#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c8m n ASP 11 N 0.00 0.00 -0.93 -3.46 5.75 -1.26 -3.47 116.55 113.19 1c8m n ASP 11 Ca 0.00 -0.36 0.04 0.00 -0.01 0.00 0.00 54.79 54.45 1c8m n ASP 11 Cb 0.00 -0.14 0.23 0.00 -1.03 0.00 0.00 41.12 40.18 1c8m n ASP 11 CO 0.00 0.00 0.00 -2.11 -0.11 0.00 0.00 177.20 174.98 1c8m n ARG 12 N -1.14 2.38 -4.30 0.11 1.85 -1.26 -4.47 116.66 109.84 1c8m n ARG 12 Ca 0.13 -2.94 -0.22 0.00 -1.00 0.00 0.00 57.85 53.82 1c8m n ARG 12 Cb 0.12 -1.81 -0.12 0.00 -1.05 0.00 0.00 32.46 29.60 1c8m n ARG 12 CO 0.00 0.00 0.00 0.42 -0.01 0.00 0.00 177.63 178.04 1c8m s ILE 13 N -2.99 1.70 -0.13 8.89 1.01 -1.23 -2.00 121.20 126.45 1c8m s ILE 13 Ca 0.42 -1.70 -0.17 0.00 0.00 0.00 0.00 60.65 59.20 1c8m s ILE 13 Cb 0.36 -1.65 0.04 0.00 0.01 0.00 0.00 42.46 41.23 1c8m s ILE 13 CO 0.05 -0.20 0.45 -0.51 0.00 0.00 0.00 174.94 174.74 1c8m s ILE 14 N -1.60 0.01 -0.08 2.92 2.07 -0.56 -4.92 121.20 119.04 1c8m s ILE 14 Ca 0.10 -0.10 0.00 0.00 -1.41 0.00 0.00 60.65 59.24 1c8m s ILE 14 Cb -0.08 -0.68 0.02 0.00 0.13 0.00 0.00 42.46 41.86 1c8m s ILE 14 CO 0.05 -0.05 -0.06 -1.58 -1.91 0.00 0.00 174.94 171.38 1c8m s GLN 15 N -0.23 1.26 -0.18 3.50 0.74 -1.26 -2.35 119.66 121.14 1c8m s GLN 15 Ca -0.04 -0.19 0.01 0.00 0.05 0.00 0.00 55.36 55.19 1c8m s GLN 15 Cb -0.03 -1.30 0.02 0.00 1.10 0.00 0.00 33.01 32.80 1c8m s GLN 15 CO 0.02 -0.18 -0.19 0.42 -0.55 0.00 0.00 175.29 174.81 1c8m s ILE 16 N 1.40 2.17 -0.17 -2.34 1.01 0.27 -4.95 121.20 118.60 1c8m s ILE 16 Ca -0.02 -0.91 -0.02 0.00 0.00 0.00 0.00 60.65 59.71 1c8m s ILE 16 Cb -0.13 -1.91 -0.01 0.00 0.01 0.00 0.00 42.46 40.41 1c8m s ILE 16 CO -0.04 0.53 -0.10 -0.89 0.00 0.00 0.00 174.94 174.45 1c8m s THR 17 N 1.25 3.18 -0.07 2.92 2.01 -1.26 -0.29 115.64 123.39 1c8m s THR 17 Ca 0.04 -0.59 -0.02 0.00 0.31 0.00 0.00 61.69 61.42 1c8m s THR 17 Cb -0.13 -2.38 0.03 0.00 0.01 0.00 0.00 72.50 70.03 1c8m s THR 17 CO -0.11 0.49 0.05 -0.13 -0.69 0.00 0.00 174.62 174.22 1c8m s ARG 18 N 0.79 0.15 7.98 4.92 1.81 0.04 -5.01 118.95 129.63 1c8m s ARG 18 Ca -0.04 0.23 0.00 0.00 -1.72 0.00 0.00 55.73 54.21 1c8m s ARG 18 Cb -0.15 -0.82 0.00 0.00 -0.45 0.00 0.00 34.95 33.53 1c8m s ARG 18 CO 0.01 -0.37 0.00 0.41 -0.68 0.00 0.00 175.30 174.67 1c8m n GLY 19 N 5.25 3.92 1.55 -3.53 0.00 -1.16 -1.11 105.19 110.11 1c8m n GLY 19 Ca -0.05 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.07 1c8m n GLY 19 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1c8m n ASP 20 N 6.84 4.60 -4.45 1.61 8.00 -1.26 -4.94 116.55 126.95 1c8m n ASP 20 Ca 0.00 -2.41 -0.31 0.00 0.71 0.00 0.00 54.79 52.78 1c8m n ASP 20 Cb 0.00 -0.57 -0.13 0.00 -0.02 0.00 0.00 41.12 40.40 1c8m n ASP 20 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1c8m s SER 21 N -0.88 3.77 -0.04 -2.24 1.04 -0.27 -5.07 113.70 110.02 1c8m s SER 21 Ca 0.50 -0.43 0.01 0.00 0.48 0.00 0.00 55.95 56.50 1c8m s SER 21 Cb 0.32 -0.60 0.02 0.00 0.10 0.00 0.00 66.02 65.86 1c8m s SER 21 CO 0.24 0.25 -0.05 -0.89 0.98 0.00 0.00 173.24 173.78 1c8m s THR 22 N -0.92 0.57 -0.01 2.02 2.01 -1.26 -0.78 115.64 117.27 1c8m s THR 22 Ca 0.14 -0.17 0.08 0.00 0.31 0.00 0.00 61.69 62.06 1c8m s THR 22 Cb -0.10 -0.57 -0.02 0.00 0.01 0.00 0.00 72.50 71.82 1c8m s THR 22 CO 0.05 0.22 -0.25 -0.63 -0.69 0.00 0.00 174.62 173.32 1c8m s ILE 23 N 0.72 2.01 0.21 1.82 1.01 0.61 -4.94 121.20 122.64 1c8m s ILE 23 Ca -0.10 -1.14 0.06 0.00 0.00 0.00 0.00 60.65 59.47 1c8m s ILE 23 Cb -0.13 -1.68 -0.05 0.00 0.01 0.00 0.00 42.46 40.61 1c8m s ILE 23 CO 0.00 0.52 -0.09 0.42 0.00 0.00 0.00 174.94 175.79 1c8m s THR 24 N -0.64 1.45 -0.24 2.92 -4.23 -1.26 -0.56 115.64 113.09 1c8m s THR 24 Ca 0.10 -2.13 -0.19 0.00 -1.18 0.00 0.00 61.69 58.29 1c8m s THR 24 Cb -0.10 -2.12 0.07 0.00 1.34 0.00 0.00 72.50 71.69 1c8m s THR 24 CO -0.00 -0.54 0.62 -0.55 -0.54 0.00 0.00 174.62 173.61 1c8m s SER 25 N -3.30 -0.71 -0.09 3.99 0.15 -0.99 -4.99 113.70 107.75 1c8m s SER 25 Ca 0.23 1.29 0.15 0.00 0.70 0.00 0.00 55.95 58.32 1c8m s SER 25 Cb 0.02 1.26 0.52 0.00 -1.71 0.00 0.00 66.02 66.11 1c8m s SER 25 CO 0.06 -0.22 1.44 0.00 1.20 0.00 0.00 173.24 175.72 1c8m n GLN 26 N 3.28 3.20 -2.95 5.44 6.02 -1.26 -1.49 117.38 129.62 1c8m n GLN 26 Ca -0.16 -2.59 -0.13 0.00 -0.01 0.00 0.00 57.00 54.10 1c8m n GLN 26 Cb 0.56 -1.67 -0.01 0.00 1.02 0.00 0.00 30.24 30.15 1c8m n GLN 26 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 1c8m n ASP 27 N 0.42 -2.01 -4.95 1.08 8.00 -0.85 -4.62 116.55 113.62 1c8m n ASP 27 Ca 0.20 -2.92 -0.20 0.00 0.71 0.00 0.00 54.79 52.57 1c8m n ASP 27 Cb 0.73 0.90 0.00 0.00 -0.02 0.00 0.00 41.12 42.74 1c8m n ASP 27 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 1c8m s VAL 28 N 0.24 2.53 -0.49 2.53 -7.23 -0.93 -1.16 120.40 115.89 1c8m s VAL 28 Ca 0.32 -1.20 0.08 0.00 -1.81 0.00 0.00 61.98 59.37 1c8m s VAL 28 Cb 0.12 -2.74 0.34 0.00 0.56 0.00 0.00 36.38 34.67 1c8m s VAL 28 CO -0.16 0.00 0.85 0.00 -0.31 0.00 0.00 175.10 175.48 1c8m n ALA 29 N -1.79 3.54 -0.79 1.32 0.00 -1.26 -4.74 120.51 116.80 1c8m n ALA 29 Ca 0.06 -4.16 0.00 0.00 0.00 0.00 0.00 53.44 49.35 1c8m n ALA 29 Cb 0.61 -0.82 0.00 0.00 0.00 0.00 0.00 19.45 19.25 1c8m n ALA 29 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1c8m n ASN 30 N 0.03 -2.73 -4.06 0.00 4.05 -1.26 -4.90 115.26 106.39 1c8m n ASN 30 Ca 0.28 0.00 -0.08 0.00 0.45 0.00 0.00 54.58 55.23 1c8m n ASN 30 Cb 0.50 0.00 -0.10 0.00 1.23 0.00 0.00 39.78 41.41 1c8m n ASN 30 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1c8m s ALA 31 N -1.79 0.43 -0.09 5.20 0.00 -1.26 -4.53 121.76 119.73 1c8m s ALA 31 Ca 0.00 -1.01 0.03 0.00 0.00 0.00 0.00 51.96 50.98 1c8m s ALA 31 Cb 0.00 0.21 -0.01 0.00 0.00 0.00 0.00 23.12 23.32 1c8m s ALA 31 CO 0.00 -0.28 -0.19 0.08 0.00 0.00 0.00 175.76 175.37 1c8m s VAL 32 N -3.02 2.52 -0.40 0.00 1.01 -0.49 -5.03 120.40 115.00 1c8m s VAL 32 Ca -0.00 -0.88 -0.07 0.00 0.00 0.00 0.00 61.98 61.03 1c8m s VAL 32 Cb 0.01 -1.99 0.08 0.00 0.00 0.00 0.00 36.38 34.49 1c8m s VAL 32 CO -0.06 0.56 0.21 -0.69 0.00 0.00 0.00 175.10 175.11 1c8m s VAL 33 N 0.03 3.85 -0.26 2.92 1.01 -1.26 -0.04 120.40 126.65 1c8m s VAL 33 Ca -0.07 -1.54 -0.41 0.00 0.00 0.00 0.00 61.98 59.96 1c8m s VAL 33 Cb -0.15 -3.39 -0.17 0.00 0.00 0.00 0.00 36.38 32.67 1c8m s VAL 33 CO 0.05 -0.49 1.60 0.61 0.00 0.00 0.00 175.10 176.87 1c8m n GLY 34 N 4.80 0.55 2.63 4.51 0.00 0.58 -0.99 105.19 117.28 1c8m n GLY 34 Ca -0.09 0.90 -0.11 0.00 0.00 0.00 0.00 46.02 46.72 1c8m n GLY 34 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1c8m n TYR 35 N 4.33 -0.06 -1.22 1.61 4.01 -1.26 -2.42 117.16 122.15 1c8m n TYR 35 Ca 0.26 0.00 -0.07 0.00 -0.16 0.00 0.00 57.90 57.92 1c8m n TYR 35 Cb 0.09 -2.66 -0.03 0.00 -0.31 0.00 0.00 39.34 36.43 1c8m n TYR 35 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1c8m n GLY 36 N 0.16 0.88 3.33 2.72 0.00 -0.16 -5.01 105.19 107.12 1c8m n GLY 36 Ca -0.11 -0.25 -0.33 0.00 0.00 0.00 0.00 46.02 45.33 1c8m n GLY 36 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1c8m s VAL 37 N -2.02 2.83 0.14 1.61 1.01 -1.02 -5.08 120.40 117.86 1c8m s VAL 37 Ca 0.00 -0.74 -0.20 0.00 0.00 0.00 0.00 61.98 61.04 1c8m s VAL 37 Cb 0.00 -2.17 -0.07 0.00 0.00 0.00 0.00 36.38 34.14 1c8m s VAL 37 CO 0.00 0.53 0.65 0.86 0.00 0.00 0.00 175.10 177.14 1c8m s TRP 38 N 0.37 3.77 0.31 5.22 -0.11 -1.26 -4.01 118.94 123.23 1c8m s TRP 38 Ca -0.12 1.35 -0.29 0.00 1.22 0.00 0.00 56.10 58.25 1c8m s TRP 38 Cb -0.16 -2.57 -0.12 0.00 -1.50 0.00 0.00 33.47 29.12 1c8m s TRP 38 CO 0.06 0.50 1.47 -0.35 -4.62 0.00 0.00 176.95 174.00 1c8m n PRO 39 N 1.35 2.42 -3.95 5.86 -0.04 -1.26 -4.88 135.00 134.50 1c8m n PRO 39 Ca -0.07 0.86 -0.08 0.00 -0.04 0.00 0.00 63.50 64.16 1c8m n PRO 39 Cb 0.50 -2.56 -0.09 0.00 -0.04 0.00 0.00 33.50 31.32 1c8m n PRO 39 CO 0.00 0.00 0.00 -3.38 -0.04 0.00 0.00 175.50 172.08 1c8m s HIS 40 N -0.47 0.28 0.74 0.54 -3.43 -1.26 -4.92 115.29 106.77 1c8m s HIS 40 Ca 0.61 -0.73 -0.11 0.00 -0.80 0.00 0.00 55.06 54.03 1c8m s HIS 40 Cb -0.54 -0.18 0.04 0.00 -1.43 0.00 0.00 32.58 30.46 1c8m s HIS 40 CO 0.55 -0.45 1.08 0.71 -2.00 0.00 0.00 174.74 174.63 1c8m s TYR 41 N -3.63 2.74 0.13 0.38 1.51 -1.26 -4.94 117.35 112.28 1c8m s TYR 41 Ca 0.04 1.52 -0.31 0.00 -1.01 0.00 0.00 57.07 57.30 1c8m s TYR 41 Cb 0.05 -3.01 -0.08 0.00 -0.11 0.00 0.00 41.96 38.81 1c8m s TYR 41 CO -0.09 -1.62 1.40 -1.17 -1.11 0.00 0.00 175.55 172.95 1c8m s LEU 42 N -5.71 4.38 0.38 -1.29 2.96 -1.26 -5.01 118.68 113.12 1c8m s LEU 42 Ca 0.61 2.37 -0.06 0.00 -0.22 0.00 0.00 54.13 56.83 1c8m s LEU 42 Cb -0.16 -3.59 -0.05 0.00 0.50 0.00 0.00 46.19 42.88 1c8m s LEU 42 CO 0.54 -0.66 0.67 0.42 -1.32 0.00 0.00 176.35 176.01 1c8m s THR 43 N 0.95 4.94 0.32 3.68 -4.23 -1.26 -4.93 115.64 115.11 1c8m s THR 43 Ca 0.64 0.19 0.37 0.00 -1.18 0.00 0.00 61.69 61.71 1c8m s THR 43 Cb -0.38 -3.78 0.39 0.00 1.34 0.00 0.00 72.50 70.07 1c8m s THR 43 CO 0.32 -0.53 2.13 1.55 -0.54 0.00 0.00 174.62 177.54 1c8m h PRO 44 N 1.10 0.00 0.00 3.99 0.13 -1.95 -1.29 132.00 133.98 1c8m h PRO 44 Ca -0.48 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.53 1c8m h PRO 44 Cb 1.20 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.31 1c8m h PRO 44 CO 0.64 0.00 -0.58 -0.56 -0.23 0.00 0.00 178.00 177.27 1c8m h GLN 45 N 0.00 0.00 0.00 0.86 -0.00 -2.02 -3.28 115.11 110.67 1c8m h GLN 45 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 1c8m h GLN 45 Cb 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.64 1c8m h GLN 45 CO 0.00 0.58 -1.36 -0.25 -0.00 0.00 0.00 178.83 177.80 1c8m n ASP 46 N -3.29 0.65 -4.72 0.06 10.43 -0.91 -5.00 116.55 113.77 1c8m n ASP 46 Ca 0.01 -0.61 -0.31 0.00 2.57 0.00 0.00 54.79 56.45 1c8m n ASP 46 Cb 0.75 1.37 0.12 0.00 1.84 0.00 0.00 41.12 45.20 1c8m n ASP 46 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1c8m s ALA 47 N -3.15 1.91 0.00 2.24 0.00 -0.54 -4.64 121.76 117.59 1c8m s ALA 47 Ca 0.02 0.48 0.00 0.00 0.00 0.00 0.00 51.96 52.46 1c8m s ALA 47 Cb 0.15 -3.37 0.00 0.00 0.00 0.00 0.00 23.12 19.90 1c8m s ALA 47 CO 0.86 -2.19 0.00 -2.37 0.00 0.00 0.00 175.76 172.06 1c8m n THR 48 N -3.71 0.00 -2.46 0.00 5.66 -1.26 -5.02 114.28 107.49 1c8m n THR 48 Ca 0.11 0.00 -0.43 0.00 -3.05 0.00 0.00 64.05 60.68 1c8m n THR 48 Cb 0.52 0.00 -0.02 0.00 -1.55 0.00 0.00 70.33 69.28 1c8m n THR 48 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1c8m s ALA 49 N -1.00 3.04 -0.18 1.79 0.00 -1.26 -4.92 121.76 119.23 1c8m s ALA 49 Ca 0.00 -0.38 0.23 0.00 0.00 0.00 0.00 51.96 51.81 1c8m s ALA 49 Cb 0.00 -3.96 1.22 0.00 0.00 0.00 0.00 23.12 20.39 1c8m s ALA 49 CO 0.00 -2.45 1.70 -0.84 0.00 0.00 0.00 175.76 174.17 1c8m h ILE 50 N 6.36 0.00 -4.14 0.00 3.07 -2.05 -3.45 117.51 117.31 1c8m h ILE 50 Ca -0.26 -0.02 -0.46 0.00 1.55 0.00 0.00 64.86 65.67 1c8m h ILE 50 Cb 1.08 0.55 0.00 0.00 -0.27 0.00 0.00 36.82 38.19 1c8m h ILE 50 CO 1.12 0.00 0.36 1.51 -1.05 0.00 0.00 178.15 180.09 1c8m s ASP 51 N -4.11 6.74 0.03 2.16 3.84 -1.26 -4.99 116.67 119.08 1c8m s ASP 51 Ca -0.02 1.63 -0.30 0.00 -0.00 0.00 0.00 52.55 53.85 1c8m s ASP 51 Cb 0.07 -2.52 -0.07 0.00 -1.38 0.00 0.00 42.92 39.02 1c8m s ASP 51 CO 0.22 -0.50 1.56 -0.75 -0.00 0.00 0.00 175.17 175.70 1c8m s LYS 52 N -3.68 4.23 0.70 2.11 2.20 -1.26 -4.93 119.74 119.11 1c8m s LYS 52 Ca 0.60 2.18 -0.14 0.00 -0.36 0.00 0.00 55.97 58.26 1c8m s LYS 52 Cb -0.10 -3.63 0.02 0.00 -1.51 0.00 0.00 37.83 32.61 1c8m s LYS 52 CO 0.23 -0.69 1.12 -2.14 -0.36 0.00 0.00 175.35 173.51 1c8m s PRO 53 N 2.71 2.53 -0.13 4.03 0.02 -1.26 -4.90 135.00 138.00 1c8m s PRO 53 Ca 0.70 1.37 -0.05 0.00 0.02 0.00 0.00 61.00 63.04 1c8m s PRO 53 Cb -0.36 -1.92 -0.04 0.00 0.02 0.00 0.00 34.50 32.21 1c8m s PRO 53 CO 0.30 -1.46 0.05 -0.08 -0.33 0.00 0.00 177.00 175.47 1c8m s THR 54 N -2.47 4.68 -0.45 0.99 -1.32 -0.11 -4.93 115.64 112.04 1c8m s THR 54 Ca 0.66 -0.09 0.03 0.00 -1.21 0.00 0.00 61.69 61.07 1c8m s THR 54 Cb -0.20 -3.04 0.13 0.00 -1.51 0.00 0.00 72.50 67.88 1c8m s THR 54 CO 0.46 0.55 0.23 -1.10 -2.21 0.00 0.00 174.62 172.55 1c8m s GLN 55 N -0.42 1.45 0.66 7.08 -0.21 -1.26 -1.53 119.66 125.43 1c8m s GLN 55 Ca 0.09 -2.12 0.29 0.00 0.02 0.00 0.00 55.36 53.64 1c8m s GLN 55 Cb -0.12 -2.62 1.55 0.00 1.00 0.00 0.00 33.01 32.82 1c8m s GLN 55 CO 0.02 -1.13 1.88 -1.35 -2.12 0.00 0.00 175.29 172.59 1c8m h PRO 56 N 6.78 0.00 0.00 2.91 0.11 -1.98 -3.47 132.00 136.35 1c8m h PRO 56 Ca -0.04 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.07 1c8m h PRO 56 Cb 0.93 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.04 1c8m h PRO 56 CO 0.54 0.00 0.00 -3.47 -0.21 0.00 0.00 178.00 174.86 1c8m n ASP 57 N -2.97 0.00 0.22 -2.05 4.64 -1.26 -2.65 116.55 112.48 1c8m n ASP 57 Ca -0.01 0.00 0.15 0.00 -1.38 0.00 0.00 54.79 53.55 1c8m n ASP 57 Cb 0.44 0.00 0.77 0.00 -1.04 0.00 0.00 41.12 41.29 1c8m n ASP 57 CO 0.00 0.00 0.00 0.71 -0.82 0.00 0.00 177.20 177.09 1c8m h THR 58 N 0.00 0.00 0.00 5.18 1.35 -1.90 0.43 112.91 117.97 1c8m h THR 58 Ca 0.00 -0.07 0.00 0.00 -0.55 0.00 0.00 66.41 65.79 1c8m h THR 58 Cb 0.00 0.78 0.00 0.00 -1.73 0.00 0.00 68.15 67.20 1c8m h THR 58 CO 0.00 0.00 -0.06 0.28 -0.25 0.00 0.00 175.52 175.49 1c8m h SER 59 N 0.00 0.00 0.00 5.36 0.02 -1.91 -3.36 113.55 113.66 1c8m h SER 59 Ca 0.00 -0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.93 1c8m h SER 59 Cb 0.09 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.63 1c8m h SER 59 CO 0.00 0.01 -0.99 -1.54 -1.14 0.00 0.00 176.83 173.17 1c8m n SER 60 N -2.42 4.96 -3.98 3.07 3.41 -0.83 -4.29 113.62 113.53 1c8m n SER 60 Ca 0.05 0.00 -0.43 0.00 -0.26 0.00 0.00 58.87 58.23 1c8m n SER 60 Cb 0.45 0.52 0.00 0.00 -0.26 0.00 0.00 64.21 64.92 1c8m n SER 60 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1c8m n ASN 61 N -1.96 4.95 -3.89 4.04 3.02 0.08 -4.22 115.26 117.28 1c8m n ASN 61 Ca 0.00 -3.05 -0.09 0.00 -0.03 0.00 0.00 54.58 51.41 1c8m n ASN 61 Cb 0.47 -1.53 -0.07 0.00 -0.61 0.00 0.00 39.78 38.04 1c8m n ASN 61 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1c8m s ARG 62 N 1.11 0.96 0.09 3.52 1.70 -1.26 -3.00 118.95 122.07 1c8m s ARG 62 Ca 0.42 -1.03 -0.31 0.00 -0.47 0.00 0.00 55.73 54.34 1c8m s ARG 62 Cb 0.08 0.36 -0.07 0.00 -0.57 0.00 0.00 34.95 34.75 1c8m s ARG 62 CO -0.00 -0.33 1.29 -0.06 -1.08 0.00 0.00 175.30 175.12 1c8m s PHE 63 N -3.90 3.34 -0.16 5.89 0.40 -1.26 -3.97 117.98 118.32 1c8m s PHE 63 Ca 0.09 1.13 0.01 0.00 -0.60 0.00 0.00 56.93 57.56 1c8m s PHE 63 Cb 0.04 -3.55 0.01 0.00 0.51 0.00 0.00 43.02 40.03 1c8m s PHE 63 CO -0.07 -1.82 -0.18 0.71 0.70 0.00 0.00 175.22 174.56 1c8m s TYR 64 N 1.07 2.76 -0.24 0.36 1.51 0.77 -4.91 117.35 118.68 1c8m s TYR 64 Ca 0.62 -1.32 -0.17 0.00 -1.01 0.00 0.00 57.07 55.19 1c8m s TYR 64 Cb -0.33 -1.89 -0.03 0.00 -0.11 0.00 0.00 41.96 39.59 1c8m s TYR 64 CO 0.30 -0.63 0.46 0.99 -1.11 0.00 0.00 175.55 175.56 1c8m s THR 65 N 1.02 5.12 0.98 -0.71 2.01 -1.26 -0.89 115.64 121.92 1c8m s THR 65 Ca -0.02 0.78 -0.15 0.00 0.31 0.00 0.00 61.69 62.61 1c8m s THR 65 Cb -0.15 -3.78 0.19 0.00 0.01 0.00 0.00 72.50 68.78 1c8m s THR 65 CO -0.05 0.15 1.23 -0.76 -0.69 0.00 0.00 174.62 174.49 1c8m s LEU 66 N 1.98 2.13 0.35 4.42 1.02 -0.24 -5.00 118.68 123.33 1c8m s LEU 66 Ca 0.20 0.54 -0.28 0.00 0.02 0.00 0.00 54.13 54.60 1c8m s LEU 66 Cb -0.15 -2.62 -0.10 0.00 0.02 0.00 0.00 46.19 43.34 1c8m s LEU 66 CO 0.09 -2.89 1.28 -1.81 0.02 0.00 0.00 176.35 173.04 1c8m s ASP 67 N -4.48 6.69 0.60 2.29 1.01 -1.25 -4.63 116.67 116.90 1c8m s ASP 67 Ca 0.70 2.62 -0.15 0.00 0.71 0.00 0.00 52.55 56.43 1c8m s ASP 67 Cb -0.08 -2.64 -0.04 0.00 1.01 0.00 0.00 42.92 41.17 1c8m s ASP 67 CO 0.53 -0.59 1.04 -0.44 0.21 0.00 0.00 175.17 175.93 1c8m s SER 68 N -0.62 5.88 0.16 0.27 0.01 -1.26 -4.72 113.70 113.41 1c8m s SER 68 Ca 0.51 1.72 0.10 0.00 1.31 0.00 0.00 55.95 59.58 1c8m s SER 68 Cb -0.38 -2.52 -0.04 0.00 0.21 0.00 0.00 66.02 63.29 1c8m s SER 68 CO 0.50 -1.10 -0.22 -0.54 0.41 0.00 0.00 173.24 172.29 1c8m s LYS 69 N -4.31 1.34 -0.21 12.44 -0.14 -0.16 -4.95 119.74 123.75 1c8m s LYS 69 Ca 0.61 -1.39 -0.08 0.00 -1.36 0.00 0.00 55.97 53.75 1c8m s LYS 69 Cb -0.14 -1.61 -0.04 0.00 -1.68 0.00 0.00 37.83 34.36 1c8m s LYS 69 CO 0.40 0.35 0.09 -1.64 -0.76 0.00 0.00 175.35 173.79 1c8m s MET 70 N -2.45 3.92 -0.26 1.68 -1.94 -1.26 0.00 119.30 118.99 1c8m s MET 70 Ca 0.15 -0.36 -0.14 0.00 -1.71 0.00 0.00 55.69 53.63 1c8m s MET 70 Cb -0.08 -3.33 -0.04 0.00 2.01 0.00 0.00 34.83 33.39 1c8m s MET 70 CO 0.07 0.10 0.33 -0.46 -0.01 0.00 0.00 175.02 175.05 1c8m s TRP 71 N 0.87 3.26 0.31 -0.03 -0.00 -0.44 -4.95 118.94 117.95 1c8m s TRP 71 Ca 0.05 0.36 0.03 0.00 -0.00 0.00 0.00 56.10 56.54 1c8m s TRP 71 Cb -0.13 -2.51 -0.05 0.00 -0.00 0.00 0.00 33.47 30.78 1c8m s TRP 71 CO 0.03 -0.18 0.10 0.54 -0.00 0.00 0.00 176.95 177.44 1c8m s ASN 72 N 1.57 1.81 0.18 5.86 2.20 -1.26 -4.31 114.94 120.99 1c8m s ASN 72 Ca 0.13 -1.46 0.08 0.00 -0.94 0.00 0.00 52.86 50.67 1c8m s ASN 72 Cb -0.16 0.19 0.42 0.00 -2.00 0.00 0.00 41.25 39.70 1c8m s ASN 72 CO 0.10 -0.75 1.10 -1.54 -2.94 0.00 0.00 177.10 173.06 1c8m n SER 73 N -0.73 0.20 -0.27 3.54 3.41 -1.26 -1.65 113.62 116.86 1c8m n SER 73 Ca -0.01 0.46 0.04 0.00 -0.26 0.00 0.00 58.87 59.09 1c8m n SER 73 Cb 0.66 -0.43 0.02 0.00 -0.26 0.00 0.00 64.21 64.20 1c8m n SER 73 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1c8m n THR 74 N -1.73 0.00 -1.68 6.66 -2.24 -1.26 -4.76 114.28 109.26 1c8m n THR 74 Ca -0.01 -0.47 -0.43 0.00 -2.27 0.00 0.00 64.05 60.87 1c8m n THR 74 Cb 0.25 1.14 -0.01 0.00 -2.10 0.00 0.00 70.33 69.60 1c8m n THR 74 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1c8m n SER 75 N 0.18 2.60 -0.00 3.42 7.64 -0.66 -4.92 113.62 121.88 1c8m n SER 75 Ca 0.04 1.19 0.07 0.00 1.01 0.00 0.00 58.87 61.17 1c8m n SER 75 Cb 0.19 -1.45 -0.09 0.00 -1.01 0.00 0.00 64.21 61.85 1c8m n SER 75 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1c8m n LYS 76 N 1.02 1.60 0.00 1.43 5.02 -1.26 -4.76 118.16 121.21 1c8m n LYS 76 Ca 0.07 -0.06 0.00 0.00 -2.02 0.00 0.00 58.31 56.31 1c8m n LYS 76 Cb 0.34 -1.22 0.00 0.00 -0.02 0.00 0.00 35.03 34.13 1c8m n LYS 76 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1c8m n GLY 77 N 1.49 2.00 3.28 0.72 0.00 -1.26 -4.52 105.19 106.90 1c8m n GLY 77 Ca 0.00 -1.82 -0.14 0.00 0.00 0.00 0.00 46.02 44.06 1c8m n GLY 77 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1c8m s TRP 78 N -1.49 -0.25 -0.00 1.61 0.51 -0.34 -1.35 118.94 117.63 1c8m s TRP 78 Ca 0.00 0.40 -0.10 0.00 -2.12 0.00 0.00 56.10 54.28 1c8m s TRP 78 Cb 0.00 0.14 0.01 0.00 -0.81 0.00 0.00 33.47 32.81 1c8m s TRP 78 CO 0.00 -0.42 0.21 1.67 -0.51 0.00 0.00 176.95 177.90 1c8m s TRP 79 N -1.29 -0.04 0.06 -1.98 1.48 -0.77 -1.23 118.94 115.17 1c8m s TRP 79 Ca -0.13 0.00 0.02 0.00 -1.06 0.00 0.00 56.10 54.93 1c8m s TRP 79 Cb -0.04 0.01 -0.03 0.00 -1.16 0.00 0.00 33.47 32.24 1c8m s TRP 79 CO 0.05 -0.34 -0.07 -1.58 -4.06 0.00 0.00 176.95 170.96 1c8m s TRP 80 N -1.45 0.70 0.01 1.66 0.51 -0.17 -1.07 118.94 119.13 1c8m s TRP 80 Ca -0.14 -0.67 0.08 0.00 -2.12 0.00 0.00 56.10 53.25 1c8m s TRP 80 Cb -0.06 -0.42 -0.03 0.00 -0.81 0.00 0.00 33.47 32.15 1c8m s TRP 80 CO 0.02 -0.13 -0.25 0.15 -0.51 0.00 0.00 176.95 176.23 1c8m s LYS 81 N -2.43 2.00 0.08 4.98 1.02 -1.26 -0.17 119.74 123.97 1c8m s LYS 81 Ca -0.03 -0.99 0.07 0.00 0.02 0.00 0.00 55.97 55.04 1c8m s LYS 81 Cb -0.04 -2.05 -0.04 0.00 -0.52 0.00 0.00 37.83 35.18 1c8m s LYS 81 CO -0.02 0.54 -0.12 -0.51 -0.92 0.00 0.00 175.35 174.33 1c8m s LEU 82 N -0.96 2.95 0.00 3.17 1.43 0.37 -0.49 118.68 125.16 1c8m s LEU 82 Ca 0.11 -0.38 0.21 0.00 -1.03 0.00 0.00 54.13 53.04 1c8m s LEU 82 Cb -0.10 -1.75 1.18 0.00 0.03 0.00 0.00 46.19 45.55 1c8m s LEU 82 CO 0.01 0.20 1.65 -0.81 0.23 0.00 0.00 176.35 177.63 1c8m n PRO 83 N 0.95 0.53 -0.28 1.29 -0.04 -1.26 -1.27 135.00 134.92 1c8m n PRO 83 Ca -0.14 0.03 0.09 0.00 -0.04 0.00 0.00 63.50 63.44 1c8m n PRO 83 Cb 0.52 -1.50 0.22 0.00 -0.04 0.00 0.00 33.50 32.70 1c8m n PRO 83 CO 0.00 0.00 0.00 0.22 -0.04 0.00 0.00 175.50 175.68 1c8m h ASP 84 N 0.00 -0.13 -0.07 3.54 3.58 -1.80 0.27 116.42 121.80 1c8m h ASP 84 Ca 0.00 0.19 0.02 0.00 0.42 0.00 0.00 57.03 57.66 1c8m h ASP 84 Cb 0.07 0.29 -0.00 0.00 1.72 0.00 0.00 39.33 41.40 1c8m h ASP 84 CO 0.00 -0.14 0.10 0.00 -2.88 0.00 0.00 179.24 176.32 1c8m h ALA 85 N 1.73 1.53 -0.62 -0.78 0.00 -1.00 -1.51 119.26 118.60 1c8m h ALA 85 Ca 0.48 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.38 1c8m h ALA 85 Cb 0.89 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1c8m h ALA 85 CO -0.64 -0.14 0.00 1.28 0.00 0.00 0.00 179.25 179.75 1c8m n LEU 86 N -3.62 5.01 0.29 0.00 4.77 0.08 -3.46 117.00 120.07 1c8m n LEU 86 Ca -0.01 -2.58 0.16 0.00 -0.03 0.00 0.00 56.01 53.55 1c8m n LEU 86 Cb 0.20 -0.61 0.84 0.00 -2.33 0.00 0.00 43.42 41.52 1c8m n LEU 86 CO 0.25 0.77 1.03 0.07 -1.33 0.00 0.00 177.39 178.18 1c8m h LYS 87 N 4.03 0.00 -0.21 3.23 2.10 -1.29 -2.50 116.57 121.93 1c8m h LYS 87 Ca 0.00 0.00 -0.12 0.00 -2.00 0.00 0.00 60.65 58.53 1c8m h LYS 87 Cb 1.59 0.00 -0.08 0.00 -0.90 0.00 0.00 32.23 32.84 1c8m h LYS 87 CO 0.30 0.06 -0.32 -3.47 -2.00 0.00 0.00 179.45 174.02 1c8m n ASP 88 N -3.38 2.29 -4.22 7.07 4.64 -1.26 -4.61 116.55 117.09 1c8m n ASP 88 Ca -0.02 -3.85 -0.41 0.00 -1.38 0.00 0.00 54.79 49.13 1c8m n ASP 88 Cb 0.21 -0.57 -0.08 0.00 -1.04 0.00 0.00 41.12 39.64 1c8m n ASP 88 CO 0.00 0.00 0.00 -0.04 -0.82 0.00 0.00 177.20 176.34 1c8m s MET 89 N -3.28 2.51 0.30 -0.67 -1.94 -0.94 -4.98 119.30 110.30 1c8m s MET 89 Ca 0.42 -1.76 0.00 0.00 -1.71 0.00 0.00 55.69 52.64 1c8m s MET 89 Cb 0.39 -3.95 0.00 0.00 2.01 0.00 0.00 34.83 33.28 1c8m s MET 89 CO -0.03 -1.20 0.00 0.41 -0.01 0.00 0.00 175.02 174.18 1c8m n GLY 90 N 4.93 1.14 0.27 -0.03 0.00 -1.26 -1.37 105.19 108.86 1c8m n GLY 90 Ca -0.08 -0.41 0.02 0.00 0.00 0.00 0.00 46.02 45.54 1c8m n GLY 90 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1c8m h ILE 91 N 0.00 1.16 -0.32 -0.61 1.08 -1.97 -2.52 117.51 114.33 1c8m h ILE 91 Ca 0.00 -0.58 -0.01 0.00 -0.39 0.00 0.00 64.86 63.87 1c8m h ILE 91 Cb 0.00 0.88 -0.01 0.00 -3.07 0.00 0.00 36.82 34.61 1c8m h ILE 91 CO 0.00 0.21 0.16 0.15 -0.69 0.00 0.00 178.15 177.97 1c8m h PHE 92 N 0.44 0.46 -0.83 1.37 3.57 -1.74 -1.18 116.94 119.03 1c8m h PHE 92 Ca 0.10 -0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.55 1c8m h PHE 92 Cb 0.21 -0.14 -0.04 0.00 2.79 0.00 0.00 35.95 38.77 1c8m h PHE 92 CO 0.01 0.40 0.40 0.78 -2.23 0.00 0.00 178.31 177.67 1c8m h GLY 93 N 0.39 1.27 0.95 2.40 0.00 -0.92 -2.21 103.07 104.95 1c8m h GLY 93 Ca 0.11 -0.62 -0.03 0.00 0.00 0.00 0.00 47.33 46.78 1c8m h GLY 93 CO -0.01 0.59 0.15 0.83 0.00 0.00 0.00 176.54 178.10 1c8m h GLU 94 N 1.17 0.68 -0.35 4.80 4.39 -1.16 -2.87 114.58 121.23 1c8m h GLU 94 Ca 0.28 -0.14 -0.01 0.00 0.34 0.00 0.00 59.36 59.84 1c8m h GLU 94 Cb 0.11 -0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 28.64 1c8m h GLU 94 CO -0.04 0.65 0.18 -0.91 -1.16 0.00 0.00 179.01 177.73 1c8m h ASN 95 N 0.57 0.42 0.99 1.42 2.35 -0.87 -2.02 115.58 118.44 1c8m h ASN 95 Ca 0.14 -0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.87 1c8m h ASN 95 Cb 0.25 -0.11 0.00 0.00 0.05 0.00 0.00 38.32 38.51 1c8m h ASN 95 CO -0.01 0.36 0.00 0.00 -1.65 0.00 0.00 177.43 176.13 1c8m h MET 96 N 0.48 0.00 0.00 0.81 -0.00 -1.17 -2.94 114.93 112.11 1c8m h MET 96 Ca 0.12 0.00 -0.18 0.00 -0.00 0.00 0.00 59.70 59.65 1c8m h MET 96 Cb 0.04 0.00 -0.03 0.00 -0.00 0.00 0.00 31.60 31.60 1c8m h MET 96 CO -0.02 0.00 -2.17 1.19 -0.00 0.00 0.00 176.91 175.91 1c8m n PHE 97 N -2.46 0.02 0.81 -0.10 3.01 -0.81 -4.23 117.46 113.69 1c8m n PHE 97 Ca 0.03 0.01 0.13 0.00 1.01 0.00 0.00 57.45 58.62 1c8m n PHE 97 Cb 0.30 -0.75 0.40 0.00 -0.01 0.00 0.00 39.48 39.42 1c8m n PHE 97 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 1c8m n TYR 98 N -2.50 0.38 -4.49 1.38 4.02 -0.93 -1.35 117.16 113.67 1c8m n TYR 98 Ca -0.18 0.11 -0.29 0.00 -0.01 0.00 0.00 57.90 57.53 1c8m n TYR 98 Cb 0.85 -0.61 -0.13 0.00 -0.02 0.00 0.00 39.34 39.43 1c8m n TYR 98 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 176.86 174.84 1c8m s HIS 99 N -3.06 2.37 0.02 -0.72 3.76 -1.11 -0.94 115.29 115.59 1c8m s HIS 99 Ca 0.11 -0.36 -0.21 0.00 -0.15 0.00 0.00 55.06 54.45 1c8m s HIS 99 Cb 0.16 -1.31 -0.17 0.00 1.11 0.00 0.00 32.58 32.36 1c8m s HIS 99 CO 0.62 0.30 1.25 0.35 -0.85 0.00 0.00 174.74 176.41 1c8m h PHE 100 N 4.07 0.41 -3.41 1.40 -0.00 -1.16 -3.46 116.94 114.80 1c8m h PHE 100 Ca -0.50 -0.16 -0.65 0.00 -0.00 0.00 0.00 57.97 56.66 1c8m h PHE 100 Cb 1.16 -0.07 -0.14 0.00 -0.00 0.00 0.00 35.95 36.90 1c8m h PHE 100 CO 0.57 0.84 -0.71 -0.51 -0.00 0.00 0.00 178.31 178.50 1c8m s LEU 101 N -8.88 3.19 0.12 0.59 1.43 -0.64 -4.02 118.68 110.47 1c8m s LEU 101 Ca -0.14 -0.33 -0.11 0.00 -1.03 0.00 0.00 54.13 52.52 1c8m s LEU 101 Cb 0.04 -1.95 0.01 0.00 0.03 0.00 0.00 46.19 44.32 1c8m s LEU 101 CO 0.76 0.16 0.27 -0.83 0.23 0.00 0.00 176.35 176.94 1c8m s GLY 102 N -2.34 0.10 -0.21 -3.19 0.00 -0.01 -1.09 107.32 100.57 1c8m s GLY 102 Ca 0.23 -0.54 -0.19 0.00 0.00 0.00 0.00 44.72 44.22 1c8m s GLY 102 CO 0.16 -0.68 0.56 -1.60 0.00 0.00 0.00 173.10 171.53 1c8m s ARG 103 N -3.87 0.64 -0.17 2.90 3.52 -0.26 -2.08 118.95 119.62 1c8m s ARG 103 Ca 0.08 0.80 -0.31 0.00 -0.13 0.00 0.00 55.73 56.17 1c8m s ARG 103 Cb 0.04 0.29 0.14 0.00 -1.56 0.00 0.00 34.95 33.85 1c8m s ARG 103 CO -0.08 -0.09 1.10 0.45 -0.81 0.00 0.00 175.30 175.87 1c8m s SER 104 N 0.43 -0.26 0.54 -2.12 0.15 -1.26 -1.40 113.70 109.78 1c8m s SER 104 Ca -0.01 0.21 0.05 0.00 0.70 0.00 0.00 55.95 56.90 1c8m s SER 104 Cb -0.04 0.23 0.05 0.00 -1.71 0.00 0.00 66.02 64.54 1c8m s SER 104 CO -0.01 -0.29 0.41 0.61 1.20 0.00 0.00 173.24 175.15 1c8m n GLY 105 N 0.44 2.74 3.25 9.45 0.00 -0.29 -4.23 105.19 116.56 1c8m n GLY 105 Ca -0.06 -2.30 -0.10 0.00 0.00 0.00 0.00 46.02 43.56 1c8m n GLY 105 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1c8m s TYR 106 N -2.68 -0.03 -0.22 1.61 1.51 -0.51 -0.77 117.35 116.26 1c8m s TYR 106 Ca 0.31 -0.29 0.01 0.00 -1.01 0.00 0.00 57.07 56.09 1c8m s TYR 106 Cb -0.02 0.08 0.04 0.00 -0.11 0.00 0.00 41.96 41.95 1c8m s TYR 106 CO 0.20 -0.58 -0.14 0.99 -1.11 0.00 0.00 175.55 174.90 1c8m s THR 107 N -3.50 2.23 -0.21 -0.71 2.01 0.13 -0.98 115.64 114.61 1c8m s THR 107 Ca 0.02 -1.26 -0.07 0.00 0.31 0.00 0.00 61.69 60.69 1c8m s THR 107 Cb 0.02 -2.13 -0.03 0.00 0.01 0.00 0.00 72.50 70.37 1c8m s THR 107 CO -0.09 0.24 0.05 -0.69 -0.69 0.00 0.00 174.62 173.44 1c8m s VAL 108 N 1.21 4.43 -0.25 3.82 1.01 0.96 -0.88 120.40 130.71 1c8m s VAL 108 Ca -0.02 -0.15 0.01 0.00 0.00 0.00 0.00 61.98 61.83 1c8m s VAL 108 Cb -0.17 -3.03 0.07 0.00 0.00 0.00 0.00 36.38 33.25 1c8m s VAL 108 CO -0.08 0.40 -0.04 -2.28 0.00 0.00 0.00 175.10 173.10 1c8m s HIS 109 N 1.00 2.60 -0.13 5.22 2.46 -0.12 -1.08 115.29 125.23 1c8m s HIS 109 Ca 0.03 -1.96 -0.16 0.00 0.47 0.00 0.00 55.06 53.45 1c8m s HIS 109 Cb -0.14 -1.78 -0.05 0.00 -0.13 0.00 0.00 32.58 30.49 1c8m s HIS 109 CO 0.03 -0.81 0.39 0.08 -2.47 0.00 0.00 174.74 171.95 1c8m s VAL 110 N 1.32 5.23 -0.09 0.89 1.01 -0.35 -1.45 120.40 126.96 1c8m s VAL 110 Ca -0.03 0.76 0.04 0.00 0.00 0.00 0.00 61.98 62.75 1c8m s VAL 110 Cb -0.19 -3.72 -0.01 0.00 0.00 0.00 0.00 36.38 32.46 1c8m s VAL 110 CO -0.08 0.38 -0.22 -1.10 0.00 0.00 0.00 175.10 174.08 1c8m s GLN 111 N 0.39 2.93 -0.30 2.72 -0.21 0.15 -1.04 119.66 124.29 1c8m s GLN 111 Ca 0.21 -0.85 -0.04 0.00 0.02 0.00 0.00 55.36 54.71 1c8m s GLN 111 Cb -0.14 -2.32 0.18 0.00 1.00 0.00 0.00 33.01 31.73 1c8m s GLN 111 CO 0.08 0.27 0.69 0.00 -2.12 0.00 0.00 175.29 174.20 1c8m s ASN 113 N 2.87 3.50 0.00 0.00 4.22 -1.26 -4.44 114.94 119.83 1c8m s ASN 113 Ca 0.15 -0.72 0.00 0.00 -2.14 0.00 0.00 52.86 50.15 1c8m s ASN 113 Cb -0.14 -0.32 0.00 0.00 1.28 0.00 0.00 41.25 42.07 1c8m s ASN 113 CO -0.19 0.17 0.00 0.00 -2.04 0.00 0.00 177.10 175.04 1c8m n ALA 114 N 0.76 0.00 -3.81 3.54 0.00 -1.26 -4.78 120.51 114.96 1c8m n ALA 114 Ca -0.16 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.24 1c8m n ALA 114 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.99 1c8m n ALA 114 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1c8m s SER 115 N 1.00 -0.09 0.00 0.00 1.04 -1.26 -5.00 113.70 109.39 1c8m s SER 115 Ca 0.00 -0.58 0.15 0.00 0.48 0.00 0.00 55.95 56.00 1c8m s SER 115 Cb 0.00 0.53 0.91 0.00 0.10 0.00 0.00 66.02 67.56 1c8m s SER 115 CO 0.00 -1.01 1.48 0.29 0.98 0.00 0.00 173.24 174.97 1c8m n LYS 116 N -0.56 0.85 -0.08 4.02 5.02 -1.26 -2.33 118.16 123.82 1c8m n LYS 116 Ca -0.05 0.00 0.06 0.00 -2.02 0.00 0.00 58.31 56.30 1c8m n LYS 116 Cb 0.60 -1.28 0.11 0.00 -0.02 0.00 0.00 35.03 34.44 1c8m n LYS 116 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 1c8m n PHE 117 N -0.78 0.10 -4.32 2.13 3.01 -1.26 -5.00 117.46 111.34 1c8m n PHE 117 Ca 0.11 -0.81 -0.26 0.00 1.01 0.00 0.00 57.45 57.51 1c8m n PHE 117 Cb 0.05 -0.13 -0.09 0.00 -0.01 0.00 0.00 39.48 39.30 1c8m n PHE 117 CO 0.00 0.00 0.00 -1.01 1.01 0.00 0.00 176.76 176.76 1c8m s HIS 118 N -2.19 2.59 0.02 1.38 3.76 -0.98 -4.41 115.29 115.46 1c8m s HIS 118 Ca 0.22 -0.24 -0.02 0.00 -0.15 0.00 0.00 55.06 54.87 1c8m s HIS 118 Cb 0.19 -1.24 -0.01 0.00 1.11 0.00 0.00 32.58 32.63 1c8m s HIS 118 CO 0.03 0.54 0.03 1.14 -0.85 0.00 0.00 174.74 175.63 1c8m s GLN 119 N -3.00 0.39 0.00 1.40 -2.07 -0.27 -4.57 119.66 111.54 1c8m s GLN 119 Ca 0.26 -0.59 0.00 0.00 -1.82 0.00 0.00 55.36 53.21 1c8m s GLN 119 Cb -0.08 0.15 0.00 0.00 -1.09 0.00 0.00 33.01 31.99 1c8m s GLN 119 CO 0.15 -0.08 0.00 0.41 -1.32 0.00 0.00 175.29 174.46 1c8m n GLY 120 N 1.43 2.83 3.01 2.60 0.00 -1.26 -1.09 105.19 112.71 1c8m n GLY 120 Ca -0.23 -0.83 -0.13 0.00 0.00 0.00 0.00 46.02 44.83 1c8m n GLY 120 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1c8m s THR 121 N -2.00 -0.04 -0.10 2.61 2.01 -0.34 -1.35 115.64 116.42 1c8m s THR 121 Ca 0.00 0.14 0.01 0.00 0.31 0.00 0.00 61.69 62.16 1c8m s THR 121 Cb 0.00 -0.32 -0.02 0.00 0.01 0.00 0.00 72.50 72.17 1c8m s THR 121 CO 0.00 0.06 -0.13 -0.76 -0.69 0.00 0.00 174.62 173.10 1c8m s LEU 122 N 1.11 2.77 -0.32 4.42 1.43 -0.18 -1.24 118.68 126.69 1c8m s LEU 122 Ca -0.08 -0.26 -0.13 0.00 -1.03 0.00 0.00 54.13 52.63 1c8m s LEU 122 Cb -0.10 -1.60 -0.03 0.00 0.03 0.00 0.00 46.19 44.49 1c8m s LEU 122 CO -0.07 0.24 0.27 -0.22 0.23 0.00 0.00 176.35 176.80 1c8m s LEU 123 N -0.08 4.32 -0.29 1.79 2.96 0.05 -0.61 118.68 126.81 1c8m s LEU 123 Ca -0.02 -0.20 -0.09 0.00 -0.22 0.00 0.00 54.13 53.61 1c8m s LEU 123 Cb -0.14 -2.21 -0.01 0.00 0.50 0.00 0.00 46.19 44.33 1c8m s LEU 123 CO 0.04 -0.20 0.12 -0.69 -1.32 0.00 0.00 176.35 174.30 1c8m s VAL 124 N 1.83 4.48 0.06 1.68 1.01 -0.01 -1.75 120.40 127.70 1c8m s VAL 124 Ca 0.08 -0.36 0.06 0.00 0.00 0.00 0.00 61.98 61.77 1c8m s VAL 124 Cb -0.17 -3.23 -0.03 0.00 0.00 0.00 0.00 36.38 32.96 1c8m s VAL 124 CO 0.11 0.15 -0.17 -0.69 0.00 0.00 0.00 175.10 174.49 1c8m s VAL 125 N 1.61 1.39 -0.27 2.92 1.01 0.17 -1.43 120.40 125.80 1c8m s VAL 125 Ca 0.05 -1.20 -0.01 0.00 0.00 0.00 0.00 61.98 60.82 1c8m s VAL 125 Cb -0.16 -1.25 0.04 0.00 0.00 0.00 0.00 36.38 35.00 1c8m s VAL 125 CO 0.05 0.03 -0.05 -0.04 0.00 0.00 0.00 175.10 175.10 1c8m s MET 126 N -1.36 2.61 -0.18 2.72 -1.94 -0.60 -0.78 119.30 119.78 1c8m s MET 126 Ca 0.04 -1.13 -0.05 0.00 -1.71 0.00 0.00 55.69 52.84 1c8m s MET 126 Cb -0.09 -3.04 -0.03 0.00 2.01 0.00 0.00 34.83 33.68 1c8m s MET 126 CO 0.02 -0.50 -0.01 0.42 -0.01 0.00 0.00 175.02 174.94 1c8m s ILE 127 N 1.27 4.03 0.11 2.53 1.01 -0.16 -3.86 121.20 126.13 1c8m s ILE 127 Ca -0.03 -0.30 -0.25 0.00 0.00 0.00 0.00 60.65 60.08 1c8m s ILE 127 Cb -0.18 -2.80 -0.07 0.00 0.01 0.00 0.00 42.46 39.42 1c8m s ILE 127 CO -0.03 0.46 0.76 -2.16 0.00 0.00 0.00 174.94 173.96 1c8m s PRO 128 N 0.67 4.51 -1.11 2.79 0.04 -1.26 -1.06 135.00 139.59 1c8m s PRO 128 Ca -0.01 1.09 -0.18 0.00 0.04 0.00 0.00 61.00 61.94 1c8m s PRO 128 Cb -0.14 -3.30 -0.02 0.00 0.04 0.00 0.00 34.50 31.08 1c8m s PRO 128 CO 0.02 0.46 0.81 0.39 0.04 0.00 0.00 177.00 178.72 1c8m n GLU 129 N 2.09 -1.36 -2.76 4.56 -0.58 -0.35 -4.86 120.64 117.38 1c8m n GLU 129 Ca -0.05 0.55 -0.43 0.00 -0.42 0.00 0.00 57.16 56.81 1c8m n GLU 129 Cb 0.49 -4.36 -0.01 0.00 -0.57 0.00 0.00 31.44 26.99 1c8m n GLU 129 CO 0.00 0.00 0.00 -1.58 -0.48 0.00 0.00 177.13 175.07 1c8m s HIS 130 N -3.43 3.03 -0.58 -0.32 2.46 -1.26 -4.94 115.29 110.24 1c8m s HIS 130 Ca 0.45 -1.59 -0.28 0.00 0.47 0.00 0.00 55.06 54.11 1c8m s HIS 130 Cb -0.15 -4.51 0.02 0.00 -0.13 0.00 0.00 32.58 27.81 1c8m s HIS 130 CO 0.84 -1.64 1.27 -1.14 -2.47 0.00 0.00 174.74 171.60 1c8m s GLN 131 N 3.23 3.43 0.72 2.88 0.74 -1.26 -4.99 119.66 124.41 1c8m s GLN 131 Ca 0.45 0.30 -0.14 0.00 0.05 0.00 0.00 55.36 56.01 1c8m s GLN 131 Cb -0.01 -4.06 0.03 0.00 1.10 0.00 0.00 33.01 30.08 1c8m s GLN 131 CO -0.01 -1.79 1.14 -0.51 -0.55 0.00 0.00 175.29 173.57 1c8m s LEU 132 N 5.36 3.27 0.29 3.68 1.43 -1.26 -4.77 118.68 126.68 1c8m s LEU 132 Ca 0.46 2.11 0.09 0.00 -1.03 0.00 0.00 54.13 55.75 1c8m s LEU 132 Cb -0.09 -4.56 -0.04 0.00 0.03 0.00 0.00 46.19 41.53 1c8m s LEU 132 CO 0.25 -2.02 0.07 0.00 0.23 0.00 0.00 176.35 174.87 1c8m s ALA 133 N -2.33 3.32 0.15 4.21 0.00 -0.26 -4.67 121.76 122.19 1c8m s ALA 133 Ca 0.68 -1.68 0.09 0.00 0.00 0.00 0.00 51.96 51.05 1c8m s ALA 133 Cb -0.23 -0.83 -0.04 0.00 0.00 0.00 0.00 23.12 22.02 1c8m s ALA 133 CO 0.46 0.19 -0.12 0.95 0.00 0.00 0.00 175.76 177.24 1c8m s THR 134 N -2.33 3.10 -0.13 0.00 -4.23 -1.26 0.37 115.64 111.16 1c8m s THR 134 Ca 0.34 -1.57 -0.01 0.00 -1.18 0.00 0.00 61.69 59.26 1c8m s THR 134 Cb -0.05 -2.49 -0.02 0.00 1.34 0.00 0.00 72.50 71.27 1c8m s THR 134 CO 0.21 -0.02 -0.09 -0.69 -0.54 0.00 0.00 174.62 173.49 1c8m s VAL 135 N -1.49 3.44 -1.48 2.29 1.01 -1.26 -4.68 120.40 118.23 1c8m s VAL 135 Ca 0.22 -0.53 -0.11 0.00 0.00 0.00 0.00 61.98 61.56 1c8m s VAL 135 Cb -0.10 -2.46 0.06 0.00 0.00 0.00 0.00 36.38 33.89 1c8m s VAL 135 CO 0.13 0.53 0.96 0.59 0.00 0.00 0.00 175.10 177.32 1c8m n ASN 136 N 3.28 -4.38 -0.54 3.32 3.02 -1.26 -4.90 115.26 113.80 1c8m n ASN 136 Ca -0.18 -0.76 0.04 0.00 -0.03 0.00 0.00 54.58 53.66 1c8m n ASN 136 Cb 0.53 -4.05 0.07 0.00 -0.61 0.00 0.00 39.78 35.72 1c8m n ASN 136 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1c8m n LYS 137 N -4.66 0.59 0.00 3.52 5.02 -1.26 -5.12 118.16 116.26 1c8m n LYS 137 Ca -0.02 -1.93 0.00 0.00 -2.02 0.00 0.00 58.31 54.34 1c8m n LYS 137 Cb 0.55 -0.86 0.00 0.00 -0.02 0.00 0.00 35.03 34.70 1c8m n LYS 137 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1c8m n GLY 138 N -0.50 1.62 1.14 0.72 0.00 -1.26 -3.11 105.19 103.79 1c8m n GLY 138 Ca 0.08 -0.62 0.04 0.00 0.00 0.00 0.00 46.02 45.52 1c8m n GLY 138 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1c8m n ASN 139 N 0.77 3.20 -4.67 1.61 0.23 -1.26 -4.88 115.26 110.27 1c8m n ASN 139 Ca 0.00 -2.41 -0.43 0.00 -0.53 0.00 0.00 54.58 51.21 1c8m n ASN 139 Cb 0.00 -0.56 -0.03 0.00 -2.08 0.00 0.00 39.78 37.12 1c8m n ASN 139 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 1c8m s VAL 140 N -1.83 4.75 0.39 3.53 1.01 -1.18 -5.04 120.40 122.02 1c8m s VAL 140 Ca 0.27 1.95 0.03 0.00 0.00 0.00 0.00 61.98 64.23 1c8m s VAL 140 Cb 0.20 -4.28 -0.01 0.00 0.00 0.00 0.00 36.38 32.29 1c8m s VAL 140 CO 0.09 -0.09 0.57 0.20 0.00 0.00 0.00 175.10 175.86 1c8m s ASN 141 N 1.18 5.97 0.22 3.32 0.01 -1.26 -4.67 114.94 119.70 1c8m s ASN 141 Ca 0.44 0.14 -0.32 0.00 -0.71 0.00 0.00 52.86 52.41 1c8m s ASN 141 Cb -0.16 -1.52 -0.14 0.00 0.41 0.00 0.00 41.25 39.84 1c8m s ASN 141 CO 0.10 -0.52 1.28 0.00 -1.51 0.00 0.00 177.10 176.45 1c8m n ALA 142 N -1.86 0.22 -1.96 0.60 0.00 -1.26 -4.77 120.51 111.48 1c8m n ALA 142 Ca -0.01 0.43 -0.32 0.00 0.00 0.00 0.00 53.44 53.54 1c8m n ALA 142 Cb 0.58 -2.15 -0.06 0.00 0.00 0.00 0.00 19.45 17.82 1c8m n ALA 142 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1c8m s GLY 143 N 0.10 2.25 0.23 0.00 0.00 0.05 -4.96 107.32 104.99 1c8m s GLY 143 Ca 0.69 0.18 -0.10 0.00 0.00 0.00 0.00 44.72 45.49 1c8m s GLY 143 CO 0.52 0.42 1.62 -1.82 0.00 0.00 0.00 173.10 173.84 1c8m h TYR 144 N 1.72 -0.24 0.00 1.90 3.20 -1.91 -0.72 116.97 120.92 1c8m h TYR 144 Ca -0.48 0.06 -0.00 0.00 3.14 0.00 0.00 58.73 61.45 1c8m h TYR 144 Cb 1.18 0.22 -0.00 0.00 1.54 0.00 0.00 36.73 39.67 1c8m h TYR 144 CO 0.62 -0.27 -0.00 1.57 -1.64 0.00 0.00 178.16 178.44 1c8m h LYS 145 N 0.04 0.00 0.06 1.82 2.10 -1.94 -2.51 116.57 116.14 1c8m h LYS 145 Ca 0.36 0.00 -0.27 0.00 -2.00 0.00 0.00 60.65 58.75 1c8m h LYS 145 Cb 0.59 0.00 0.02 0.00 -0.90 0.00 0.00 32.23 31.93 1c8m h LYS 145 CO -0.69 0.00 -1.10 1.88 -2.00 0.00 0.00 179.45 177.54 1c8m h TYR 146 N 0.00 0.82 -0.39 0.07 -1.99 -1.46 -3.16 116.97 110.86 1c8m h TYR 146 Ca -0.00 -0.49 0.00 0.00 2.00 0.00 0.00 58.73 60.24 1c8m h TYR 146 Cb 0.42 -0.08 0.00 0.00 2.00 0.00 0.00 36.73 39.07 1c8m h TYR 146 CO 0.00 1.33 0.00 0.25 -0.00 0.00 0.00 178.16 179.74 1c8m n THR 147 N -3.76 0.52 -3.01 -2.88 -2.24 -1.10 -4.16 114.28 97.66 1c8m n THR 147 Ca -0.10 -0.52 -0.21 0.00 -2.27 0.00 0.00 64.05 60.95 1c8m n THR 147 Cb 0.92 0.26 -0.02 0.00 -2.10 0.00 0.00 70.33 69.38 1c8m n THR 147 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1c8m n HIS 148 N 0.64 1.75 0.29 4.78 8.25 -0.97 -4.84 115.22 125.11 1c8m n HIS 148 Ca 0.13 -3.72 0.17 0.00 -0.26 0.00 0.00 57.72 54.04 1c8m n HIS 148 Cb 0.33 -0.42 0.81 0.00 1.12 0.00 0.00 29.99 31.83 1c8m n HIS 148 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1c8m h PRO 149 N 2.97 0.00 0.00 -0.41 0.11 -1.72 -3.47 132.00 129.48 1c8m h PRO 149 Ca 0.10 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.21 1c8m h PRO 149 Cb 0.84 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.95 1c8m h PRO 149 CO 0.63 0.04 0.00 0.41 -0.21 0.00 0.00 178.00 178.86 1c8m n GLY 150 N -0.34 -1.60 0.15 -0.55 0.00 -1.26 -3.97 105.19 97.62 1c8m n GLY 150 Ca -0.01 -1.48 0.11 0.00 0.00 0.00 0.00 46.02 44.65 1c8m n GLY 150 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1c8m n GLU 151 N 0.00 0.16 0.10 1.61 0.28 -1.22 -1.77 120.64 119.79 1c8m n GLU 151 Ca 0.00 0.57 0.13 0.00 -0.16 0.00 0.00 57.16 57.70 1c8m n GLU 151 Cb 0.00 -1.93 0.37 0.00 1.43 0.00 0.00 31.44 31.30 1c8m n GLU 151 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1c8m n ALA 152 N -1.78 2.37 -0.83 -1.84 0.00 -1.25 -3.87 120.51 113.31 1c8m n ALA 152 Ca -0.00 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.39 1c8m n ALA 152 Cb 0.09 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.11 1c8m n ALA 152 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1c8m n GLY 153 N 1.31 0.88 3.01 0.00 0.00 -0.73 -4.72 105.19 104.93 1c8m n GLY 153 Ca 0.05 -0.83 -0.25 0.00 0.00 0.00 0.00 46.02 44.99 1c8m n GLY 153 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1c8m s ARG 154 N 0.00 1.72 -0.35 1.61 6.06 -0.23 -4.84 118.95 122.91 1c8m s ARG 154 Ca 0.00 -0.40 -0.18 0.00 -2.50 0.00 0.00 55.73 52.65 1c8m s ARG 154 Cb 0.00 -1.48 -0.00 0.00 0.06 0.00 0.00 34.95 33.53 1c8m s ARG 154 CO 0.00 -0.03 0.50 -1.21 -2.50 0.00 0.00 175.30 172.06 1c8m s GLU 155 N 0.88 3.59 0.29 5.12 2.02 -1.26 -1.84 118.70 127.49 1c8m s GLU 155 Ca -0.10 -0.21 -0.30 0.00 0.02 0.00 0.00 54.97 54.37 1c8m s GLU 155 Cb -0.15 -3.82 -0.11 0.00 0.10 0.00 0.00 34.13 30.15 1c8m s GLU 155 CO 0.01 -0.65 1.55 0.08 0.02 0.00 0.00 175.26 176.28 1c8m s VAL 156 N 2.36 2.19 0.00 2.63 1.01 -0.45 -3.48 120.40 124.65 1c8m s VAL 156 Ca 0.18 0.16 0.00 0.00 0.00 0.00 0.00 61.98 62.32 1c8m s VAL 156 Cb -0.16 -3.10 0.00 0.00 0.00 0.00 0.00 36.38 33.12 1c8m s VAL 156 CO 0.13 0.03 0.00 0.61 0.00 0.00 0.00 175.10 175.87 1c8m n GLY 157 N 2.07 0.77 0.70 4.51 0.00 -1.26 -4.40 105.19 107.59 1c8m n GLY 157 Ca 0.07 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.43 1c8m n GLY 157 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1c8m n THR 158 N -2.97 0.00 -1.45 2.61 -2.24 -1.23 -5.09 114.28 103.91 1c8m n THR 158 Ca 0.00 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.36 1c8m n THR 158 Cb 0.41 -0.47 0.00 0.00 -2.10 0.00 0.00 70.33 68.17 1c8m n THR 158 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1c8m n GLN 159 N -2.21 0.57 -2.74 -0.78 6.02 -1.26 -4.95 117.38 112.04 1c8m n GLN 159 Ca 0.00 0.21 -0.42 0.00 -0.01 0.00 0.00 57.00 56.77 1c8m n GLN 159 Cb 0.18 -1.48 -0.03 0.00 1.02 0.00 0.00 30.24 29.93 1c8m n GLN 159 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 1c8m s VAL 160 N -1.41 4.10 0.00 5.09 -7.23 -1.26 -4.93 120.40 114.76 1c8m s VAL 160 Ca 0.63 -0.10 0.00 0.00 -1.81 0.00 0.00 61.98 60.69 1c8m s VAL 160 Cb -0.64 -4.78 0.00 0.00 0.56 0.00 0.00 36.38 31.52 1c8m s VAL 160 CO 0.58 -1.62 0.28 -0.62 -0.31 0.00 0.00 175.10 173.41 1c8m n GLU 161 N 8.33 0.00 -1.73 4.82 -0.58 -1.26 -4.93 120.64 125.28 1c8m n GLU 161 Ca -0.00 0.00 -0.30 0.00 -0.42 0.00 0.00 57.16 56.44 1c8m n GLU 161 Cb 0.47 -0.42 0.08 0.00 -0.57 0.00 0.00 31.44 31.00 1c8m n GLU 161 CO 0.00 0.00 0.00 -0.80 -0.48 0.00 0.00 177.13 175.85 1c8m s ASN 162 N 0.85 4.76 0.11 1.62 0.02 -1.26 -5.00 114.94 116.05 1c8m s ASN 162 Ca 0.00 1.12 -0.15 0.00 -1.02 0.00 0.00 52.86 52.82 1c8m s ASN 162 Cb 0.00 -1.83 -0.05 0.00 0.02 0.00 0.00 41.25 39.39 1c8m s ASN 162 CO 0.00 -1.78 1.50 -0.08 0.02 0.00 0.00 177.10 176.76 1c8m h GLU 163 N -0.96 0.72 -0.97 -0.60 4.81 -2.02 -3.15 114.58 112.41 1c8m h GLU 163 Ca -0.46 -0.30 -0.09 0.00 -0.13 0.00 0.00 59.36 58.38 1c8m h GLU 163 Cb 1.28 -0.03 -0.05 0.00 0.63 0.00 0.00 28.75 30.58 1c8m h GLU 163 CO 0.62 0.90 0.11 1.63 -0.73 0.00 0.00 179.01 181.54 1c8m n LYS 164 N -4.35 1.53 -2.68 1.92 4.76 -1.26 -4.88 118.16 113.20 1c8m n LYS 164 Ca -0.02 -0.76 -0.42 0.00 -2.87 0.00 0.00 58.31 54.24 1c8m n LYS 164 Cb 0.38 -1.42 -0.03 0.00 -1.84 0.00 0.00 35.03 32.12 1c8m n LYS 164 CO 0.00 0.00 0.00 -1.14 -1.37 0.00 0.00 177.40 174.89 1c8m s GLN 165 N -1.02 4.53 1.00 1.97 2.00 -1.19 -0.77 119.66 126.17 1c8m s GLN 165 Ca 0.14 1.45 -0.12 0.00 -2.00 0.00 0.00 55.36 54.82 1c8m s GLN 165 Cb 0.11 -3.46 0.19 0.00 0.80 0.00 0.00 33.01 30.65 1c8m s GLN 165 CO 0.03 -0.11 1.10 -1.25 -0.50 0.00 0.00 175.29 174.55 1c8m s PRO 166 N 1.18 0.43 0.60 1.67 0.04 -1.26 -4.71 135.00 132.95 1c8m s PRO 166 Ca 0.52 0.49 -0.20 0.00 0.04 0.00 0.00 61.00 61.85 1c8m s PRO 166 Cb -0.21 -1.74 -0.03 0.00 0.04 0.00 0.00 34.50 32.55 1c8m s PRO 166 CO 0.26 -2.72 1.28 0.45 0.04 0.00 0.00 177.00 176.31 1c8m n SER 167 N -4.16 2.16 -0.32 6.66 2.88 0.16 -4.89 113.62 116.10 1c8m n SER 167 Ca 0.05 0.89 0.08 0.00 -1.33 0.00 0.00 58.87 58.56 1c8m n SER 167 Cb 0.57 -1.54 0.14 0.00 -0.75 0.00 0.00 64.21 62.64 1c8m n SER 167 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1c8m n ASP 168 N -1.33 1.91 -4.42 -3.46 9.92 -1.26 -4.80 116.55 113.11 1c8m n ASP 168 Ca 0.13 -3.20 -0.44 0.00 -0.53 0.00 0.00 54.79 50.76 1c8m n ASP 168 Cb 0.46 -0.43 -0.04 0.00 -0.64 0.00 0.00 41.12 40.47 1c8m n ASP 168 CO 0.00 0.00 0.00 -1.81 0.13 0.00 0.00 177.20 175.52 1c8m s ASP 169 N -2.79 6.23 0.32 -2.24 1.01 -1.26 -4.64 116.67 113.30 1c8m s ASP 169 Ca 0.31 -1.27 0.02 0.00 0.71 0.00 0.00 52.55 52.32 1c8m s ASP 169 Cb 0.29 -2.37 0.55 0.00 1.01 0.00 0.00 42.92 42.39 1c8m s ASP 169 CO -0.01 -1.28 1.88 -0.55 0.21 0.00 0.00 175.17 175.42 1c8m h ASN 170 N 9.34 0.62 0.54 0.27 7.08 -1.93 -2.10 115.58 129.41 1c8m h ASN 170 Ca -0.24 -0.10 0.00 0.00 -3.08 0.00 0.00 56.30 52.88 1c8m h ASN 170 Cb 1.07 -0.16 0.00 0.00 -2.08 0.00 0.00 38.32 37.15 1c8m h ASN 170 CO 1.14 0.62 0.00 4.11 -2.08 0.00 0.00 177.43 181.22 1c8m h TRP 171 N 0.66 0.00 -0.20 4.14 5.08 -1.93 -1.84 115.95 121.85 1c8m h TRP 171 Ca 0.15 0.00 -0.06 0.00 1.08 0.00 0.00 58.89 60.06 1c8m h TRP 171 Cb 0.24 0.00 -0.03 0.00 -3.00 0.00 0.00 29.16 26.37 1c8m h TRP 171 CO 0.01 0.00 -0.08 1.28 -1.28 0.00 0.00 178.44 178.37 1c8m n LEU 172 N -2.31 3.47 -2.00 0.11 4.77 -0.83 -1.69 117.00 118.51 1c8m n LEU 172 Ca 0.01 -3.37 -0.10 0.00 -0.03 0.00 0.00 56.01 52.52 1c8m n LEU 172 Cb 0.18 -0.54 -0.02 0.00 -2.33 0.00 0.00 43.42 40.70 1c8m n LEU 172 CO 0.18 0.95 -0.12 0.59 -1.33 0.00 0.00 177.39 177.65 1c8m n ASN 173 N -0.99 -3.16 -0.68 -1.43 5.03 -0.69 -1.25 115.26 112.09 1c8m n ASN 173 Ca 0.23 0.25 -0.08 0.00 0.87 0.00 0.00 54.58 55.86 1c8m n ASN 173 Cb 0.86 -2.83 -0.03 0.00 -1.02 0.00 0.00 39.78 36.75 1c8m n ASN 173 CO 0.00 0.00 0.00 0.49 -1.83 0.00 0.00 177.26 175.92 1c8m n PHE 174 N -2.64 -0.09 -1.33 3.10 3.72 -0.95 -4.68 117.46 114.59 1c8m n PHE 174 Ca -0.12 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.28 1c8m n PHE 174 Cb 0.49 -2.31 0.00 0.00 -0.94 0.00 0.00 39.48 36.72 1c8m n PHE 174 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 1c8m n ASP 175 N -0.55 0.00 0.00 4.37 5.68 -0.53 -1.10 116.55 124.41 1c8m n ASP 175 Ca -0.08 -1.04 0.00 0.00 -0.50 0.00 0.00 54.79 53.17 1c8m n ASP 175 Cb 0.47 -0.01 0.00 0.00 -1.14 0.00 0.00 41.12 40.45 1c8m n ASP 175 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1c8m n GLY 176 N 0.00 0.63 3.26 6.12 0.00 -0.38 -4.85 105.19 109.97 1c8m n GLY 176 Ca 0.00 -0.64 -0.17 0.00 0.00 0.00 0.00 46.02 45.22 1c8m n GLY 176 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1c8m s THR 177 N -2.00 1.35 0.14 2.61 -4.23 -1.08 -5.05 115.64 107.38 1c8m s THR 177 Ca 0.00 -1.92 -0.30 0.00 -1.18 0.00 0.00 61.69 58.29 1c8m s THR 177 Cb 0.00 -1.72 -0.07 0.00 1.34 0.00 0.00 72.50 72.05 1c8m s THR 177 CO 0.00 -0.56 0.95 -0.76 -0.54 0.00 0.00 174.62 173.71 1c8m s LEU 178 N -2.84 4.53 0.28 4.79 1.43 -1.26 -2.94 118.68 122.67 1c8m s LEU 178 Ca 0.14 1.82 0.03 0.00 -1.03 0.00 0.00 54.13 55.08 1c8m s LEU 178 Cb -0.02 -3.58 0.67 0.00 0.03 0.00 0.00 46.19 43.30 1c8m s LEU 178 CO 0.03 -0.01 1.74 0.25 0.23 0.00 0.00 176.35 178.59 1c8m h LEU 179 N 5.24 0.50 -1.97 1.79 5.85 -1.57 -1.49 115.31 123.66 1c8m h LEU 179 Ca -0.43 0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.41 1c8m h LEU 179 Cb 1.21 0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.29 1c8m h LEU 179 CO 0.71 0.13 0.00 1.23 -0.34 0.00 0.00 178.44 180.17 1c8m h GLY 180 N 0.55 0.00 -1.49 3.75 0.00 -1.93 -1.22 103.07 102.73 1c8m h GLY 180 Ca 0.53 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.86 1c8m h GLY 180 CO -0.44 0.00 0.00 0.70 0.00 0.00 0.00 176.54 176.80 1c8m n ASN 181 N -2.54 2.53 0.21 0.19 3.02 -0.56 -4.17 115.26 113.94 1c8m n ASN 181 Ca -0.02 -1.83 0.15 0.00 -0.03 0.00 0.00 54.58 52.85 1c8m n ASN 181 Cb 0.05 -0.09 0.71 0.00 -0.61 0.00 0.00 39.78 39.84 1c8m n ASN 181 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1c8m h LEU 182 N 3.64 0.00 0.00 3.41 3.38 -1.34 -2.66 115.31 121.74 1c8m h LEU 182 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1c8m h LEU 182 Cb 0.79 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.54 1c8m h LEU 182 CO 0.00 0.00 0.00 0.18 0.09 0.00 0.00 178.44 178.71 1c8m n LEU 183 N -2.56 0.00 0.05 1.67 4.32 -1.26 -1.70 117.00 117.52 1c8m n LEU 183 Ca -0.00 0.27 0.14 0.00 -0.02 0.00 0.00 56.01 56.39 1c8m n LEU 183 Cb 0.14 -0.27 0.52 0.00 -1.62 0.00 0.00 43.42 42.19 1c8m n LEU 183 CO 0.17 -0.19 0.93 0.00 -1.22 0.00 0.00 177.39 177.07 1c8m n ILE 184 N -1.27 0.26 -3.66 -0.08 0.13 -1.00 -4.78 119.36 108.95 1c8m n ILE 184 Ca 0.04 -0.12 -0.20 0.00 -1.10 0.00 0.00 62.75 61.37 1c8m n ILE 184 Cb 0.07 -0.53 -0.01 0.00 -0.84 0.00 0.00 39.64 38.32 1c8m n ILE 184 CO 0.00 0.00 0.00 -0.36 2.80 0.00 0.00 176.55 178.99 1c8m s PHE 185 N -3.04 3.27 0.15 9.51 2.99 -0.69 -5.03 117.98 125.14 1c8m s PHE 185 Ca 0.13 -0.10 -0.32 0.00 0.00 0.00 0.00 56.93 56.63 1c8m s PHE 185 Cb 0.16 -1.82 -0.12 0.00 0.00 0.00 0.00 43.02 41.24 1c8m s PHE 185 CO 0.56 0.17 1.74 -2.30 -0.00 0.00 0.00 175.22 175.39 1c8m n PRO 186 N -1.57 2.57 -3.86 0.24 -0.02 -1.25 -4.87 135.00 126.25 1c8m n PRO 186 Ca -0.04 0.93 -0.08 0.00 -2.02 0.00 0.00 63.50 62.29 1c8m n PRO 186 Cb 0.58 -2.77 -0.01 0.00 -0.02 0.00 0.00 33.50 31.27 1c8m n PRO 186 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 1c8m s HIS 187 N 1.83 0.03 0.28 6.00 -3.43 -1.26 -1.55 115.29 117.18 1c8m s HIS 187 Ca 0.80 -0.55 -0.16 0.00 -0.80 0.00 0.00 55.06 54.35 1c8m s HIS 187 Cb -0.56 0.68 0.01 0.00 -1.43 0.00 0.00 32.58 31.28 1c8m s HIS 187 CO 0.37 -1.34 0.59 -0.65 -2.00 0.00 0.00 174.74 171.71 1c8m s GLN 188 N -3.28 1.72 0.08 -0.38 -0.21 -0.52 -4.93 119.66 112.14 1c8m s GLN 188 Ca 0.15 -1.20 0.08 0.00 0.02 0.00 0.00 55.36 54.40 1c8m s GLN 188 Cb -0.05 0.53 -0.03 0.00 1.00 0.00 0.00 33.01 34.46 1c8m s GLN 188 CO 0.09 -0.75 -0.20 -0.06 -2.12 0.00 0.00 175.29 172.25 1c8m s PHE 189 N -3.78 1.74 -0.43 0.91 0.08 -1.26 -0.83 117.98 114.40 1c8m s PHE 189 Ca 0.18 -0.41 -0.02 0.00 0.12 0.00 0.00 56.93 56.80 1c8m s PHE 189 Cb -0.03 -0.98 0.12 0.00 -0.57 0.00 0.00 43.02 41.56 1c8m s PHE 189 CO 0.09 0.16 0.22 0.42 -0.10 0.00 0.00 175.22 176.02 1c8m s ILE 190 N -1.07 3.21 -0.41 0.64 1.01 0.22 -4.87 121.20 119.94 1c8m s ILE 190 Ca 0.06 -2.26 -0.16 0.00 0.00 0.00 0.00 60.65 58.29 1c8m s ILE 190 Cb -0.10 -3.20 0.02 0.00 0.01 0.00 0.00 42.46 39.19 1c8m s ILE 190 CO 0.03 -0.71 0.39 0.21 0.00 0.00 0.00 174.94 174.86 1c8m s ASN 191 N 1.50 6.17 0.51 3.58 2.47 -1.26 -1.01 114.94 126.89 1c8m s ASN 191 Ca 0.10 -0.70 0.34 0.00 0.42 0.00 0.00 52.86 53.02 1c8m s ASN 191 Cb -0.22 -2.20 1.47 0.00 -1.45 0.00 0.00 41.25 38.85 1c8m s ASN 191 CO -0.04 -0.52 1.76 -0.07 -3.72 0.00 0.00 177.10 174.51 1c8m h LEU 192 N 8.90 0.11 -0.64 3.21 3.38 -1.38 0.23 115.31 129.12 1c8m h LEU 192 Ca -0.27 0.03 0.00 0.00 0.09 0.00 0.00 57.88 57.73 1c8m h LEU 192 Cb 1.12 0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.88 1c8m h LEU 192 CO 0.76 0.00 0.00 0.08 0.09 0.00 0.00 178.44 179.38 1c8m h ARG 193 N 0.09 0.00 0.00 1.13 0.11 -1.83 -3.39 114.38 110.49 1c8m h ARG 193 Ca 0.63 0.00 -0.13 0.00 0.10 0.00 0.00 59.98 60.58 1c8m h ARG 193 Cb 2.29 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 33.35 1c8m h ARG 193 CO -0.10 0.00 -1.22 0.43 0.10 0.00 0.00 179.97 179.18 1c8m n SER 194 N -2.78 1.48 -4.34 0.08 7.64 0.74 -5.10 113.62 111.34 1c8m n SER 194 Ca 0.03 0.24 -0.17 0.00 1.01 0.00 0.00 58.87 59.98 1c8m n SER 194 Cb 0.38 -0.57 -0.10 0.00 -1.01 0.00 0.00 64.21 62.91 1c8m n SER 194 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1c8m s ASN 195 N -6.23 1.81 -0.08 6.43 4.22 -0.75 -4.79 114.94 115.56 1c8m s ASN 195 Ca -0.21 -1.25 0.11 0.00 -2.14 0.00 0.00 52.86 49.37 1c8m s ASN 195 Cb 0.06 0.02 0.17 0.00 1.28 0.00 0.00 41.25 42.78 1c8m s ASN 195 CO 0.29 -0.54 1.07 -0.46 -2.04 0.00 0.00 177.10 175.42 1c8m n ASN 196 N -0.45 1.62 -3.48 3.54 0.23 -0.31 -4.20 115.26 112.21 1c8m n ASN 196 Ca -0.04 -2.61 -0.10 0.00 -0.53 0.00 0.00 54.58 51.30 1c8m n ASN 196 Cb 0.64 -0.31 -0.02 0.00 -2.08 0.00 0.00 39.78 38.01 1c8m n ASN 196 CO 0.00 0.00 0.00 -0.94 -0.93 0.00 0.00 177.26 175.39 1c8m s SER 197 N -2.09 -0.42 0.02 0.53 1.04 -1.25 -0.96 113.70 110.56 1c8m s SER 197 Ca 0.19 0.02 0.03 0.00 0.48 0.00 0.00 55.95 56.68 1c8m s SER 197 Cb 0.17 0.44 -0.01 0.00 0.10 0.00 0.00 66.02 66.72 1c8m s SER 197 CO 0.02 -0.70 -0.10 0.00 0.98 0.00 0.00 173.24 173.43 1c8m s ALA 198 N -3.20 0.85 -0.10 5.32 0.00 -0.21 -4.46 121.76 119.97 1c8m s ALA 198 Ca 0.03 -0.58 -0.01 0.00 0.00 0.00 0.00 51.96 51.40 1c8m s ALA 198 Cb -0.01 -0.15 0.03 0.00 0.00 0.00 0.00 23.12 22.99 1c8m s ALA 198 CO -0.09 0.16 -0.05 0.99 0.00 0.00 0.00 175.76 176.77 1c8m s THR 199 N -0.60 0.77 -0.06 0.00 2.01 -1.26 -1.22 115.64 115.29 1c8m s THR 199 Ca 0.01 -0.13 0.04 0.00 0.31 0.00 0.00 61.69 61.92 1c8m s THR 199 Cb -0.06 -0.85 -0.00 0.00 0.01 0.00 0.00 72.50 71.60 1c8m s THR 199 CO 0.00 0.33 -0.19 -0.76 -0.69 0.00 0.00 174.62 173.31 1c8m s LEU 200 N 1.81 1.92 -0.23 4.42 1.02 -0.24 -1.39 118.68 125.98 1c8m s LEU 200 Ca 0.05 -0.40 0.00 0.00 0.02 0.00 0.00 54.13 53.80 1c8m s LEU 200 Cb -0.12 -1.08 0.03 0.00 0.02 0.00 0.00 46.19 45.04 1c8m s LEU 200 CO -0.07 0.14 -0.12 -0.63 0.02 0.00 0.00 176.35 175.70 1c8m s ILE 201 N 0.18 2.44 0.01 -0.59 1.01 0.94 -0.03 121.20 125.16 1c8m s ILE 201 Ca -0.09 -1.17 0.07 0.00 0.00 0.00 0.00 60.65 59.46 1c8m s ILE 201 Cb -0.14 -2.23 -0.03 0.00 0.01 0.00 0.00 42.46 40.07 1c8m s ILE 201 CO 0.04 0.24 -0.19 0.68 0.00 0.00 0.00 174.94 175.71 1c8m s VAL 202 N 1.25 2.69 0.87 2.92 -7.23 -0.15 -0.30 120.40 120.44 1c8m s VAL 202 Ca -0.01 -1.08 -0.10 0.00 -1.81 0.00 0.00 61.98 58.98 1c8m s VAL 202 Cb -0.16 -2.08 0.18 0.00 0.56 0.00 0.00 36.38 34.87 1c8m s VAL 202 CO -0.07 0.44 1.20 -2.16 -0.31 0.00 0.00 175.10 174.19 1c8m s PRO 203 N -1.13 0.99 -0.09 4.82 0.04 -1.26 -1.42 135.00 136.95 1c8m s PRO 203 Ca 0.13 -0.74 -0.30 0.00 0.04 0.00 0.00 61.00 60.13 1c8m s PRO 203 Cb -0.10 -2.04 -0.01 0.00 0.04 0.00 0.00 34.50 32.38 1c8m s PRO 203 CO 0.03 -2.07 1.02 -0.47 0.04 0.00 0.00 177.00 175.55 1c8m s TYR 204 N -3.60 3.51 -0.15 0.56 5.04 -1.26 -4.76 117.35 116.68 1c8m s TYR 204 Ca 0.72 1.58 0.01 0.00 -2.44 0.00 0.00 57.07 56.93 1c8m s TYR 204 Cb -0.04 -3.20 0.02 0.00 0.35 0.00 0.00 41.96 39.09 1c8m s TYR 204 CO 0.50 -0.28 -0.16 0.08 -1.34 0.00 0.00 175.55 174.35 1c8m s VAL 205 N 1.93 1.68 -0.10 3.14 1.01 -1.26 -5.07 120.40 121.73 1c8m s VAL 205 Ca 0.49 -0.71 -0.32 0.00 0.00 0.00 0.00 61.98 61.44 1c8m s VAL 205 Cb -0.19 -1.55 0.12 0.00 0.00 0.00 0.00 36.38 34.76 1c8m s VAL 205 CO 0.19 0.48 1.12 0.21 0.00 0.00 0.00 175.10 177.10 1c8m s ASN 206 N 1.37 -0.19 0.00 3.32 2.47 -1.26 -4.96 114.94 115.69 1c8m s ASN 206 Ca 0.03 -0.04 0.26 0.00 0.42 0.00 0.00 52.86 53.53 1c8m s ASN 206 Cb -0.13 0.23 1.07 0.00 -1.45 0.00 0.00 41.25 40.96 1c8m s ASN 206 CO -0.10 -0.38 1.75 0.00 -3.72 0.00 0.00 177.10 174.65 1c8m n ALA 207 N -0.21 2.57 -2.67 1.71 0.00 -1.26 -4.81 120.51 115.85 1c8m n ALA 207 Ca -0.03 -0.43 -0.16 0.00 0.00 0.00 0.00 53.44 52.81 1c8m n ALA 207 Cb 0.60 -1.19 -0.12 0.00 0.00 0.00 0.00 19.45 18.75 1c8m n ALA 207 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1c8m s VAL 208 N -1.95 0.98 0.28 0.00 -7.23 -1.26 -5.07 120.40 106.15 1c8m s VAL 208 Ca 0.37 -1.37 0.29 0.00 -1.81 0.00 0.00 61.98 59.46 1c8m s VAL 208 Cb 0.20 -1.08 0.31 0.00 0.56 0.00 0.00 36.38 36.36 1c8m s VAL 208 CO 0.32 -0.34 2.00 1.55 -0.31 0.00 0.00 175.10 178.31 1c8m h PRO 209 N 4.11 0.00 -3.64 4.82 0.13 -1.87 -3.45 132.00 132.09 1c8m h PRO 209 Ca -0.39 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.67 1c8m h PRO 209 Cb 1.19 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 32.19 1c8m h PRO 209 CO 0.44 0.12 -0.22 -1.64 -0.23 0.00 0.00 178.00 176.47 1c8m s MET 210 N -3.91 1.04 0.29 0.86 -1.94 -1.26 -4.90 119.30 109.49 1c8m s MET 210 Ca -0.01 -0.92 -0.17 0.00 -1.71 0.00 0.00 55.69 52.88 1c8m s MET 210 Cb 0.11 0.41 0.02 0.00 2.01 0.00 0.00 34.83 37.38 1c8m s MET 210 CO 0.58 -0.38 0.66 0.34 -0.01 0.00 0.00 175.02 176.21 1c8m s ASP 211 N -2.87 -0.13 -0.02 3.03 -1.08 -0.89 -4.91 116.67 109.80 1c8m s ASP 211 Ca 0.07 -0.81 -0.30 0.00 -0.52 0.00 0.00 52.55 51.00 1c8m s ASP 211 Cb 0.03 0.71 -0.06 0.00 -1.46 0.00 0.00 42.92 42.14 1c8m s ASP 211 CO -0.08 -1.35 1.55 -0.55 0.52 0.00 0.00 175.17 175.26 1c8m s SER 212 N -2.98 6.73 0.34 -0.34 0.15 -1.26 -0.83 113.70 115.51 1c8m s SER 212 Ca 0.15 2.20 0.26 0.00 0.70 0.00 0.00 55.95 59.27 1c8m s SER 212 Cb -0.04 -2.55 0.85 0.00 -1.71 0.00 0.00 66.02 62.57 1c8m s SER 212 CO 0.09 -0.84 1.76 -0.03 1.20 0.00 0.00 173.24 175.42 1c8m h MET 213 N 8.69 0.00 0.07 5.44 4.05 -1.82 -2.70 114.93 128.66 1c8m h MET 213 Ca -0.38 0.00 -0.35 0.00 -0.28 0.00 0.00 59.70 58.69 1c8m h MET 213 Cb 1.18 0.00 -0.03 0.00 -0.80 0.00 0.00 31.60 31.94 1c8m h MET 213 CO 0.94 0.00 -1.98 0.28 0.23 0.00 0.00 176.91 176.37 1c8m n VAL 214 N -2.60 1.69 0.14 -5.77 0.31 -1.26 -4.48 118.33 106.36 1c8m n VAL 214 Ca 0.03 -0.70 0.11 0.00 -0.01 0.00 0.00 64.34 63.78 1c8m n VAL 214 Cb 0.38 -1.45 -0.08 0.00 -0.91 0.00 0.00 33.84 31.78 1c8m n VAL 214 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1c8m n ARG 215 N -3.31 0.57 -4.47 5.55 5.12 -1.24 -4.92 116.66 113.97 1c8m n ARG 215 Ca -0.29 -0.05 -0.29 0.00 -1.93 0.00 0.00 57.85 55.29 1c8m n ARG 215 Cb 1.05 -1.64 -0.17 0.00 -1.16 0.00 0.00 32.46 30.54 1c8m n ARG 215 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 1c8m s HIS 216 N -3.40 2.05 -0.27 -1.55 2.46 -1.02 -5.09 115.29 108.48 1c8m s HIS 216 Ca -0.03 -0.98 -0.09 0.00 0.47 0.00 0.00 55.06 54.43 1c8m s HIS 216 Cb 0.12 -1.47 -0.03 0.00 -0.13 0.00 0.00 32.58 31.08 1c8m s HIS 216 CO 0.85 -0.50 0.11 -0.80 -2.47 0.00 0.00 174.74 171.94 1c8m s ASN 217 N 0.98 5.42 -0.04 9.88 0.01 -1.26 -4.61 114.94 125.32 1c8m s ASN 217 Ca -0.06 -0.23 -0.23 0.00 -0.71 0.00 0.00 52.86 51.63 1c8m s ASN 217 Cb -0.15 -1.98 -0.24 0.00 0.41 0.00 0.00 41.25 39.29 1c8m s ASN 217 CO -0.02 -0.07 1.04 0.78 -1.51 0.00 0.00 177.10 177.32 1c8m h ASN 218 N 8.29 0.33 -3.02 -1.22 2.35 -1.56 -3.42 115.58 117.34 1c8m h ASN 218 Ca -0.36 -0.79 -0.62 0.00 -0.55 0.00 0.00 56.30 53.98 1c8m h ASN 218 Cb 1.17 -0.10 -0.17 0.00 0.05 0.00 0.00 38.32 39.27 1c8m h ASN 218 CO 0.58 1.07 -0.80 0.26 -1.65 0.00 0.00 177.43 176.89 1c8m s TRP 219 N -3.09 2.21 -0.05 1.19 0.52 -1.17 -1.22 118.94 117.34 1c8m s TRP 219 Ca -0.15 -0.38 0.03 0.00 0.02 0.00 0.00 56.10 55.62 1c8m s TRP 219 Cb 0.02 -1.06 0.01 0.00 -1.15 0.00 0.00 33.47 31.29 1c8m s TRP 219 CO 0.77 0.52 -0.11 -1.12 0.02 0.00 0.00 176.95 177.03 1c8m s SER 220 N -2.88 1.60 -0.28 2.95 0.01 -0.22 -0.48 113.70 114.40 1c8m s SER 220 Ca 0.22 -0.26 -0.13 0.00 1.31 0.00 0.00 55.95 57.10 1c8m s SER 220 Cb -0.07 -0.60 -0.04 0.00 0.21 0.00 0.00 66.02 65.52 1c8m s SER 220 CO 0.10 0.06 0.26 -0.22 0.41 0.00 0.00 173.24 173.86 1c8m s LEU 221 N 0.43 4.05 -0.12 2.44 2.96 0.76 -0.99 118.68 128.22 1c8m s LEU 221 Ca -0.09 0.09 0.03 0.00 -0.22 0.00 0.00 54.13 53.94 1c8m s LEU 221 Cb -0.13 -2.24 0.00 0.00 0.50 0.00 0.00 46.19 44.32 1c8m s LEU 221 CO 0.02 -0.11 -0.22 -0.69 -1.32 0.00 0.00 176.35 174.03 1c8m s VAL 222 N 1.88 2.22 -0.22 1.68 1.01 0.04 -1.00 120.40 126.00 1c8m s VAL 222 Ca 0.10 -0.95 0.01 0.00 0.00 0.00 0.00 61.98 61.14 1c8m s VAL 222 Cb -0.16 -1.87 0.05 0.00 0.00 0.00 0.00 36.38 34.40 1c8m s VAL 222 CO 0.11 0.55 -0.08 -0.63 0.00 0.00 0.00 175.10 175.04 1c8m s ILE 223 N 0.50 1.67 -0.12 2.22 1.01 -0.37 -0.65 121.20 125.47 1c8m s ILE 223 Ca -0.14 -1.20 0.03 0.00 0.00 0.00 0.00 60.65 59.35 1c8m s ILE 223 Cb -0.17 -1.84 0.00 0.00 0.01 0.00 0.00 42.46 40.47 1c8m s ILE 223 CO 0.05 0.02 -0.23 -0.63 0.00 0.00 0.00 174.94 174.16 1c8m s ILE 224 N 1.35 2.09 -0.69 2.92 -1.09 -0.72 -1.20 121.20 123.86 1c8m s ILE 224 Ca -0.04 -0.99 -0.27 0.00 -2.23 0.00 0.00 60.65 57.12 1c8m s ILE 224 Cb -0.18 -1.81 0.03 0.00 -1.58 0.00 0.00 42.46 38.92 1c8m s ILE 224 CO -0.07 0.55 1.21 -2.16 -1.23 0.00 0.00 174.94 173.25 1c8m s PRO 225 N 0.55 3.26 0.37 2.79 0.04 -1.26 -0.77 135.00 139.98 1c8m s PRO 225 Ca -0.13 -0.19 0.20 0.00 0.04 0.00 0.00 61.00 60.91 1c8m s PRO 225 Cb -0.17 -4.14 0.53 0.00 0.04 0.00 0.00 34.50 30.76 1c8m s PRO 225 CO 0.04 -1.98 1.66 -0.39 0.04 0.00 0.00 177.00 176.37 1c8m h VAL 226 N 6.05 0.70 -3.24 -0.36 -1.51 -1.53 -3.42 116.25 112.96 1c8m h VAL 226 Ca -0.27 -1.60 -0.55 0.00 -1.23 0.00 0.00 66.70 63.05 1c8m h VAL 226 Cb 1.05 2.05 -0.37 0.00 -2.13 0.00 0.00 31.29 31.90 1c8m h VAL 226 CO 1.24 0.34 -0.80 0.00 -1.23 0.00 0.00 177.57 177.11 1c8m n GLN 228 N 4.88 1.59 -2.32 0.00 7.27 -1.26 -1.20 117.38 126.33 1c8m n GLN 228 Ca -0.13 0.56 -0.43 0.00 0.07 0.00 0.00 57.00 57.07 1c8m n GLN 228 Cb 0.49 -1.99 -0.02 0.00 2.41 0.00 0.00 30.24 31.12 1c8m n GLN 228 CO 0.00 0.00 0.00 -1.17 0.07 0.00 0.00 177.06 175.96 1c8m s LEU 229 N 0.00 4.16 0.04 1.69 2.96 -1.26 -4.16 118.68 122.11 1c8m s LEU 229 Ca 0.58 1.75 0.03 0.00 -0.22 0.00 0.00 54.13 56.26 1c8m s LEU 229 Cb -0.66 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 42.47 1c8m s LEU 229 CO 0.61 -0.86 -0.09 -1.10 -1.32 0.00 0.00 176.35 173.58 1c8m s GLN 230 N 3.75 0.63 0.14 1.98 -0.21 -0.25 -4.33 119.66 121.37 1c8m s GLN 230 Ca 0.60 -0.66 -0.24 0.00 0.02 0.00 0.00 55.36 55.07 1c8m s GLN 230 Cb -0.24 -0.51 0.08 0.00 1.00 0.00 0.00 33.01 33.34 1c8m s GLN 230 CO 0.19 0.12 1.06 -1.54 -2.12 0.00 0.00 175.29 173.00 1c8m s SER 231 N -1.21 -0.05 -0.25 5.90 1.04 -1.26 -1.12 113.70 116.76 1c8m s SER 231 Ca -0.04 -0.52 0.13 0.00 0.48 0.00 0.00 55.95 55.99 1c8m s SER 231 Cb -0.08 0.44 0.56 0.00 0.10 0.00 0.00 66.02 67.04 1c8m s SER 231 CO 0.01 -0.85 1.52 0.59 0.98 0.00 0.00 173.24 175.49 1c8m n ASN 232 N -0.95 3.57 -3.09 7.02 5.03 -1.26 -4.51 115.26 121.06 1c8m n ASN 232 Ca -0.04 -3.33 -0.16 0.00 0.87 0.00 0.00 54.58 51.93 1c8m n ASN 232 Cb 0.60 -0.62 -0.00 0.00 -1.02 0.00 0.00 39.78 38.74 1c8m n ASN 232 CO 0.00 0.00 0.00 -3.20 -1.83 0.00 0.00 177.26 172.23 1c8m n ASN 233 N -0.69 0.15 0.31 6.41 5.15 -1.26 -5.00 115.26 120.33 1c8m n ASN 233 Ca 0.30 -3.16 0.19 0.00 -0.60 0.00 0.00 54.58 51.32 1c8m n ASN 233 Cb 1.05 -0.07 0.96 0.00 -0.53 0.00 0.00 39.78 41.18 1c8m n ASN 233 CO 0.00 0.00 0.00 0.16 1.40 0.00 0.00 177.26 178.82 1c8m h ILE 234 N 1.43 0.08 0.00 -1.44 3.07 -2.00 -2.78 117.51 115.87 1c8m h ILE 234 Ca 0.06 -0.26 0.00 0.00 1.55 0.00 0.00 64.86 66.20 1c8m h ILE 234 Cb 1.00 1.24 0.00 0.00 -0.27 0.00 0.00 36.82 38.79 1c8m h ILE 234 CO 0.42 0.01 0.00 0.77 -1.05 0.00 0.00 178.15 178.31 1c8m h SER 235 N 0.00 0.00 -3.35 2.16 4.64 -1.98 -3.41 113.55 111.61 1c8m h SER 235 Ca -0.00 0.00 -0.57 0.00 -0.47 0.00 0.00 61.79 60.75 1c8m h SER 235 Cb 0.24 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.27 1c8m h SER 235 CO 0.00 0.00 0.90 0.21 -0.87 0.00 0.00 176.83 177.07 1c8m s ASN 236 N -5.26 6.79 0.19 4.97 3.04 -1.05 -4.98 114.94 118.64 1c8m s ASN 236 Ca 0.01 0.97 -0.30 0.00 0.04 0.00 0.00 52.86 53.58 1c8m s ASN 236 Cb 0.09 -2.54 -0.08 0.00 -1.54 0.00 0.00 41.25 37.18 1c8m s ASN 236 CO 0.49 -1.02 1.28 -0.63 -3.04 0.00 0.00 177.10 174.17 1c8m s ILE 237 N 4.04 3.34 -0.43 -5.21 1.01 -1.26 -5.00 121.20 117.68 1c8m s ILE 237 Ca 0.49 1.10 -0.02 0.00 0.00 0.00 0.00 60.65 62.21 1c8m s ILE 237 Cb -0.12 -3.70 0.12 0.00 0.01 0.00 0.00 42.46 38.76 1c8m s ILE 237 CO 0.21 0.16 0.23 -0.69 0.00 0.00 0.00 174.94 174.85 1c8m s VAL 238 N 0.14 3.28 0.73 2.92 1.01 -1.26 -5.07 120.40 122.15 1c8m s VAL 238 Ca 0.56 -2.21 -0.09 0.00 0.00 0.00 0.00 61.98 60.24 1c8m s VAL 238 Cb -0.35 -3.24 0.06 0.00 0.00 0.00 0.00 36.38 32.85 1c8m s VAL 238 CO 0.37 -0.71 1.08 -2.84 0.00 0.00 0.00 175.10 172.99 1c8m s PRO 239 N 0.95 2.25 -0.07 2.72 0.02 -1.26 -1.33 135.00 138.27 1c8m s PRO 239 Ca 0.10 -0.01 0.01 0.00 0.02 0.00 0.00 61.00 61.12 1c8m s PRO 239 Cb -0.22 -2.08 0.02 0.00 0.02 0.00 0.00 34.50 32.24 1c8m s PRO 239 CO -0.04 -1.30 -0.09 0.42 -0.33 0.00 0.00 177.00 175.66 1c8m s ILE 240 N -3.36 0.93 -0.02 2.83 1.01 0.10 -4.48 121.20 118.20 1c8m s ILE 240 Ca 0.60 -0.32 0.06 0.00 0.00 0.00 0.00 60.65 61.00 1c8m s ILE 240 Cb -0.11 -0.91 -0.01 0.00 0.01 0.00 0.00 42.46 41.44 1c8m s ILE 240 CO 0.47 0.32 -0.22 -0.89 0.00 0.00 0.00 174.94 174.63 1c8m s THR 241 N 1.08 1.72 -0.11 2.92 2.01 -0.09 -0.99 115.64 122.18 1c8m s THR 241 Ca -0.07 -0.92 0.03 0.00 0.31 0.00 0.00 61.69 61.03 1c8m s THR 241 Cb -0.14 -1.44 -0.00 0.00 0.01 0.00 0.00 72.50 70.92 1c8m s THR 241 CO -0.01 0.49 -0.21 -0.69 -0.69 0.00 0.00 174.62 173.51 1c8m s VAL 242 N -0.43 2.32 -0.12 3.82 1.01 -1.26 0.29 120.40 126.03 1c8m s VAL 242 Ca 0.06 -0.93 0.02 0.00 0.00 0.00 0.00 61.98 61.13 1c8m s VAL 242 Cb -0.09 -1.91 0.02 0.00 0.00 0.00 0.00 36.38 34.39 1c8m s VAL 242 CO -0.00 0.55 -0.16 -0.44 0.00 0.00 0.00 175.10 175.05 1c8m s SER 243 N 0.31 2.64 -0.07 3.32 0.01 -0.53 -1.08 113.70 118.31 1c8m s SER 243 Ca -0.16 -0.48 0.06 0.00 1.31 0.00 0.00 55.95 56.68 1c8m s SER 243 Cb -0.17 -1.19 -0.01 0.00 0.21 0.00 0.00 66.02 64.86 1c8m s SER 243 CO 0.08 0.01 -0.25 -0.63 0.41 0.00 0.00 173.24 172.86 1c8m s ILE 244 N 1.07 2.06 -0.16 1.44 1.01 -0.07 -0.95 121.20 125.60 1c8m s ILE 244 Ca -0.04 -1.06 0.01 0.00 0.00 0.00 0.00 60.65 59.56 1c8m s ILE 244 Cb -0.14 -1.75 0.02 0.00 0.01 0.00 0.00 42.46 40.60 1c8m s ILE 244 CO -0.04 0.57 -0.16 -0.55 0.00 0.00 0.00 174.94 174.76 1c8m s SER 245 N -0.08 2.92 0.79 3.58 0.15 -0.05 -0.16 113.70 120.85 1c8m s SER 245 Ca -0.06 -0.59 -0.12 0.00 0.70 0.00 0.00 55.95 55.88 1c8m s SER 245 Cb -0.14 -1.29 0.07 0.00 -1.71 0.00 0.00 66.02 62.95 1c8m s SER 245 CO 0.05 -0.05 1.13 -2.84 1.20 0.00 0.00 173.24 172.73 1c8m s PRO 246 N 1.41 1.94 -0.03 5.44 0.02 -1.25 -0.69 135.00 141.84 1c8m s PRO 246 Ca 0.04 1.41 -0.01 0.00 0.02 0.00 0.00 61.00 62.47 1c8m s PRO 246 Cb -0.13 -1.84 0.03 0.00 0.02 0.00 0.00 34.50 32.57 1c8m s PRO 246 CO -0.11 -1.91 0.05 -1.64 -0.33 0.00 0.00 177.00 173.05 1c8m s MET 247 N -4.55 -0.01 -1.45 5.54 -1.94 0.05 -4.12 119.30 112.81 1c8m s MET 247 Ca 0.66 0.20 -0.09 0.00 -1.71 0.00 0.00 55.69 54.75 1c8m s MET 247 Cb -0.21 -0.21 0.03 0.00 2.01 0.00 0.00 34.83 36.45 1c8m s MET 247 CO 0.53 -0.15 0.93 0.00 -0.01 0.00 0.00 175.02 176.32 1c8m s ALA 249 N -3.24 3.58 -0.05 0.00 0.00 -1.26 -4.55 121.76 116.24 1c8m s ALA 249 Ca 0.52 1.17 -0.07 0.00 0.00 0.00 0.00 51.96 53.58 1c8m s ALA 249 Cb -0.24 -3.52 0.01 0.00 0.00 0.00 0.00 23.12 19.37 1c8m s ALA 249 CO 0.64 -0.62 0.17 -1.83 0.00 0.00 0.00 175.76 174.13 1c8m s GLU 250 N 0.34 0.29 0.18 0.00 -1.05 -0.49 -4.27 118.70 113.70 1c8m s GLU 250 Ca 0.61 0.08 0.07 0.00 -0.15 0.00 0.00 54.97 55.58 1c8m s GLU 250 Cb -0.38 0.13 -0.04 0.00 -0.44 0.00 0.00 34.13 33.40 1c8m s GLU 250 CO 0.36 -0.05 -0.15 -0.06 0.95 0.00 0.00 175.26 176.31 1c8m s PHE 251 N -0.30 1.66 0.03 4.83 0.08 -0.58 -1.10 117.98 122.61 1c8m s PHE 251 Ca -0.04 -0.56 -0.17 0.00 0.12 0.00 0.00 56.93 56.28 1c8m s PHE 251 Cb -0.03 -0.80 0.03 0.00 -0.57 0.00 0.00 43.02 41.65 1c8m s PHE 251 CO 0.01 0.31 0.39 0.45 -0.10 0.00 0.00 175.22 176.27 1c8m s SER 252 N -3.03 -0.25 -0.21 1.36 0.15 -0.25 -0.93 113.70 110.52 1c8m s SER 252 Ca 0.19 0.01 -0.01 0.00 0.70 0.00 0.00 55.95 56.83 1c8m s SER 252 Cb -0.02 0.40 -0.01 0.00 -1.71 0.00 0.00 66.02 64.67 1c8m s SER 252 CO 0.06 -0.62 0.19 0.61 1.20 0.00 0.00 173.24 174.68 1c8m n GLY 253 N 0.65 0.35 3.79 9.45 0.00 -1.26 -1.63 105.19 116.54 1c8m n GLY 253 Ca -0.19 -0.09 -0.34 0.00 0.00 0.00 0.00 46.02 45.40 1c8m n GLY 253 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c8m s ALA 254 N -3.07 2.76 0.00 4.61 0.00 -1.26 -1.58 121.76 123.21 1c8m s ALA 254 Ca 0.08 0.68 0.00 0.00 0.00 0.00 0.00 51.96 52.73 1c8m s ALA 254 Cb -0.01 -3.30 0.00 0.00 0.00 0.00 0.00 23.12 19.81 1c8m s ALA 254 CO 0.16 -0.61 0.00 2.89 0.00 0.00 0.00 175.76 178.19 1c8m n ARG 255 N -1.29 0.00 -1.31 0.00 1.85 -0.12 -4.96 116.66 110.84 1c8m n ARG 255 Ca 0.10 0.00 -0.29 0.00 -1.00 0.00 0.00 57.85 56.66 1c8m n ARG 255 Cb 0.52 0.00 0.15 0.00 -1.05 0.00 0.00 32.46 32.07 1c8m n ARG 255 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1c8m s ALA 256 N -1.00 1.45 -0.09 2.89 0.00 -1.26 -4.79 121.76 118.97 1c8m s ALA 256 Ca 0.00 -0.31 -0.29 0.00 0.00 0.00 0.00 51.96 51.37 1c8m s ALA 256 Cb 0.00 -3.11 -0.02 0.00 0.00 0.00 0.00 23.12 19.99 1c8m s ALA 256 CO 0.00 -2.45 0.95 0.21 0.00 0.00 0.00 175.76 174.47 1c8m s LYS 257 N -5.06 4.44 0.16 0.00 2.20 -1.26 -4.53 119.74 115.69 1c8m s LYS 257 Ca 0.64 1.31 -0.30 0.00 -0.36 0.00 0.00 55.97 57.25 1c8m s LYS 257 Cb -0.17 -3.52 -0.08 0.00 -1.51 0.00 0.00 37.83 32.55 1c8m s LYS 257 CO 0.56 -0.22 1.33 0.99 -0.36 0.00 0.00 175.35 177.65 1c8m s THR 258 N 1.70 3.28 -0.20 3.43 2.01 -0.46 -4.98 115.64 120.42 1c8m s THR 258 Ca 0.47 1.00 -0.03 0.00 0.31 0.00 0.00 61.69 63.43 1c8m s THR 258 Cb -0.19 -3.64 -0.01 0.00 0.01 0.00 0.00 72.50 68.68 1c8m s THR 258 CO 0.20 0.12 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.50 1c8m s VAL 259 N 0.50 3.36 0.04 3.82 1.01 -1.26 -4.94 120.40 122.93 1c8m s VAL 259 Ca 0.59 -0.51 -0.03 0.00 0.00 0.00 0.00 61.98 62.04 1c8m s VAL 259 Cb -0.36 -2.51 -0.04 0.00 0.00 0.00 0.00 36.38 33.46 1c8m s VAL 259 CO 0.35 0.44 0.24 -0.69 0.00 0.00 0.00 175.10 175.45 1c8m s VAL 260 N 1.24 5.35 0.00 2.92 1.01 -1.26 -5.28 120.40 124.38 1c8m s VAL 260 Ca 0.03 -0.11 0.00 0.00 0.00 0.00 0.00 61.98 61.90 1c8m s VAL 260 Cb -0.14 -3.59 0.00 0.00 0.00 0.00 0.00 36.38 32.65 1c8m s VAL 260 CO -0.02 0.24 0.00 0.00 0.00 0.00 0.00 175.10 175.32