 0.24 0.02 -1.26 -2.28 135.00 133.77 12e8 s PRO 119 Ca -0.11 0.90 -0.27 0.00 0.02 0.00 0.00 61.00 61.54 12e8 s PRO 119 Cb -0.14 -1.77 -0.12 0.00 0.02 0.00 0.00 34.50 32.49 12e8 s PRO 119 CO 0.01 -2.44 1.17 -2.30 -0.33 0.00 0.00 177.00 173.11 12e8 n PRO 120 N -4.03 1.78 -2.79 5.54 -0.02 -1.17 -4.80 135.00 129.52 12e8 n PRO 120 Ca 0.07 0.62 -0.33 0.00 -2.02 0.00 0.00 63.50 61.84 12e8 n PRO 120 Cb 0.55 -2.15 -0.07 0.00 -0.02 0.00 0.00 33.50 31.81 12e8 n PRO 120 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 12e8 s SER 121 N -0.46 6.88 0.42 2.55 1.04 -1.26 -4.92 113.70 117.94 12e8 s SER 121 Ca 0.58 1.71 0.13 0.00 0.48 0.00 0.00 55.95 58.85 12e8 s SER 121 Cb -0.60 -2.54 0.99 0.00 0.10 0.00 0.00 66.02 63.97 12e8 s SER 121 CO 0.61 -0.40 1.94 0.77 0.98 0.00 0.00 173.24 177.14 12e8 h SER 122 N 1.86 0.43 -0.31 7.02 4.64 -1.99 -1.18 113.55 124.03 12e8 h SER 122 Ca -0.49 0.02 -0.02 0.00 -0.47 0.00 0.00 61.79 60.83 12e8 h SER 122 Cb 1.18 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 63.19 12e8 h SER 122 CO 0.61 0.24 0.13 -0.33 -0.87 0.00 0.00 176.83 176.61 12e8 h GLU 123 N 0.47 0.46 -0.44 4.77 5.08 -1.99 -0.03 114.58 122.90 12e8 h GLU 123 Ca 0.33 -0.08 -0.06 0.00 -1.00 0.00 0.00 59.36 58.55 12e8 h GLU 123 Cb 0.66 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.81 12e8 h GLU 123 CO -0.11 0.47 0.03 0.37 -1.00 0.00 0.00 179.01 178.77 12e8 h GLN 124 N 0.36 0.70 -0.48 2.33 4.15 -1.57 -2.68 115.11 117.91 12e8 h GLN 124 Ca 0.10 -0.16 -0.05 0.00 0.77 0.00 0.00 58.65 59.31 12e8 h GLN 124 Cb 0.18 -0.10 -0.02 0.00 0.21 0.00 0.00 27.48 27.75 12e8 h GLN 124 CO -0.01 0.69 0.09 -0.07 -1.93 0.00 0.00 178.83 177.61 12e8 h LEU 125 N 0.67 0.69 -0.68 -2.39 3.38 -0.44 0.38 115.31 116.92 12e8 h LEU 125 Ca 0.14 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.98 12e8 h LEU 125 Cb 0.37 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.94 12e8 h LEU 125 CO 0.01 0.70 0.00 0.35 0.09 0.00 0.00 178.44 179.59 12e8 n THR 126 N -4.28 1.13 1.04 0.22 -2.24 -0.11 -0.87 114.28 109.18 12e8 n THR 126 Ca 0.03 0.44 0.12 0.00 -2.27 0.00 0.00 64.05 62.37 12e8 n THR 126 Cb 0.23 -1.37 0.20 0.00 -2.10 0.00 0.00 70.33 67.29 12e8 n THR 126 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 12e8 n SER 127 N -1.98 0.72 0.00 3.42 7.64 0.11 -4.96 113.62 118.57 12e8 n SER 127 Ca 0.01 -0.52 0.00 0.00 1.01 0.00 0.00 58.87 59.37 12e8 n SER 127 Cb 0.12 0.36 0.00 0.00 -1.01 0.00 0.00 64.21 63.68 12e8 n SER 127 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 12e8 n GLY 128 N 1.47 0.75 3.58 0.23 0.00 -0.05 -5.06 105.19 106.11 12e8 n GLY 128 Ca 0.06 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.84 12e8 n GLY 128 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 12e8 s GLY 129 N -1.65 2.07 -0.25 -0.02 0.00 -1.20 -1.74 107.32 104.53 12e8 s GLY 129 Ca 0.00 -1.98 -0.02 0.00 0.00 0.00 0.00 44.72 42.72 12e8 s GLY 129 CO 0.00 -1.95 0.32 0.00 0.00 0.00 0.00 173.10 171.47 12e8 s ALA 130 N -2.54 -0.75 -0.16 3.20 0.00 -0.51 -3.55 121.76 117.46 12e8 s ALA 130 Ca 0.33 0.35 -0.04 0.00 0.00 0.00 0.00 51.96 52.60 12e8 s ALA 130 Cb -0.00 -1.67 -0.03 0.00 0.00 0.00 0.00 23.12 21.41 12e8 s ALA 130 CO 0.18 -1.43 -0.01 -1.12 0.00 0.00 0.00 175.76 173.38 12e8 s SER 131 N 2.44 5.05 -0.27 0.00 0.01 -1.26 -1.10 113.70 118.57 12e8 s SER 131 Ca 0.10 -0.05 -0.04 0.00 1.31 0.00 0.00 55.95 57.27 12e8 s SER 131 Cb -0.15 -1.80 0.02 0.00 0.21 0.00 0.00 66.02 64.30 12e8 s SER 131 CO -0.21 0.19 0.01 -0.69 0.41 0.00 0.00 173.24 172.95 12e8 s VAL 132 N 0.25 3.48 -0.03 3.43 1.01 0.51 -3.02 120.40 126.03 12e8 s VAL 132 Ca -0.01 -0.82 0.02 0.00 0.00 0.00 0.00 61.98 61.17 12e8 s VAL 132 Cb -0.13 -2.78 -0.03 0.00 0.00 0.00 0.00 36.38 33.44 12e8 s VAL 132 CO 0.02 0.15 -0.06 0.54 0.00 0.00 0.00 175.10 175.75 12e8 s VAL 133 N 1.42 3.77 -0.07 2.92 0.11 -0.96 -0.75 120.40 126.84 12e8 s VAL 133 Ca 0.02 -0.60 0.02 0.00 -2.93 0.00 0.00 61.98 58.48 12e8 s VAL 133 Cb -0.17 -2.60 0.02 0.00 -1.53 0.00 0.00 36.38 32.10 12e8 s VAL 133 CO -0.01 0.49 -0.10 0.00 -3.33 0.00 0.00 175.10 172.15 12e8 s PHE 135 N 0.90 3.22 -0.43 0.00 0.08 -0.19 -0.02 117.98 121.55 12e8 s PHE 135 Ca -0.10 0.23 0.02 0.00 0.12 0.00 0.00 56.93 57.20 12e8 s PHE 135 Cb -0.15 -1.82 0.13 0.00 -0.57 0.00 0.00 43.02 40.62 12e8 s PHE 135 CO 0.01 0.49 0.23 -0.51 -0.10 0.00 0.00 175.22 175.34 12e8 s LEU 136 N -0.86 2.79 0.09 -0.37 1.02 0.57 -1.82 118.68 120.11 12e8 s LEU 136 Ca 0.13 -2.58 0.01 0.00 0.02 0.00 0.00 54.13 51.72 12e8 s LEU 136 Cb -0.11 -1.07 -0.04 0.00 0.02 0.00 0.00 46.19 44.99 12e8 s LEU 136 CO 0.02 -0.28 0.20 0.20 0.02 0.00 0.00 176.35 176.52 12e8 s ASN 137 N 0.40 6.16 -1.14 2.29 0.02 -0.49 -0.51 114.94 121.67 12e8 s ASN 137 Ca 0.17 0.17 -0.23 0.00 -1.02 0.00 0.00 52.86 51.95 12e8 s ASN 137 Cb -0.24 -1.83 -0.00 0.00 0.02 0.00 0.00 41.25 39.19 12e8 s ASN 137 CO -0.01 0.13 0.78 0.59 0.02 0.00 0.00 177.10 178.62 12e8 n ASN 138 N 0.05 -5.22 -4.61 -1.22 4.13 -0.93 -0.74 115.26 106.74 12e8 n ASN 138 Ca -0.06 -1.05 -0.26 0.00 1.68 0.00 0.00 54.58 54.89 12e8 n ASN 138 Cb 0.52 -3.17 -0.10 0.00 -1.54 0.00 0.00 39.78 35.50 12e8 n ASN 138 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 12e8 s PHE 139 N -3.47 2.49 -0.28 3.10 -0.12 -0.10 -4.58 117.98 115.03 12e8 s PHE 139 Ca 0.48 -0.52 -0.21 0.00 -0.05 0.00 0.00 56.93 56.63 12e8 s PHE 139 Cb -0.18 -1.55 0.09 0.00 -0.63 0.00 0.00 43.02 40.75 12e8 s PHE 139 CO 0.88 0.49 0.78 -0.47 -0.05 0.00 0.00 175.22 176.84 12e8 s TYR 140 N -2.60 -0.81 1.13 3.49 6.14 -0.35 -1.06 117.35 123.30 12e8 s TYR 140 Ca 0.35 1.80 -0.19 0.00 0.64 0.00 0.00 57.07 59.67 12e8 s TYR 140 Cb 0.03 0.41 0.27 0.00 0.42 0.00 0.00 41.96 43.09 12e8 s TYR 140 CO 0.18 -0.39 1.21 -1.25 0.64 0.00 0.00 175.55 175.94 12e8 s PRO 141 N 0.84 -0.67 0.43 4.97 0.04 -1.26 -0.30 135.00 139.04 12e8 s PRO 141 Ca -0.03 -0.31 0.22 0.00 0.04 0.00 0.00 61.00 60.92 12e8 s PRO 141 Cb -0.05 -1.68 0.95 0.00 0.04 0.00 0.00 34.50 33.75 12e8 s PRO 141 CO -0.08 -3.31 1.85 1.57 0.04 0.00 0.00 177.00 177.08 12e8 h LYS 142 N -2.29 0.00 -6.30 4.56 2.10 -1.98 -3.44 116.57 109.23 12e8 h LYS 142 Ca -0.43 0.00 -0.57 0.00 -2.00 0.00 0.00 60.65 57.64 12e8 h LYS 142 Cb 1.26 0.00 0.02 0.00 -0.90 0.00 0.00 32.23 32.60 12e8 h LYS 142 CO 0.31 0.27 1.19 -0.25 -2.00 0.00 0.00 179.45 178.97 12e8 n ASP 143 N -3.58 3.78 -3.52 7.07 9.92 -1.26 -4.94 116.55 124.03 12e8 n ASP 143 Ca -0.01 0.90 -0.15 0.00 -0.53 0.00 0.00 54.79 55.00 12e8 n ASP 143 Cb 0.41 -1.45 -0.05 0.00 -0.64 0.00 0.00 41.12 39.39 12e8 n ASP 143 CO 0.00 0.00 0.00 -0.51 0.13 0.00 0.00 177.20 176.82 12e8 s ILE 144 N 4.52 0.01 -0.03 0.53 2.07 -1.26 -4.67 121.20 122.36 12e8 s ILE 144 Ca 0.92 -0.11 0.02 0.00 -1.41 0.00 0.00 60.65 60.06 12e8 s ILE 144 Cb -0.55 -0.99 0.01 0.00 0.13 0.00 0.00 42.46 41.06 12e8 s ILE 144 CO 0.46 -0.06 -0.06 0.20 -1.91 0.00 0.00 174.94 173.57 12e8 s ASN 145 N -1.95 0.98 -0.07 4.50 -0.87 -0.85 -5.01 114.94 111.66 12e8 s ASN 145 Ca -0.05 -0.14 0.03 0.00 -1.57 0.00 0.00 52.86 51.13 12e8 s ASN 145 Cb -0.01 -0.33 -0.02 0.00 -0.02 0.00 0.00 41.25 40.88 12e8 s ASN 145 CO -0.01 0.02 -0.18 -0.69 -2.57 0.00 0.00 177.10 173.66 12e8 s VAL 146 N 0.43 2.69 -0.02 1.60 1.01 -1.26 -1.24 120.40 123.62 12e8 s VAL 146 Ca -0.06 -0.83 0.04 0.00 0.00 0.00 0.00 61.98 61.13 12e8 s VAL 146 Cb -0.10 -2.05 -0.01 0.00 0.00 0.00 0.00 36.38 34.22 12e8 s VAL 146 CO 0.00 0.57 -0.14 -0.75 0.00 0.00 0.00 175.10 174.78 12e8 s LYS 147 N -0.22 1.23 0.00 2.72 2.20 0.23 -4.96 119.74 120.93 12e8 s LYS 147 Ca -0.00 -0.49 0.02 0.00 -0.36 0.00 0.00 55.97 55.14 12e8 s LYS 147 Cb -0.13 -1.15 -0.03 0.00 -1.51 0.00 0.00 37.83 35.00 12e8 s LYS 147 CO 0.03 0.26 -0.04 -1.58 -0.36 0.00 0.00 175.35 173.67 12e8 s TRP 148 N -0.18 2.97 -0.04 4.03 0.52 -1.26 -0.24 118.94 124.73 12e8 s TRP 148 Ca 0.02 0.01 0.01 0.00 0.02 0.00 0.00 56.10 56.16 12e8 s TRP 148 Cb -0.07 -1.63 0.02 0.00 -1.15 0.00 0.00 33.47 30.64 12e8 s TRP 148 CO 0.00 0.41 -0.03 0.15 0.02 0.00 0.00 176.95 177.51 12e8 s LYS 149 N -1.47 0.66 -0.27 4.98 1.02 -0.51 -0.94 119.74 123.20 12e8 s LYS 149 Ca 0.18 -0.03 -0.03 0.00 0.02 0.00 0.00 55.97 56.10 12e8 s LYS 149 Cb -0.11 -0.75 0.02 0.00 -0.52 0.00 0.00 37.83 36.47 12e8 s LYS 149 CO 0.09 -0.12 -0.00 0.42 -0.92 0.00 0.00 175.35 174.81 12e8 s ILE 150 N 1.06 3.27 -1.40 2.17 1.01 0.57 -0.76 121.20 127.12 12e8 s ILE 150 Ca -0.09 -0.97 -0.10 0.00 0.00 0.00 0.00 60.65 59.49 12e8 s ILE 150 Cb -0.14 -2.70 0.03 0.00 0.01 0.00 0.00 42.46 39.66 12e8 s ILE 150 CO -0.01 0.11 1.13 0.47 0.00 0.00 0.00 174.94 176.64 12e8 n ASP 151 N 4.73 -5.87 0.00 3.58 8.00 0.14 -1.58 116.55 125.54 12e8 n ASP 151 Ca -0.15 -0.61 0.00 0.00 0.71 0.00 0.00 54.79 54.74 12e8 n ASP 151 Cb 0.47 -4.72 0.00 0.00 -0.02 0.00 0.00 41.12 36.84 12e8 n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 12e8 n GLY 152 N -1.91 0.50 3.42 0.44 0.00 -1.26 -5.02 105.19 101.36 12e8 n GLY 152 Ca 0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.70 12e8 n GLY 152 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 12e8 s SER 153 N -2.19 4.27 0.13 1.61 0.15 -0.62 -4.99 113.70 112.06 12e8 s SER 153 Ca 0.00 -0.25 -0.34 0.00 0.70 0.00 0.00 55.95 56.06 12e8 s SER 153 Cb 0.00 -1.61 -0.13 0.00 -1.71 0.00 0.00 66.02 62.56 12e8 s SER 153 CO 0.00 0.18 1.63 1.21 1.20 0.00 0.00 173.24 177.46 12e8 n GLU 154 N 3.42 2.19 -3.83 5.44 2.13 -1.26 -0.31 120.64 128.42 12e8 n GLU 154 Ca -0.18 0.79 -0.36 0.00 0.66 0.00 0.00 57.16 58.07 12e8 n GLU 154 Cb 0.53 -2.58 -0.13 0.00 0.27 0.00 0.00 31.44 29.53 12e8 n GLU 154 CO 0.00 0.00 0.00 0.50 -0.41 0.00 0.00 177.13 177.22 12e8 s ARG 155 N 1.39 3.00 -0.21 5.31 6.06 -0.11 -4.85 118.95 129.54 12e8 s ARG 155 Ca 0.81 -0.90 -0.20 0.00 -2.50 0.00 0.00 55.73 52.93 12e8 s ARG 155 Cb -0.67 -3.23 -0.19 0.00 0.06 0.00 0.00 34.95 30.92 12e8 s ARG 155 CO 0.39 -0.43 0.18 1.04 -2.50 0.00 0.00 175.30 173.99 12e8 n GLN 156 N 4.79 0.58 -2.74 5.12 1.13 -1.26 -4.42 117.38 120.58 12e8 n GLN 156 Ca -0.15 0.54 -0.37 0.00 -1.94 0.00 0.00 57.00 55.08 12e8 n GLN 156 Cb 0.48 -1.73 -0.06 0.00 0.11 0.00 0.00 30.24 29.04 12e8 n GLN 156 CO 0.00 0.00 0.00 -0.80 -1.44 0.00 0.00 177.06 174.82 12e8 s ASN 157 N -6.91 7.22 0.00 1.08 0.01 -1.26 -4.14 114.94 110.94 12e8 s ASN 157 Ca -0.29 1.87 0.00 0.00 -0.71 0.00 0.00 52.86 53.73 12e8 s ASN 157 Cb 0.07 -2.58 0.00 0.00 0.41 0.00 0.00 41.25 39.15 12e8 s ASN 157 CO 0.59 -0.15 0.00 0.61 -1.51 0.00 0.00 177.10 176.64 12e8 n GLY 158 N 0.46 1.10 3.81 0.66 0.00 -1.26 -4.88 105.19 105.08 12e8 n GLY 158 Ca 0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.67 12e8 n GLY 158 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 12e8 s VAL 159 N -2.63 5.21 -0.08 1.61 -7.23 -1.26 -1.40 120.40 114.62 12e8 s VAL 159 Ca 0.00 0.64 0.04 0.00 -1.81 0.00 0.00 61.98 60.84 12e8 s VAL 159 Cb 0.00 -3.63 0.00 0.00 0.56 0.00 0.00 36.38 33.31 12e8 s VAL 159 CO 0.00 0.52 -0.20 -0.76 -0.31 0.00 0.00 175.10 174.36 12e8 s LEU 160 N -0.55 1.92 -0.05 1.32 2.01 0.03 -4.96 118.68 118.41 12e8 s LEU 160 Ca 0.20 -0.45 0.02 0.00 0.01 0.00 0.00 54.13 53.91 12e8 s LEU 160 Cb -0.15 -1.17 -0.03 0.00 0.01 0.00 0.00 46.19 44.85 12e8 s LEU 160 CO 0.09 0.12 -0.07 0.20 1.01 0.00 0.00 176.35 177.70 12e8 s ASN 161 N 0.40 4.64 -0.02 2.29 0.01 -1.26 -1.38 114.94 119.61 12e8 s ASN 161 Ca -0.15 -0.06 0.01 0.00 -0.71 0.00 0.00 52.86 51.94 12e8 s ASN 161 Cb -0.17 -1.14 0.01 0.00 0.41 0.00 0.00 41.25 40.37 12e8 s ASN 161 CO 0.06 0.34 -0.03 -0.55 -1.51 0.00 0.00 177.10 175.41 12e8 s SER 162 N -1.00 0.54 0.00 -1.22 0.15 -0.08 -4.98 113.70 107.10 12e8 s SER 162 Ca 0.14 -0.07 0.07 0.00 0.70 0.00 0.00 55.95 56.79 12e8 s SER 162 Cb -0.11 -0.18 -0.02 0.00 -1.71 0.00 0.00 66.02 64.00 12e8 s SER 162 CO 0.03 -0.02 -0.23 0.00 1.20 0.00 0.00 173.24 174.23 12e8 s ALA 163 N 0.44 1.90 0.45 5.45 0.00 -1.26 -0.65 121.76 128.09 12e8 s ALA 163 Ca -0.05 -1.02 -0.07 0.00 0.00 0.00 0.00 51.96 50.82 12e8 s ALA 163 Cb -0.08 -0.45 -0.05 0.00 0.00 0.00 0.00 23.12 22.54 12e8 s ALA 163 CO -0.01 0.46 0.78 0.95 0.00 0.00 0.00 175.76 177.94 12e8 s THR 164 N -0.61 4.87 0.73 0.00 -4.23 -0.90 -5.02 115.64 110.48 12e8 s THR 164 Ca 0.09 0.34 -0.11 0.00 -1.18 0.00 0.00 61.69 60.83 12e8 s THR 164 Cb -0.09 -3.82 0.03 0.00 1.34 0.00 0.00 72.50 69.96 12e8 s THR 164 CO -0.00 -0.73 1.07 -1.81 -0.54 0.00 0.00 174.62 172.61 12e8 s ASP 165 N -3.77 5.03 0.14 3.99 1.01 -1.26 -4.52 116.67 117.29 12e8 s ASP 165 Ca 0.49 1.70 -0.35 0.00 0.71 0.00 0.00 52.55 55.10 12e8 s ASP 165 Cb -0.10 -2.51 -0.15 0.00 1.01 0.00 0.00 42.92 41.17 12e8 s ASP 165 CO 0.40 -1.68 1.50 1.67 0.21 0.00 0.00 175.17 177.27 12e8 n GLN 166 N -3.29 1.84 -1.69 8.23 7.27 -1.26 -4.81 117.38 123.67 12e8 n GLN 166 Ca 0.08 0.66 -0.44 0.00 0.07 0.00 0.00 57.00 57.37 12e8 n GLN 166 Cb 0.53 -2.39 -0.04 0.00 2.41 0.00 0.00 30.24 30.76 12e8 n GLN 166 CO 0.00 0.00 0.00 -3.47 0.07 0.00 0.00 177.06 173.66 12e8 n ASP 167 N 3.10 3.49 0.27 1.69 2.03 0.95 -4.87 116.55 123.22 12e8 n ASP 167 Ca 0.17 1.07 0.15 0.00 0.52 0.00 0.00 54.79 56.70 12e8 n ASP 167 Cb 0.26 -1.49 0.73 0.00 -0.72 0.00 0.00 41.12 39.90 12e8 n ASP 167 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 12e8 h SER 168 N 6.51 0.00 0.00 1.67 4.64 -1.90 -0.92 113.55 123.55 12e8 h SER 168 Ca -0.44 0.00 -0.17 0.00 -0.47 0.00 0.00 61.79 60.70 12e8 h SER 168 Cb 1.23 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.30 12e8 h SER 168 CO 0.92 0.08 -1.51 1.17 -0.87 0.00 0.00 176.83 176.62 12e8 n LYS 169 N -3.31 0.55 -0.18 4.77 4.81 -1.26 -4.71 118.16 118.83 12e8 n LYS 169 Ca -0.01 0.27 0.12 0.00 -0.87 0.00 0.00 58.31 57.82 12e8 n LYS 169 Cb 0.28 -1.49 0.25 0.00 0.02 0.00 0.00 35.03 34.09 12e8 n LYS 169 CO 0.00 0.00 0.00 -0.40 1.17 0.00 0.00 177.40 178.17 12e8 n ASP 170 N -4.40 3.14 -1.45 3.14 5.68 -1.25 -4.97 116.55 116.44 12e8 n ASP 170 Ca -0.28 -1.95 -0.12 0.00 -0.50 0.00 0.00 54.79 51.93 12e8 n ASP 170 Cb 0.64 -0.23 -0.05 0.00 -1.14 0.00 0.00 41.12 40.33 12e8 n ASP 170 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 12e8 n SER 171 N 1.28 -3.28 -4.93 -1.12 7.64 -0.35 -4.95 113.62 107.92 12e8 n SER 171 Ca 0.19 0.29 -0.20 0.00 1.01 0.00 0.00 58.87 60.16 12e8 n SER 171 Cb 0.55 -3.07 0.05 0.00 -1.01 0.00 0.00 64.21 60.73 12e8 n SER 171 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 12e8 s THR 172 N -2.09 2.52 0.24 0.44 -4.23 -1.26 -4.62 115.64 106.64 12e8 s THR 172 Ca 0.00 -0.79 0.10 0.00 -1.18 0.00 0.00 61.69 59.82 12e8 s THR 172 Cb 0.00 -2.72 -0.05 0.00 1.34 0.00 0.00 72.50 71.07 12e8 s THR 172 CO 0.00 0.00 -0.19 -0.31 -0.54 0.00 0.00 174.62 173.58 12e8 s TYR 173 N -2.73 2.09 0.05 3.99 1.51 -0.22 -0.03 117.35 122.01 12e8 s TYR 173 Ca 0.60 -0.41 -0.03 0.00 -1.01 0.00 0.00 57.07 56.21 12e8 s TYR 173 Cb -0.08 -0.94 -0.03 0.00 -0.11 0.00 0.00 41.96 40.80 12e8 s TYR 173 CO 0.39 0.57 0.04 -1.12 -1.11 0.00 0.00 175.55 174.31 12e8 s SER 174 N -3.30 0.34 -0.01 2.29 0.01 -1.26 -0.92 113.70 110.84 12e8 s SER 174 Ca 0.26 -0.80 -0.19 0.00 1.31 0.00 0.00 55.95 56.52 12e8 s SER 174 Cb -0.04 0.23 0.04 0.00 0.21 0.00 0.00 66.02 66.45 12e8 s SER 174 CO 0.12 -0.59 0.41 -0.32 0.41 0.00 0.00 173.24 173.27 12e8 s MET 175 N -3.49 0.80 0.00 12.44 0.00 0.33 -2.13 119.30 127.26 12e8 s MET 175 Ca 0.03 -0.13 0.07 0.00 0.00 0.00 0.00 55.69 55.65 12e8 s MET 175 Cb 0.04 0.36 -0.02 0.00 0.00 0.00 0.00 34.83 35.22 12e8 s MET 175 CO -0.09 -0.24 -0.22 -1.54 0.00 0.00 0.00 175.02 172.93 12e8 s SER 176 N -1.45 2.58 -0.08 1.11 1.04 0.17 -0.31 113.70 116.76 12e8 s SER 176 Ca -0.11 -0.43 -0.00 0.00 0.48 0.00 0.00 55.95 55.88 12e8 s SER 176 Cb -0.03 -0.27 0.02 0.00 0.10 0.00 0.00 66.02 65.84 12e8 s SER 176 CO 0.04 0.25 -0.05 -0.55 0.98 0.00 0.00 173.24 173.91 12e8 s SER 177 N -0.70 1.68 -0.05 7.02 0.15 0.98 -0.91 113.70 121.87 12e8 s SER 177 Ca 0.08 -0.19 0.02 0.00 0.70 0.00 0.00 55.95 56.56 12e8 s SER 177 Cb -0.09 -0.62 0.02 0.00 -1.71 0.00 0.00 66.02 63.62 12e8 s SER 177 CO -0.00 -0.11 -0.09 0.28 1.20 0.00 0.00 173.24 174.51 12e8 s THR 178 N 1.52 0.87 -0.27 6.45 -1.32 -0.48 -0.21 115.64 122.20 12e8 s THR 178 Ca -0.00 -0.34 -0.13 0.00 -1.21 0.00 0.00 61.69 60.01 12e8 s THR 178 Cb -0.13 -0.82 -0.04 0.00 -1.51 0.00 0.00 72.50 70.00 12e8 s THR 178 CO -0.04 0.29 0.29 -0.22 -2.21 0.00 0.00 174.62 172.74 12e8 s LEU 179 N 0.68 4.04 -0.21 9.08 2.96 0.07 -0.79 118.68 134.52 12e8 s LEU 179 Ca -0.12 0.18 -0.03 0.00 -0.22 0.00 0.00 54.13 53.93 12e8 s LEU 179 Cb -0.14 -2.30 -0.01 0.00 0.50 0.00 0.00 46.19 44.24 12e8 s LEU 179 CO 0.02 -0.12 -0.06 -0.89 -1.32 0.00 0.00 176.35 173.99 12e8 s THR 180 N 1.86 3.34 0.44 3.68 2.01 -0.49 -0.36 115.64 126.11 12e8 s THR 180 Ca 0.12 -0.51 0.04 0.00 0.31 0.00 0.00 61.69 61.64 12e8 s THR 180 Cb -0.16 -2.50 -0.02 0.00 0.01 0.00 0.00 72.50 69.84 12e8 s THR 180 CO 0.10 0.44 0.13 -0.76 -0.69 0.00 0.00 174.62 173.84 12e8 s LEU 181 N 1.28 2.00 0.51 4.42 1.43 -0.26 -4.75 118.68 123.32 12e8 s LEU 181 Ca 0.03 -1.73 0.00 0.00 -1.03 0.00 0.00 54.13 51.40 12e8 s LEU 181 Cb -0.14 -0.11 0.01 0.00 0.03 0.00 0.00 46.19 45.98 12e8 s LEU 181 CO -0.02 -0.99 0.74 0.42 0.23 0.00 0.00 176.35 176.73 12e8 s THR 182 N -3.15 3.37 0.30 5.49 -4.23 -1.26 -1.42 115.64 114.73 12e8 s THR 182 Ca 0.20 -0.53 -0.00 0.00 -1.18 0.00 0.00 61.69 60.18 12e8 s THR 182 Cb 0.01 -3.26 0.19 0.00 1.34 0.00 0.00 72.50 70.78 12e8 s THR 182 CO 0.14 -0.19 1.88 0.50 -0.54 0.00 0.00 174.62 176.41 12e8 h LYS 183 N 0.20 0.83 -0.37 3.99 3.64 -1.57 -1.01 116.57 122.28 12e8 h LYS 183 Ca -0.44 -0.13 -0.09 0.00 -1.27 0.00 0.00 60.65 58.72 12e8 h LYS 183 Cb 1.27 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.94 12e8 h LYS 183 CO 0.55 0.69 -0.11 -0.44 -2.27 0.00 0.00 179.45 177.87 12e8 h ASP 184 N 0.82 0.74 0.09 4.20 3.32 -1.94 0.12 116.42 123.77 12e8 h ASP 184 Ca 0.19 -0.37 -0.00 0.00 0.02 0.00 0.00 57.03 56.87 12e8 h ASP 184 Cb 0.17 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 39.52 12e8 h ASP 184 CO -0.02 0.95 -0.04 -0.08 -1.72 0.00 0.00 179.24 178.33 12e8 h GLU 185 N 0.53 -0.12 -1.00 3.56 4.57 -1.88 -2.93 114.58 117.32 12e8 h GLU 185 Ca 0.09 0.01 0.06 0.00 -1.18 0.00 0.00 59.36 58.34 12e8 h GLU 185 Cb 0.63 0.03 -0.07 0.00 -0.16 0.00 0.00 28.75 29.18 12e8 h GLU 185 CO 0.04 0.09 0.65 -0.92 -1.18 0.00 0.00 179.01 177.69 12e8 h TYR 186 N -0.32 1.20 0.00 0.92 3.20 -1.12 -1.95 116.97 118.91 12e8 h TYR 186 Ca -0.01 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.89 12e8 h TYR 186 Cb 0.27 -0.39 0.00 0.00 1.54 0.00 0.00 36.73 38.14 12e8 h TYR 186 CO -0.01 0.63 0.00 0.39 -1.64 0.00 0.00 178.16 177.53 12e8 n GLU 187 N -4.50 0.94 -0.38 1.82 1.02 0.40 -2.97 120.64 116.97 12e8 n GLU 187 Ca 0.15 0.00 0.12 0.00 -0.02 0.00 0.00 57.16 57.41 12e8 n GLU 187 Cb 0.17 -1.29 0.32 0.00 -0.02 0.00 0.00 31.44 30.63 12e8 n GLU 187 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 12e8 n ARG 188 N -0.79 2.74 -4.19 3.49 1.74 -0.73 -4.96 116.66 113.97 12e8 n ARG 188 Ca 0.13 -2.67 -0.11 0.00 -0.77 0.00 0.00 57.85 54.42 12e8 n ARG 188 Cb 0.06 -1.57 -0.10 0.00 -1.02 0.00 0.00 32.46 29.82 12e8 n ARG 188 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 12e8 s HIS 189 N -1.01 1.01 -0.04 -1.55 3.76 -1.16 -5.10 115.29 111.20 12e8 s HIS 189 Ca 0.49 -1.07 -0.08 0.00 -0.15 0.00 0.00 55.06 54.25 12e8 s HIS 189 Cb 0.26 -0.58 -0.03 0.00 1.11 0.00 0.00 32.58 33.33 12e8 s HIS 189 CO 0.33 -0.31 -0.16 0.09 -0.85 0.00 0.00 174.74 173.84 12e8 n ASN 190 N -0.14 1.39 -4.69 1.40 3.02 -1.26 -4.77 115.26 110.21 12e8 n ASN 190 Ca -0.08 0.21 -0.38 0.00 -0.03 0.00 0.00 54.58 54.31 12e8 n ASN 190 Cb 0.63 -0.50 -0.07 0.00 -0.61 0.00 0.00 39.78 39.24 12e8 n ASN 190 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 12e8 s SER 191 N -5.99 6.55 -0.09 6.41 0.15 -1.26 -0.94 113.70 118.53 12e8 s SER 191 Ca -0.14 0.66 0.04 0.00 0.70 0.00 0.00 55.95 57.21 12e8 s SER 191 Cb 0.03 -2.26 -0.00 0.00 -1.71 0.00 0.00 66.02 62.07 12e8 s SER 191 CO 0.20 -0.07 -0.23 -0.31 1.20 0.00 0.00 173.24 174.04 12e8 s TYR 192 N 1.11 2.37 -0.03 3.44 1.51 -0.97 0.24 117.35 125.02 12e8 s TYR 192 Ca 0.22 -0.90 0.01 0.00 -1.01 0.00 0.00 57.07 55.39 12e8 s TYR 192 Cb -0.15 -1.59 0.02 0.00 -0.11 0.00 0.00 41.96 40.13 12e8 s TYR 192 CO 0.09 -0.35 -0.03 0.99 -1.11 0.00 0.00 175.55 175.13 12e8 s THR 193 N 0.26 0.40 -0.26 -0.71 2.01 0.07 -2.42 115.64 114.98 12e8 s THR 193 Ca -0.15 -0.09 -0.05 0.00 0.31 0.00 0.00 61.69 61.71 12e8 s THR 193 Cb -0.17 -0.42 0.01 0.00 0.01 0.00 0.00 72.50 71.93 12e8 s THR 193 CO 0.07 0.17 0.02 0.00 -0.69 0.00 0.00 174.62 174.19 12e8 s GLU 195 N 1.46 3.07 -0.19 0.00 2.02 0.67 -1.09 118.70 124.64 12e8 s GLU 195 Ca 0.03 -0.81 -0.03 0.00 0.02 0.00 0.00 54.97 54.18 12e8 s GLU 195 Cb -0.16 -2.54 -0.01 0.00 0.10 0.00 0.00 34.13 31.52 12e8 s GLU 195 CO -0.00 -0.06 -0.06 0.00 0.02 0.00 0.00 175.26 175.15 12e8 s ALA 196 N 0.96 2.82 -0.20 5.21 0.00 0.31 -0.60 121.76 130.25 12e8 s ALA 196 Ca -0.03 -1.03 -0.04 0.00 0.00 0.00 0.00 51.96 50.85 12e8 s ALA 196 Cb -0.15 -1.57 -0.02 0.00 0.00 0.00 0.00 23.12 21.38 12e8 s ALA 196 CO -0.04 -0.15 -0.02 -0.08 0.00 0.00 0.00 175.76 175.47 12e8 s THR 197 N 1.00 3.68 0.02 0.00 -1.32 -0.37 -0.41 115.64 118.23 12e8 s THR 197 Ca -0.00 -0.40 -0.02 0.00 -1.21 0.00 0.00 61.69 60.06 12e8 s THR 197 Cb -0.15 -2.66 -0.02 0.00 -1.51 0.00 0.00 72.50 68.17 12e8 s THR 197 CO 0.00 0.43 0.00 -2.28 -2.21 0.00 0.00 174.62 170.57 12e8 s HIS 198 N 1.14 0.24 0.01 9.09 2.46 -1.26 -2.01 115.29 124.96 12e8 s HIS 198 Ca 0.02 -0.49 0.22 0.00 0.47 0.00 0.00 55.06 55.27 12e8 s HIS 198 Cb -0.15 -0.18 1.17 0.00 -0.13 0.00 0.00 32.58 33.30 12e8 s HIS 198 CO 0.00 -0.23 1.63 1.57 -2.47 0.00 0.00 174.74 175.24 12e8 h LYS 199 N 4.45 0.00 0.00 2.88 2.10 -1.96 -2.29 116.57 121.75 12e8 h LYS 199 Ca -0.32 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.33 12e8 h LYS 199 Cb 1.20 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.53 12e8 h LYS 199 CO 0.43 0.00 0.00 0.25 -2.00 0.00 0.00 179.45 178.13 12e8 n THR 200 N -2.31 0.00 -3.61 0.07 -2.24 -1.26 -4.76 114.28 100.17 12e8 n THR 200 Ca -0.01 0.00 -0.11 0.00 -2.27 0.00 0.00 64.05 61.66 12e8 n THR 200 Cb 0.15 -0.32 -0.06 0.00 -2.10 0.00 0.00 70.33 68.00 12e8 n THR 200 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 12e8 s SER 201 N -1.54 -0.50 0.09 3.42 1.04 -0.86 -4.92 113.70 110.43 12e8 s SER 201 Ca 0.14 0.84 0.06 0.00 0.48 0.00 0.00 55.95 57.47 12e8 s SER 201 Cb 0.07 0.81 -0.23 0.00 0.10 0.00 0.00 66.02 66.77 12e8 s SER 201 CO 0.11 -0.25 1.16 0.71 0.98 0.00 0.00 173.24 175.95 12e8 h THR 202 N 3.37 1.54 -3.47 2.02 1.35 -1.85 -3.42 112.91 112.45 12e8 h THR 202 Ca -0.26 -3.25 -0.67 0.00 -0.55 0.00 0.00 66.41 61.68 12e8 h THR 202 Cb 1.17 2.80 -0.17 0.00 -1.73 0.00 0.00 68.15 70.22 12e8 h THR 202 CO 0.17 0.90 0.01 -0.44 -0.25 0.00 0.00 175.52 175.90 12e8 s SER 203 N -6.71 6.25 0.64 5.36 0.01 -1.26 -5.05 113.70 112.95 12e8 s SER 203 Ca -0.01 -0.62 -0.17 0.00 1.31 0.00 0.00 55.95 56.46 12e8 s SER 203 Cb 0.09 -2.28 -0.07 0.00 0.21 0.00 0.00 66.02 63.97 12e8 s SER 203 CO 0.83 -0.76 0.47 -0.81 0.41 0.00 0.00 173.24 173.38 12e8 n PRO 204 N 6.05 0.39 -2.85 12.44 -0.04 -1.26 -4.89 135.00 144.84 12e8 n PRO 204 Ca -0.05 0.16 -0.42 0.00 -0.04 0.00 0.00 63.50 63.16 12e8 n PRO 204 Cb 0.47 -1.71 -0.04 0.00 -0.04 0.00 0.00 33.50 32.18 12e8 n PRO 204 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 12e8 s ILE 205 N -1.81 4.85 -0.13 0.52 1.01 0.45 -4.88 121.20 121.20 12e8 s ILE 205 Ca 0.66 1.70 0.00 0.00 0.00 0.00 0.00 60.65 63.02 12e8 s ILE 205 Cb -0.40 -4.17 -0.01 0.00 0.01 0.00 0.00 42.46 37.89 12e8 s ILE 205 CO 0.57 -0.01 -0.14 -0.69 0.00 0.00 0.00 174.94 174.67 12e8 s VAL 206 N 2.32 2.89 -0.02 2.92 1.01 -1.26 -0.53 120.40 127.73 12e8 s VAL 206 Ca 0.39 -0.71 0.04 0.00 0.00 0.00 0.00 61.98 61.70 12e8 s VAL 206 Cb -0.16 -2.21 -0.01 0.00 0.00 0.00 0.00 36.38 34.00 12e8 s VAL 206 CO 0.12 0.53 -0.13 -0.54 0.00 0.00 0.00 175.10 175.07 12e8 s LYS 207 N 0.42 1.22 0.33 2.72 -0.14 -0.25 -5.01 119.74 119.03 12e8 s LYS 207 Ca -0.11 -0.47 -0.18 0.00 -1.36 0.00 0.00 55.97 53.85 12e8 s LYS 207 Cb -0.16 -1.14 0.04 0.00 -1.68 0.00 0.00 37.83 34.89 12e8 s LYS 207 CO 0.05 0.24 0.75 -1.54 -0.76 0.00 0.00 175.35 174.09 12e8 s SER 208 N -0.11 -0.12 0.13 2.83 1.04 -1.26 -0.46 113.70 115.75 12e8 s SER 208 Ca 0.01 -0.89 -0.15 0.00 0.48 0.00 0.00 55.95 55.40 12e8 s SER 208 Cb -0.07 0.79 0.03 0.00 0.10 0.00 0.00 66.02 66.86 12e8 s SER 208 CO 0.00 -1.52 0.37 0.72 0.98 0.00 0.00 173.24 173.79 12e8 s PHE 209 N -3.09 -0.11 -0.13 5.02 -0.12 -1.02 -5.02 117.98 113.51 12e8 s PHE 209 Ca 0.13 -0.23 0.01 0.00 -0.05 0.00 0.00 56.93 56.79 12e8 s PHE 209 Cb -0.05 0.20 -0.01 0.00 -0.63 0.00 0.00 43.02 42.53 12e8 s PHE 209 CO 0.09 -0.69 -0.16 -0.80 -0.05 0.00 0.00 175.22 173.61 12e8 s ASN 210 N -2.83 3.74 0.25 1.98 0.01 -1.26 -2.30 114.94 114.54 12e8 s ASN 210 Ca 0.04 -0.41 -0.04 0.00 -0.71 0.00 0.00 52.86 51.75 12e8 s ASN 210 Cb 0.02 -1.56 0.37 0.00 0.41 0.00 0.00 41.25 40.50 12e8 s ASN 210 CO -0.10 0.15 1.86 -0.09 -1.51 0.00 0.00 177.10 177.41 12e8 h ARG 211 N 6.82 1.03 0.00 -0.60 2.43 -1.34 -2.86 114.38 119.85 12e8 h ARG 211 Ca -0.25 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 58.85 12e8 h ARG 211 Cb 1.21 -0.23 0.00 0.00 -0.42 0.00 0.00 29.97 30.53 12e8 h ARG 211 CO 0.54 0.68 0.00 -2.95 -1.51 0.00 0.00 179.97 176.73 12e8 h ASN 212 N 1.06 0.00 0.00 -3.80 -0.00 -1.91 -3.11 115.58 107.82 12e8 h ASN 212 Ca 0.41 0.00 -0.03 0.00 -0.00 0.00 0.00 56.30 56.68 12e8 h ASN 212 Cb 0.19 0.00 -0.00 0.00 -0.00 0.00 0.00 38.32 38.50 12e8 h ASN 212 CO -0.18 0.00 -0.55 -0.33 -0.00 0.00 0.00 177.43 176.37 12e8 h GLU 213 N 0.00 0.00 -0.01 4.14 4.39 -1.92 -3.56 114.58 117.62 12e8 h GLU 213 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 12e8 h GLU 213 Cb 0.28 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.93 12e8 h GLU 213 CO 0.00 0.14 0.00 0.00 -1.16 0.00 0.00 179.01 177.99