#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2grk n PHE 9 N 0.00 0.19 -2.24 7.33 3.72 -1.26 -2.70 117.46 122.50 2grk n PHE 9 Ca 0.00 -3.58 -0.41 0.00 -0.05 0.00 0.00 57.45 53.41 2grk n PHE 9 Cb 0.00 0.02 -0.03 0.00 -0.94 0.00 0.00 39.48 38.53 2grk n PHE 9 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2grk s ALA 10 N -0.38 2.68 -1.83 4.37 0.00 -1.26 -4.83 121.76 120.51 2grk s ALA 10 Ca 0.31 -0.47 0.00 0.00 0.00 0.00 0.00 51.96 51.80 2grk s ALA 10 Cb 0.02 -4.12 0.00 0.00 0.00 0.00 0.00 23.12 19.02 2grk s ALA 10 CO -0.19 -3.07 0.28 -1.13 0.00 0.00 0.00 175.76 171.65 2grk n SER 11 N 10.40 0.05 -3.82 0.00 3.41 -1.26 -4.68 113.62 117.72 2grk n SER 11 Ca 0.16 -0.61 -0.11 0.00 -0.26 0.00 0.00 58.87 58.05 2grk n SER 11 Cb 0.49 -0.03 -0.06 0.00 -0.26 0.00 0.00 64.21 64.36 2grk n SER 11 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2grk s SER 12 N -1.53 0.20 -0.81 4.04 1.04 -1.26 -4.60 113.70 110.78 2grk s SER 12 Ca 0.00 -1.15 -0.16 0.00 0.48 0.00 0.00 55.95 55.12 2grk s SER 12 Cb 0.00 0.58 0.17 0.00 0.10 0.00 0.00 66.02 66.87 2grk s SER 12 CO 0.00 -1.15 0.85 0.00 0.98 0.00 0.00 173.24 173.93 2grk s THR 14 N 1.38 4.21 0.05 0.00 -4.23 -1.26 -5.08 115.64 110.71 2grk s THR 14 Ca 0.21 -0.42 -0.31 0.00 -1.18 0.00 0.00 61.69 59.99 2grk s THR 14 Cb -0.12 -2.82 -0.06 0.00 1.34 0.00 0.00 72.50 70.84 2grk s THR 14 CO -0.06 0.50 1.34 -0.70 -0.54 0.00 0.00 174.62 175.16 2grk s GLU 15 N -1.20 4.33 -0.15 3.99 2.56 -1.26 -5.00 118.70 121.97 2grk s GLU 15 Ca 0.16 1.94 -0.28 0.00 0.00 0.00 0.00 54.97 56.79 2grk s GLU 15 Cb -0.11 -3.42 0.08 0.00 2.00 0.00 0.00 34.13 32.67 2grk s GLU 15 CO 0.06 -0.45 0.75 -2.00 -0.56 0.00 0.00 175.26 173.06 2grk s GLU 16 N 1.69 0.90 0.51 4.30 2.12 -1.26 -5.14 118.70 121.82 2grk s GLU 16 Ca 0.62 0.53 -0.21 0.00 0.36 0.00 0.00 54.97 56.27 2grk s GLU 16 Cb -0.32 0.43 -0.06 0.00 0.26 0.00 0.00 34.13 34.43 2grk s GLU 16 CO 0.28 -0.22 1.16 -1.83 -0.54 0.00 0.00 175.26 174.11 2grk s GLU 17 N -0.54 3.51 -0.49 4.30 -1.05 -1.26 -3.61 118.70 119.56 2grk s GLU 17 Ca -0.05 1.72 -0.06 0.00 -0.15 0.00 0.00 54.97 56.43 2grk s GLU 17 Cb -0.02 -2.19 0.06 0.00 -0.44 0.00 0.00 34.13 31.54 2grk s GLU 17 CO 0.05 -0.75 0.16 0.27 0.95 0.00 0.00 175.26 175.94 2grk n ASN 18 N -0.93 -0.90 -3.98 0.83 0.23 -1.26 -4.87 115.26 104.37 2grk n ASN 18 Ca 0.10 -0.12 -0.30 0.00 -0.53 0.00 0.00 54.58 53.73 2grk n ASN 18 Cb 0.49 -0.84 -0.16 0.00 -2.08 0.00 0.00 39.78 37.20 2grk n ASN 18 CO 0.00 0.00 0.00 0.21 -0.93 0.00 0.00 177.26 176.54 2grk s ASN 19 N -1.81 3.40 0.02 0.53 3.84 -1.24 -2.73 114.94 116.96 2grk s ASN 19 Ca 0.22 -0.90 0.04 0.00 0.21 0.00 0.00 52.86 52.43 2grk s ASN 19 Cb -0.13 -1.21 -0.02 0.00 -0.55 0.00 0.00 41.25 39.35 2grk s ASN 19 CO 0.27 -0.16 -0.12 -1.00 -2.79 0.00 0.00 177.10 173.30 2grk s HIS 20 N 1.41 1.07 -0.87 0.43 3.76 0.20 -4.74 115.29 116.56 2grk s HIS 20 Ca -0.02 -0.29 -0.15 0.00 -0.15 0.00 0.00 55.06 54.46 2grk s HIS 20 Cb -0.16 -0.66 0.21 0.00 1.11 0.00 0.00 32.58 33.07 2grk s HIS 20 CO -0.08 0.00 0.87 -1.01 -0.85 0.00 0.00 174.74 173.67 2grk s HIS 21 N -0.63 3.68 0.15 1.40 3.76 -1.26 -0.52 115.29 121.86 2grk s HIS 21 Ca 0.02 -1.93 -0.30 0.00 -0.15 0.00 0.00 55.06 52.70 2grk s HIS 21 Cb -0.06 -3.91 -0.07 0.00 1.11 0.00 0.00 32.58 29.64 2grk s HIS 21 CO 0.00 -1.09 1.04 -1.64 -0.85 0.00 0.00 174.74 172.21 2grk s MET 22 N 0.56 4.64 0.19 1.40 -1.94 -1.26 -1.18 119.30 121.71 2grk s MET 22 Ca 0.22 1.61 -0.01 0.00 -1.71 0.00 0.00 55.69 55.79 2grk s MET 22 Cb -0.09 -3.32 -0.04 0.00 2.01 0.00 0.00 34.83 33.39 2grk s MET 22 CO -0.09 0.14 0.12 0.20 -0.01 0.00 0.00 175.02 175.38 2grk s GLY 23 N -0.09 1.37 0.05 -0.03 0.00 -0.57 -4.83 107.32 103.22 2grk s GLY 23 Ca 0.48 -1.66 0.05 0.00 0.00 0.00 0.00 44.72 43.59 2grk s GLY 23 CO 0.33 -1.39 -0.14 -1.50 0.00 0.00 0.00 173.10 170.40 2grk s ILE 24 N -4.14 1.08 -0.07 0.90 2.07 -1.26 -2.22 121.20 117.55 2grk s ILE 24 Ca 0.37 -1.06 -0.00 0.00 -1.41 0.00 0.00 60.65 58.55 2grk s ILE 24 Cb 0.07 -0.99 0.02 0.00 0.13 0.00 0.00 42.46 41.69 2grk s ILE 24 CO 0.10 -0.06 -0.04 -0.62 -1.91 0.00 0.00 174.94 172.42 2grk s ASP 25 N -1.27 1.44 -0.16 4.50 -1.08 0.11 -1.80 116.67 118.41 2grk s ASP 25 Ca 0.00 -0.15 0.01 0.00 -0.52 0.00 0.00 52.55 51.89 2grk s ASP 25 Cb -0.08 -0.53 0.01 0.00 -1.46 0.00 0.00 42.92 40.85 2grk s ASP 25 CO 0.01 -0.11 -0.17 -0.69 0.52 0.00 0.00 175.17 174.73 2grk s VAL 26 N 1.44 2.42 -0.15 1.11 1.01 0.11 -0.63 120.40 125.72 2grk s VAL 26 Ca -0.02 -0.84 0.01 0.00 0.00 0.00 0.00 61.98 61.12 2grk s VAL 26 Cb -0.13 -2.02 0.02 0.00 0.00 0.00 0.00 36.38 34.25 2grk s VAL 26 CO -0.03 0.52 -0.16 -0.63 0.00 0.00 0.00 175.10 174.80 2grk s ILE 27 N 0.99 1.66 -0.04 2.22 1.01 -0.16 -0.42 121.20 126.46 2grk s ILE 27 Ca -0.02 -0.70 0.04 0.00 0.00 0.00 0.00 60.65 59.97 2grk s ILE 27 Cb -0.15 -1.53 -0.00 0.00 0.01 0.00 0.00 42.46 40.79 2grk s ILE 27 CO -0.04 0.47 -0.14 -0.51 0.00 0.00 0.00 174.94 174.72 2grk s ILE 28 N 1.34 1.21 -0.22 2.92 2.07 0.13 -1.15 121.20 127.49 2grk s ILE 28 Ca 0.02 -0.60 0.02 0.00 -1.41 0.00 0.00 60.65 58.68 2grk s ILE 28 Cb -0.13 -1.04 0.05 0.00 0.13 0.00 0.00 42.46 41.46 2grk s ILE 28 CO -0.09 0.35 -0.11 -0.75 -1.91 0.00 0.00 174.94 172.43 2grk s LYS 29 N 0.06 2.16 -0.19 3.50 2.20 0.40 -0.28 119.74 127.59 2grk s LYS 29 Ca -0.03 -1.02 -0.03 0.00 -0.36 0.00 0.00 55.97 54.53 2grk s LYS 29 Cb -0.10 -2.61 -0.01 0.00 -1.51 0.00 0.00 37.83 33.59 2grk s LYS 29 CO 0.01 -0.47 -0.06 0.08 -0.36 0.00 0.00 175.35 174.56 2grk s VAL 30 N 1.29 3.45 -0.33 4.02 1.01 0.21 -0.70 120.40 129.34 2grk s VAL 30 Ca -0.04 -0.49 -0.13 0.00 0.00 0.00 0.00 61.98 61.32 2grk s VAL 30 Cb -0.17 -2.53 -0.02 0.00 0.00 0.00 0.00 36.38 33.65 2grk s VAL 30 CO -0.07 0.46 0.26 -0.89 0.00 0.00 0.00 175.10 174.86 2grk s THR 31 N 0.98 5.26 0.81 3.92 2.01 -0.33 0.53 115.64 128.83 2grk s THR 31 Ca -0.00 -0.07 -0.12 0.00 0.31 0.00 0.00 61.69 61.81 2grk s THR 31 Cb -0.15 -3.71 0.08 0.00 0.01 0.00 0.00 72.50 68.74 2grk s THR 31 CO 0.00 0.02 1.15 -0.54 -0.69 0.00 0.00 174.62 174.57 2grk s LYS 32 N 1.80 1.95 0.69 4.92 1.02 0.38 -0.00 119.74 130.50 2grk s LYS 32 Ca 0.08 0.24 -0.11 0.00 0.02 0.00 0.00 55.97 56.19 2grk s LYS 32 Cb -0.17 -1.94 0.01 0.00 -0.52 0.00 0.00 37.83 35.21 2grk s LYS 32 CO 0.11 -1.63 1.06 -0.65 -0.92 0.00 0.00 175.35 173.32 2grk s GLN 33 N -5.46 2.93 0.03 1.68 -1.52 0.11 -4.43 119.66 113.00 2grk s GLN 33 Ca 0.62 0.99 -0.22 0.00 -1.95 0.00 0.00 55.36 54.80 2grk s GLN 33 Cb -0.12 -1.99 -0.15 0.00 -0.22 0.00 0.00 33.01 30.53 2grk s GLN 33 CO 0.51 -1.11 1.37 -0.44 -0.25 0.00 0.00 175.29 175.36 2grk h ASP 34 N -0.64 0.25 -0.84 5.90 3.32 -1.94 -3.22 116.42 119.25 2grk h ASP 34 Ca -0.44 -0.43 0.10 0.00 0.02 0.00 0.00 57.03 56.28 2grk h ASP 34 Cb 1.21 -0.07 -0.06 0.00 0.22 0.00 0.00 39.33 40.63 2grk h ASP 34 CO 0.56 0.63 0.54 1.56 -1.72 0.00 0.00 179.24 180.82 2grk h GLN 35 N -0.12 0.76 -6.26 3.56 4.20 -1.95 -3.43 115.11 111.87 2grk h GLN 35 Ca 0.02 -0.05 -0.68 0.00 0.06 0.00 0.00 58.65 58.01 2grk h GLN 35 Cb 0.54 -0.17 0.04 0.00 0.30 0.00 0.00 27.48 28.19 2grk h GLN 35 CO 0.02 0.51 0.72 0.25 -0.67 0.00 0.00 178.83 179.65 2grk n THR 36 N -4.52 0.16 -0.99 -0.54 -2.24 -1.22 -4.87 114.28 100.07 2grk n THR 36 Ca 0.14 -0.03 -0.35 0.00 -2.27 0.00 0.00 64.05 61.54 2grk n THR 36 Cb 0.33 -1.17 0.06 0.00 -2.10 0.00 0.00 70.33 67.45 2grk n THR 36 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 2grk n PRO 37 N 4.02 -0.05 -2.40 -0.78 -0.02 -1.26 -4.86 135.00 129.64 2grk n PRO 37 Ca 0.21 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 61.27 2grk n PRO 37 Cb 0.20 -1.32 -0.02 0.00 -0.02 0.00 0.00 33.50 32.34 2grk n PRO 37 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2grk s THR 38 N -2.10 4.20 -0.28 3.45 2.01 -1.26 -4.99 115.64 116.67 2grk s THR 38 Ca 0.49 1.48 0.01 0.00 0.31 0.00 0.00 61.69 63.98 2grk s THR 38 Cb -0.23 -3.96 0.17 0.00 0.01 0.00 0.00 72.50 68.49 2grk s THR 38 CO 0.75 -0.09 0.48 0.21 -0.69 0.00 0.00 174.62 175.28 2grk s ASN 39 N 1.90 -0.48 -0.16 3.53 3.84 -1.26 -5.00 114.94 117.31 2grk s ASN 39 Ca 0.57 0.22 0.17 0.00 0.21 0.00 0.00 52.86 54.02 2grk s ASN 39 Cb -0.24 1.55 0.38 0.00 -0.55 0.00 0.00 41.25 42.39 2grk s ASN 39 CO 0.18 -0.30 1.25 0.47 -2.79 0.00 0.00 177.10 175.91 2grk n ASP 40 N 5.39 2.69 -4.52 -4.21 8.00 -1.26 -3.82 116.55 118.82 2grk n ASP 40 Ca -0.00 -3.20 -0.43 0.00 0.71 0.00 0.00 54.79 51.87 2grk n ASP 40 Cb 0.51 -0.48 -0.02 0.00 -0.02 0.00 0.00 41.12 41.11 2grk n ASP 40 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2grk s LYS 41 N -2.93 3.75 0.73 -1.24 1.02 -1.26 -4.71 119.74 115.10 2grk s LYS 41 Ca 0.36 -1.71 -0.11 0.00 0.02 0.00 0.00 55.97 54.52 2grk s LYS 41 Cb 0.31 -5.22 0.03 0.00 -0.52 0.00 0.00 37.83 32.44 2grk s LYS 41 CO 0.03 -2.02 1.08 0.96 -0.92 0.00 0.00 175.35 174.48 2grk s ILE 42 N 3.62 3.54 -1.44 2.17 -4.36 -1.26 -1.51 121.20 121.95 2grk s ILE 42 Ca 0.43 0.53 -0.08 0.00 -0.26 0.00 0.00 60.65 61.27 2grk s ILE 42 Cb -0.01 -3.09 0.05 0.00 1.25 0.00 0.00 42.46 40.65 2grk s ILE 42 CO -0.05 -0.62 0.87 0.00 0.24 0.00 0.00 174.94 175.38 2grk h GLN 44 N -2.02 0.80 -2.41 0.00 4.20 -1.20 0.30 115.11 114.78 2grk h GLN 44 Ca -0.59 -0.27 -0.03 0.00 0.06 0.00 0.00 58.65 57.82 2grk h GLN 44 Cb 1.37 -0.07 -0.16 0.00 0.30 0.00 0.00 27.48 28.92 2grk h GLN 44 CO 0.63 0.88 0.22 -1.54 -0.67 0.00 0.00 178.83 178.34 2grk s SER 45 N -6.33 -0.60 -0.11 1.46 1.04 -0.99 -4.34 113.70 103.83 2grk s SER 45 Ca -0.13 0.39 -0.03 0.00 0.48 0.00 0.00 55.95 56.67 2grk s SER 45 Cb 0.11 0.55 0.04 0.00 0.10 0.00 0.00 66.02 66.82 2grk s SER 45 CO 0.81 -0.75 0.04 -0.69 0.98 0.00 0.00 173.24 173.63 2grk s VAL 46 N -2.31 0.18 0.24 5.02 1.01 -1.26 -1.58 120.40 121.70 2grk s VAL 46 Ca -0.05 0.00 0.08 0.00 0.00 0.00 0.00 61.98 62.01 2grk s VAL 46 Cb -0.00 -0.55 -0.04 0.00 0.00 0.00 0.00 36.38 35.79 2grk s VAL 46 CO -0.00 0.03 0.06 0.42 0.00 0.00 0.00 175.10 175.60 2grk s THR 47 N 2.03 3.83 -0.04 3.92 -4.23 -0.94 -4.88 115.64 115.33 2grk s THR 47 Ca 0.03 -1.63 -0.01 0.00 -1.18 0.00 0.00 61.69 58.91 2grk s THR 47 Cb -0.14 -3.02 0.03 0.00 1.34 0.00 0.00 72.50 70.71 2grk s THR 47 CO -0.06 -0.30 0.03 -0.70 -0.54 0.00 0.00 174.62 173.05 2grk s GLU 48 N -3.52 0.20 -0.01 3.99 2.12 -1.26 -2.67 118.70 117.54 2grk s GLU 48 Ca 0.31 0.20 0.02 0.00 0.36 0.00 0.00 54.97 55.86 2grk s GLU 48 Cb -0.08 -0.57 0.00 0.00 0.26 0.00 0.00 34.13 33.74 2grk s GLU 48 CO 0.21 -0.25 -0.06 0.08 -0.54 0.00 0.00 175.26 174.71 2grk s VAL 49 N 1.65 0.50 -0.22 3.70 1.01 -0.82 -5.00 120.40 121.22 2grk s VAL 49 Ca -0.01 -0.23 0.01 0.00 0.00 0.00 0.00 61.98 61.75 2grk s VAL 49 Cb -0.13 -0.45 0.05 0.00 0.00 0.00 0.00 36.38 35.85 2grk s VAL 49 CO -0.03 0.16 -0.08 -0.89 0.00 0.00 0.00 175.10 174.27 2grk s THR 50 N 0.13 1.59 -0.17 3.92 2.01 -1.26 0.76 115.64 122.62 2grk s THR 50 Ca -0.01 -1.14 -0.10 0.00 0.31 0.00 0.00 61.69 60.74 2grk s THR 50 Cb -0.06 -1.77 0.06 0.00 0.01 0.00 0.00 72.50 70.73 2grk s THR 50 CO -0.00 0.01 0.42 -1.61 -0.69 0.00 0.00 174.62 172.75 2grk s GLU 51 N 1.39 0.41 -0.49 4.92 2.02 -0.99 -4.95 118.70 121.02 2grk s GLU 51 Ca -0.04 0.77 -0.00 0.00 0.02 0.00 0.00 54.97 55.71 2grk s GLU 51 Cb -0.18 0.02 0.40 0.00 0.10 0.00 0.00 34.13 34.47 2grk s GLU 51 CO -0.07 -0.14 1.96 -1.13 0.02 0.00 0.00 175.26 175.89 2grk n SER 52 N 4.05 6.32 -1.77 -0.19 3.41 -1.26 -2.89 113.62 121.29 2grk n SER 52 Ca -0.22 -3.44 -0.21 0.00 -0.26 0.00 0.00 58.87 54.74 2grk n SER 52 Cb 0.56 -0.95 -0.07 0.00 -0.26 0.00 0.00 64.21 63.49 2grk n SER 52 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2grk n GLU 53 N -0.51 -1.49 0.22 4.33 1.02 -1.26 -4.11 120.64 118.85 2grk n GLU 53 Ca 0.49 1.17 0.10 0.00 -0.02 0.00 0.00 57.16 58.90 2grk n GLU 53 Cb 0.83 -5.61 0.50 0.00 -0.02 0.00 0.00 31.44 27.13 2grk n GLU 53 CO 0.00 0.00 0.00 0.38 1.18 0.00 0.00 177.13 178.69 2grk h ASP 54 N 0.00 0.00 -2.79 1.62 2.03 -1.84 -3.43 116.42 112.01 2grk h ASP 54 Ca -0.44 0.00 -0.44 0.00 -0.73 0.00 0.00 57.03 55.42 2grk h ASP 54 Cb 1.35 0.00 0.06 0.00 -0.83 0.00 0.00 39.33 39.90 2grk h ASP 54 CO 0.61 0.23 0.03 -1.81 -1.03 0.00 0.00 179.24 177.27 2grk s ASP 55 N -6.24 5.14 0.00 4.15 1.01 -1.26 -4.87 116.67 114.60 2grk s ASP 55 Ca -0.00 0.08 0.00 0.00 0.71 0.00 0.00 52.55 53.34 2grk s ASP 55 Cb 0.11 -0.90 0.00 0.00 1.01 0.00 0.00 42.92 43.14 2grk s ASP 55 CO 0.64 -1.27 0.00 0.61 0.21 0.00 0.00 175.17 175.35 2grk n GLY 56 N -2.49 0.00 3.62 0.21 0.00 -1.26 -2.62 105.19 102.64 2grk n GLY 56 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 2grk n GLY 56 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2grk n VAL 57 N 0.00 0.00 -3.45 1.61 0.31 -1.26 -4.90 118.33 110.64 2grk n VAL 57 Ca 0.00 0.00 -0.27 0.00 -0.01 0.00 0.00 64.34 64.06 2grk n VAL 57 Cb 0.00 -0.06 -0.08 0.00 -0.91 0.00 0.00 33.84 32.79 2grk n VAL 57 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2grk n SER 58 N 0.00 3.13 -4.79 4.52 3.41 -1.08 -5.07 113.62 113.74 2grk n SER 58 Ca 0.00 -3.30 -0.37 0.00 -0.26 0.00 0.00 58.87 54.94 2grk n SER 58 Cb 0.00 -0.68 -0.07 0.00 -0.26 0.00 0.00 64.21 63.21 2grk n SER 58 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 2grk s GLU 59 N -2.13 4.01 0.02 4.33 2.56 -1.26 -4.60 118.70 121.63 2grk s GLU 59 Ca 0.37 0.15 -0.04 0.00 0.00 0.00 0.00 54.97 55.45 2grk s GLU 59 Cb 0.12 -3.33 -0.01 0.00 2.00 0.00 0.00 34.13 32.92 2grk s GLU 59 CO -0.05 0.46 0.06 -1.21 -0.56 0.00 0.00 175.26 173.97 2grk s GLU 60 N -0.23 0.45 0.30 4.30 0.41 -1.26 -5.04 118.70 117.64 2grk s GLU 60 Ca 0.18 -0.59 0.01 0.00 -0.41 0.00 0.00 54.97 54.16 2grk s GLU 60 Cb -0.14 0.18 0.48 0.00 -1.78 0.00 0.00 34.13 32.87 2grk s GLU 60 CO 0.07 -0.10 1.86 0.28 -0.49 0.00 0.00 175.26 176.88 2grk h VAL 61 N 4.21 1.21 -3.48 2.63 2.07 -2.05 -3.38 116.25 117.46 2grk h VAL 61 Ca -0.32 -0.75 -0.63 0.00 0.82 0.00 0.00 66.70 65.82 2grk h VAL 61 Cb 1.19 0.71 -0.40 0.00 -1.52 0.00 0.00 31.29 31.27 2grk h VAL 61 CO 0.44 0.28 -0.73 -0.69 0.02 0.00 0.00 177.57 176.88 2grk s VAL 62 N -5.19 1.76 0.53 2.57 1.01 -1.26 -5.11 120.40 114.71 2grk s VAL 62 Ca -0.09 -2.02 -0.22 0.00 0.00 0.00 0.00 61.98 59.65 2grk s VAL 62 Cb 0.16 -2.31 -0.06 0.00 0.00 0.00 0.00 36.38 34.17 2grk s VAL 62 CO 0.79 -0.63 1.28 1.17 0.00 0.00 0.00 175.10 177.70 2grk n LYS 63 N 4.45 1.62 -2.98 2.72 4.81 -1.26 -5.02 118.16 122.49 2grk n LYS 63 Ca 0.02 0.59 -0.18 0.00 -0.87 0.00 0.00 58.31 57.87 2grk n LYS 63 Cb 0.42 -2.47 0.03 0.00 0.02 0.00 0.00 35.03 33.03 2grk n LYS 63 CO 0.00 0.00 0.00 0.20 1.17 0.00 0.00 177.40 178.77 2grk s GLY 64 N -0.88 1.86 0.09 3.14 0.00 -1.26 -5.03 107.32 105.23 2grk s GLY 64 Ca 0.70 -1.82 -0.34 0.00 0.00 0.00 0.00 44.72 43.26 2grk s GLY 64 CO 0.51 -1.52 1.67 1.22 0.00 0.00 0.00 173.10 174.98 2grk n ASP 65 N -2.05 3.24 -4.72 1.64 8.00 -1.26 -4.74 116.55 116.65 2grk n ASP 65 Ca 0.11 1.05 -0.42 0.00 0.71 0.00 0.00 54.79 56.24 2grk n ASP 65 Cb 0.60 -1.42 -0.03 0.00 -0.02 0.00 0.00 41.12 40.25 2grk n ASP 65 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 2grk s PRO 66 N 1.86 4.20 -0.18 -0.24 0.04 -1.26 -4.65 135.00 134.78 2grk s PRO 66 Ca 0.83 2.41 -0.03 0.00 0.04 0.00 0.00 61.00 64.25 2grk s PRO 66 Cb -0.67 -3.12 -0.01 0.00 0.04 0.00 0.00 34.50 30.73 2grk s PRO 66 CO 0.41 -0.61 -0.07 0.99 0.04 0.00 0.00 177.00 177.77 2grk s THR 67 N 0.89 3.36 -0.25 1.26 2.01 -1.14 -4.39 115.64 117.38 2grk s THR 67 Ca 0.69 -0.52 -0.20 0.00 0.31 0.00 0.00 61.69 61.96 2grk s THR 67 Cb -0.45 -2.48 -0.02 0.00 0.01 0.00 0.00 72.50 69.56 2grk s THR 67 CO 0.34 0.47 0.62 -0.89 -0.69 0.00 0.00 174.62 174.48 2grk s THR 68 N 0.86 4.99 -0.11 -0.82 2.01 -0.12 -2.34 115.64 120.11 2grk s THR 68 Ca -0.02 1.11 -0.04 0.00 0.31 0.00 0.00 61.69 63.05 2grk s THR 68 Cb -0.15 -3.92 -0.04 0.00 0.01 0.00 0.00 72.50 68.40 2grk s THR 68 CO 0.01 0.04 0.05 -0.31 -0.69 0.00 0.00 174.62 173.72 2grk s TYR 69 N 2.45 3.30 -0.21 4.92 1.51 0.23 -0.76 117.35 128.79 2grk s TYR 69 Ca 0.26 0.26 0.02 0.00 -1.01 0.00 0.00 57.07 56.60 2grk s TYR 69 Cb -0.16 -1.88 0.04 0.00 -0.11 0.00 0.00 41.96 39.85 2grk s TYR 69 CO 0.09 0.49 -0.15 0.71 -1.11 0.00 0.00 175.55 175.57 2grk s TYR 70 N -0.71 2.86 -0.37 2.71 2.02 0.72 -1.94 117.35 122.63 2grk s TYR 70 Ca 0.12 -1.85 -0.10 0.00 -0.37 0.00 0.00 57.07 54.87 2grk s TYR 70 Cb -0.12 -1.87 0.04 0.00 -0.40 0.00 0.00 41.96 39.61 2grk s TYR 70 CO 0.02 -0.82 0.19 0.99 -1.57 0.00 0.00 175.55 174.37 2grk s THR 71 N 1.25 4.36 -0.25 -0.71 2.01 -1.09 0.22 115.64 121.43 2grk s THR 71 Ca -0.01 -0.99 -0.09 0.00 0.31 0.00 0.00 61.69 60.91 2grk s THR 71 Cb -0.16 -3.47 -0.04 0.00 0.01 0.00 0.00 72.50 68.84 2grk s THR 71 CO -0.10 -0.26 0.12 -0.69 -0.69 0.00 0.00 174.62 173.00 2grk s VAL 72 N 1.50 4.81 -0.27 3.82 1.01 0.38 -2.22 120.40 129.44 2grk s VAL 72 Ca 0.01 -0.00 -0.08 0.00 0.00 0.00 0.00 61.98 61.91 2grk s VAL 72 Cb -0.20 -3.26 -0.02 0.00 0.00 0.00 0.00 36.38 32.90 2grk s VAL 72 CO 0.05 0.31 0.08 -0.69 0.00 0.00 0.00 175.10 174.86 2grk s VAL 73 N 1.53 4.28 0.00 2.92 1.01 -0.61 0.28 120.40 129.81 2grk s VAL 73 Ca 0.06 -0.31 0.00 0.00 0.00 0.00 0.00 61.98 61.73 2grk s VAL 73 Cb -0.15 -3.07 0.00 0.00 0.00 0.00 0.00 36.38 33.16 2grk s VAL 73 CO 0.06 0.25 0.00 0.61 0.00 0.00 0.00 175.10 176.02 2grk n GLY 74 N 4.92 0.72 2.40 4.51 0.00 0.37 -0.98 105.19 117.12 2grk n GLY 74 Ca -0.16 -0.60 -0.15 0.00 0.00 0.00 0.00 46.02 45.12 2grk n GLY 74 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2grk n GLY 75 N -0.02 -0.28 2.01 -0.02 0.00 -0.57 -0.50 105.19 105.81 2grk n GLY 75 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.02 2grk n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2grk n GLY 76 N -0.81 0.46 3.22 -0.02 0.00 -1.25 -4.70 105.19 102.09 2grk n GLY 76 Ca -0.18 -0.43 -0.20 0.00 0.00 0.00 0.00 46.02 45.21 2grk n GLY 76 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2grk s LEU 77 N -0.02 2.31 -0.60 0.99 1.43 0.35 -0.58 118.68 122.56 2grk s LEU 77 Ca 0.00 -0.68 0.01 0.00 -1.03 0.00 0.00 54.13 52.43 2grk s LEU 77 Cb 0.00 -0.64 0.15 0.00 0.03 0.00 0.00 46.19 45.73 2grk s LEU 77 CO 0.00 -0.05 0.38 -0.13 0.23 0.00 0.00 176.35 176.78 2grk s ARG 78 N -1.98 2.34 -0.37 1.70 0.52 -0.63 -0.48 118.95 120.05 2grk s ARG 78 Ca 0.03 -2.68 -0.22 0.00 -0.52 0.00 0.00 55.73 52.34 2grk s ARG 78 Cb -0.09 -3.54 0.01 0.00 0.52 0.00 0.00 34.95 31.85 2grk s ARG 78 CO 0.03 -1.16 0.70 -1.64 0.02 0.00 0.00 175.30 173.25 2grk s MET 79 N -0.35 3.67 -0.13 3.54 -1.94 0.14 -1.94 119.30 122.29 2grk s MET 79 Ca 0.18 0.12 -0.04 0.00 -1.71 0.00 0.00 55.69 54.24 2grk s MET 79 Cb -0.21 -3.83 -0.03 0.00 2.01 0.00 0.00 34.83 32.77 2grk s MET 79 CO -0.03 -0.82 0.01 1.21 -0.01 0.00 0.00 175.02 175.38 2grk s ASN 80 N 1.84 5.25 -0.09 3.03 3.84 0.69 0.14 114.94 129.65 2grk s ASN 80 Ca 0.27 0.06 0.02 0.00 0.21 0.00 0.00 52.86 53.42 2grk s ASN 80 Cb -0.14 -1.72 0.01 0.00 -0.55 0.00 0.00 41.25 38.86 2grk s ASN 80 CO 0.16 0.26 -0.13 -0.36 -2.79 0.00 0.00 177.10 174.24 2grk s PHE 81 N -0.18 1.70 -0.29 0.43 0.08 0.13 -1.41 117.98 118.44 2grk s PHE 81 Ca 0.05 -0.73 -0.05 0.00 0.12 0.00 0.00 56.93 56.33 2grk s PHE 81 Cb -0.12 -1.25 0.02 0.00 -0.57 0.00 0.00 43.02 41.10 2grk s PHE 81 CO 0.02 -0.39 0.03 0.20 -0.10 0.00 0.00 175.22 174.99 2grk s GLY 82 N 0.90 1.74 -0.20 4.36 0.00 -0.15 -0.20 107.32 113.77 2grk s GLY 82 Ca -0.09 -1.53 -0.10 0.00 0.00 0.00 0.00 44.72 43.01 2grk s GLY 82 CO 0.00 0.63 0.12 -1.36 0.00 0.00 0.00 173.10 172.50 2grk s PHE 83 N 1.41 3.37 -0.32 1.90 0.40 0.06 -1.38 117.98 123.43 2grk s PHE 83 Ca 0.01 0.26 0.03 0.00 -0.60 0.00 0.00 56.93 56.63 2grk s PHE 83 Cb -0.18 -2.16 0.09 0.00 0.51 0.00 0.00 43.02 41.29 2grk s PHE 83 CO 0.00 0.23 0.01 0.99 0.70 0.00 0.00 175.22 177.16 2grk s THR 84 N 0.45 2.15 -0.93 0.64 2.01 -0.40 -0.94 115.64 118.61 2grk s THR 84 Ca 0.07 -2.09 -0.00 0.00 0.31 0.00 0.00 61.69 59.98 2grk s THR 84 Cb -0.12 -2.50 -0.00 0.00 0.01 0.00 0.00 72.50 69.89 2grk s THR 84 CO -0.01 -0.45 0.78 0.29 -0.69 0.00 0.00 174.62 174.54 2grk n LYS 85 N 4.34 -4.97 -4.59 4.92 5.02 -1.26 -2.17 118.16 119.45 2grk n LYS 85 Ca -0.01 0.67 -0.27 0.00 -2.02 0.00 0.00 58.31 56.68 2grk n LYS 85 Cb 0.42 -5.12 -0.10 0.00 -0.02 0.00 0.00 35.03 30.21 2grk n LYS 85 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2grk s PRO 87 N -3.79 3.43 0.46 0.00 0.02 -1.26 -4.91 135.00 128.95 2grk s PRO 87 Ca 0.29 2.29 -0.24 0.00 0.02 0.00 0.00 61.00 63.35 2grk s PRO 87 Cb 0.07 -2.45 -0.07 0.00 0.02 0.00 0.00 34.50 32.07 2grk s PRO 87 CO 0.14 -0.97 1.33 -1.14 -0.33 0.00 0.00 177.00 176.03 2grk s GLN 88 N -2.68 3.64 -0.03 5.54 0.74 -1.26 -4.74 119.66 120.87 2grk s GLN 88 Ca 0.66 2.19 -0.17 0.00 0.05 0.00 0.00 55.36 58.09 2grk s GLN 88 Cb -0.41 -2.55 -0.05 0.00 1.10 0.00 0.00 33.01 31.10 2grk s GLN 88 CO 0.51 -0.78 0.48 0.42 -0.55 0.00 0.00 175.29 175.37 2grk s ILE 89 N -1.30 5.03 0.00 -2.34 -1.09 -1.26 -4.04 121.20 116.20 2grk s ILE 89 Ca 0.63 0.98 0.00 0.00 -2.23 0.00 0.00 60.65 60.03 2grk s ILE 89 Cb -0.39 -3.80 0.00 0.00 -1.58 0.00 0.00 42.46 36.69 2grk s ILE 89 CO 0.49 0.46 0.40 0.29 -1.23 0.00 0.00 174.94 175.35 2grk n LYS 90 N 2.60 0.00 -3.71 2.79 5.02 -0.33 -4.91 118.16 119.63 2grk n LYS 90 Ca -0.10 -0.40 -0.24 0.00 -2.02 0.00 0.00 58.31 55.55 2grk n LYS 90 Cb 0.52 -0.48 -0.17 0.00 -0.02 0.00 0.00 35.03 34.87 2grk n LYS 90 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2grk s SER 91 N 0.00 1.93 -0.21 4.39 0.15 0.30 -4.39 113.70 115.86 2grk s SER 91 Ca 0.00 -0.31 0.01 0.00 0.70 0.00 0.00 55.95 56.35 2grk s SER 91 Cb 0.00 -0.37 0.05 0.00 -1.71 0.00 0.00 66.02 63.99 2grk s SER 91 CO 0.00 -0.26 -0.07 -0.63 1.20 0.00 0.00 173.24 173.48 2grk s ILE 92 N 2.02 1.51 0.26 6.45 1.01 -1.26 -1.42 121.20 129.77 2grk s ILE 92 Ca 0.03 -1.06 0.07 0.00 0.00 0.00 0.00 60.65 59.69 2grk s ILE 92 Cb -0.14 -1.70 -0.05 0.00 0.01 0.00 0.00 42.46 40.58 2grk s ILE 92 CO -0.06 0.03 -0.09 -0.94 0.00 0.00 0.00 174.94 173.88 2grk s SER 93 N 1.43 2.74 0.18 3.58 1.04 -0.91 0.20 113.70 121.96 2grk s SER 93 Ca -0.03 -1.14 -0.18 0.00 0.48 0.00 0.00 55.95 55.08 2grk s SER 93 Cb -0.17 -0.16 0.04 0.00 0.10 0.00 0.00 66.02 65.82 2grk s SER 93 CO -0.07 -0.28 0.52 -0.70 0.98 0.00 0.00 173.24 173.70 2grk s GLU 94 N -3.70 1.32 0.04 4.02 2.12 -0.11 -2.29 118.70 120.10 2grk s GLU 94 Ca 0.28 -0.77 -0.19 0.00 0.36 0.00 0.00 54.97 54.65 2grk s GLU 94 Cb 0.02 0.53 0.04 0.00 0.26 0.00 0.00 34.13 34.98 2grk s GLU 94 CO 0.11 -0.56 0.44 -1.54 -0.54 0.00 0.00 175.26 173.17 2grk s SER 95 N -2.84 -0.33 -0.07 -1.70 1.04 -0.20 -0.68 113.70 108.92 2grk s SER 95 Ca 0.07 0.08 -0.08 0.00 0.48 0.00 0.00 55.95 56.49 2grk s SER 95 Cb -0.01 0.44 0.02 0.00 0.10 0.00 0.00 66.02 66.57 2grk s SER 95 CO -0.06 -0.66 0.22 0.00 0.98 0.00 0.00 173.24 173.72 2grk s ALA 96 N -2.33 -0.55 0.15 5.32 0.00 -1.26 -1.17 121.76 121.92 2grk s ALA 96 Ca -0.06 0.56 -0.25 0.00 0.00 0.00 0.00 51.96 52.21 2grk s ALA 96 Cb -0.01 -0.31 0.06 0.00 0.00 0.00 0.00 23.12 22.86 2grk s ALA 96 CO -0.01 -0.12 0.94 0.16 0.00 0.00 0.00 175.76 176.73 2grk s ASP 97 N -0.06 -0.19 0.00 0.00 -4.77 -1.09 -5.02 116.67 105.54 2grk s ASP 97 Ca -0.02 -0.40 0.00 0.00 -3.30 0.00 0.00 52.55 48.83 2grk s ASP 97 Cb -0.02 0.50 0.00 0.00 -1.09 0.00 0.00 42.92 42.31 2grk s ASP 97 CO 0.01 -0.92 0.00 0.61 0.70 0.00 0.00 175.17 175.57 2grk n GLY 98 N -0.46 0.87 1.85 2.12 0.00 -1.26 -1.36 105.19 106.95 2grk n GLY 98 Ca -0.06 -0.51 0.05 0.00 0.00 0.00 0.00 46.02 45.50 2grk n GLY 98 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2grk n ASN 99 N -3.44 5.43 -4.66 1.61 3.02 -1.26 -4.92 115.26 111.04 2grk n ASN 99 Ca 0.00 -2.92 -0.33 0.00 -0.03 0.00 0.00 54.58 51.29 2grk n ASN 99 Cb 0.00 -0.69 -0.10 0.00 -0.61 0.00 0.00 39.78 38.39 2grk n ASN 99 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2grk s THR 100 N -2.71 4.07 -0.16 3.41 -4.23 -0.46 0.14 115.64 115.70 2grk s THR 100 Ca 0.52 -0.48 0.00 0.00 -1.18 0.00 0.00 61.69 60.55 2grk s THR 100 Cb 0.40 -2.75 0.03 0.00 1.34 0.00 0.00 72.50 71.52 2grk s THR 100 CO 0.15 0.49 -0.11 -0.69 -0.54 0.00 0.00 174.62 173.92 2grk s VAL 101 N -0.96 1.44 -0.08 2.29 1.01 0.19 -2.65 120.40 121.63 2grk s VAL 101 Ca 0.16 -0.67 -0.04 0.00 0.00 0.00 0.00 61.98 61.43 2grk s VAL 101 Cb -0.11 -1.44 -0.04 0.00 0.00 0.00 0.00 36.38 34.79 2grk s VAL 101 CO 0.06 0.32 0.08 0.20 0.00 0.00 0.00 175.10 175.77 2grk s ASN 102 N 1.52 5.86 -0.08 3.32 -0.87 -0.32 -0.62 114.94 123.75 2grk s ASN 102 Ca 0.03 0.29 -0.07 0.00 -1.57 0.00 0.00 52.86 51.53 2grk s ASN 102 Cb -0.14 -1.78 0.02 0.00 -0.02 0.00 0.00 41.25 39.33 2grk s ASN 102 CO -0.09 0.36 0.21 0.00 -2.57 0.00 0.00 177.10 175.01 2grk s ALA 103 N -1.03 -0.51 -0.10 0.60 0.00 0.61 -1.04 121.76 120.29 2grk s ALA 103 Ca 0.17 0.58 0.02 0.00 0.00 0.00 0.00 51.96 52.73 2grk s ALA 103 Cb -0.12 -0.34 0.01 0.00 0.00 0.00 0.00 23.12 22.67 2grk s ALA 103 CO 0.06 -0.10 -0.15 0.50 0.00 0.00 0.00 175.76 176.07 2grk s ARG 104 N 0.12 2.18 -0.09 0.00 3.52 -0.97 -0.70 118.95 123.02 2grk s ARG 104 Ca -0.00 -0.56 0.03 0.00 -0.13 0.00 0.00 55.73 55.07 2grk s ARG 104 Cb -0.02 -1.82 0.01 0.00 -1.56 0.00 0.00 34.95 31.56 2grk s ARG 104 CO 0.00 -0.02 -0.18 -0.51 -0.81 0.00 0.00 175.30 173.78 2grk s LEU 105 N 0.86 1.86 0.16 -0.88 1.43 0.43 -2.15 118.68 120.40 2grk s LEU 105 Ca -0.09 -0.44 -0.25 0.00 -1.03 0.00 0.00 54.13 52.32 2grk s LEU 105 Cb -0.15 -1.14 0.06 0.00 0.03 0.00 0.00 46.19 44.99 2grk s LEU 105 CO 0.01 0.09 0.93 -0.94 0.23 0.00 0.00 176.35 176.66 2grk s SER 106 N 0.58 -0.19 0.53 2.29 1.04 -0.51 0.04 113.70 117.48 2grk s SER 106 Ca -0.15 -0.41 -0.07 0.00 0.48 0.00 0.00 55.95 55.80 2grk s SER 106 Cb -0.17 0.51 -0.04 0.00 0.10 0.00 0.00 66.02 66.43 2grk s SER 106 CO 0.05 -0.94 0.87 -0.94 0.98 0.00 0.00 173.24 173.26 2grk s SER 107 N -2.92 6.26 -0.11 7.02 1.04 -0.74 -0.54 113.70 123.70 2grk s SER 107 Ca 0.12 1.11 -0.02 0.00 0.48 0.00 0.00 55.95 57.63 2grk s SER 107 Cb -0.02 -2.33 -0.03 0.00 0.10 0.00 0.00 66.02 63.74 2grk s SER 107 CO 0.02 -0.67 -0.03 -0.69 0.98 0.00 0.00 173.24 172.85 2grk s VAL 108 N -2.88 4.02 0.31 5.02 1.01 -1.26 -3.37 120.40 123.25 2grk s VAL 108 Ca 0.50 -0.34 -0.29 0.00 0.00 0.00 0.00 61.98 61.86 2grk s VAL 108 Cb -0.11 -2.71 -0.13 0.00 0.00 0.00 0.00 36.38 33.44 2grk s VAL 108 CO 0.48 0.56 1.30 -0.24 0.00 0.00 0.00 175.10 177.19 2grk n SER 109 N 2.72 2.68 -0.02 3.32 2.88 -0.84 -4.74 113.62 119.62 2grk n SER 109 Ca -0.18 1.19 0.03 0.00 -1.33 0.00 0.00 58.87 58.58 2grk n SER 109 Cb 0.53 -1.46 0.39 0.00 -0.75 0.00 0.00 64.21 62.92 2grk n SER 109 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 2grk h PRO 110 N 2.91 0.59 0.00 -1.46 0.11 -1.84 -0.42 132.00 131.89 2grk h PRO 110 Ca -0.45 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.61 2grk h PRO 110 Cb 1.28 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.26 2grk h PRO 110 CO 0.66 0.41 0.01 -0.12 -0.21 0.00 0.00 178.00 178.74 2grk n MET 111 N -4.45 0.00 -0.01 1.05 0.00 -1.26 -1.08 117.12 111.36 2grk n MET 111 Ca 0.04 0.11 0.01 0.00 -0.00 0.00 0.00 57.70 57.85 2grk n MET 111 Cb 0.07 -1.51 0.01 0.00 0.00 0.00 0.00 33.22 31.80 2grk n MET 111 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 175.97 176.63 2grk n TYR 112 N -1.09 0.03 0.00 1.12 4.01 -0.16 -5.03 117.16 116.04 2grk n TYR 112 Ca 0.00 -0.31 0.00 0.00 -0.16 0.00 0.00 57.90 57.43 2grk n TYR 112 Cb 0.01 -0.03 0.00 0.00 -0.31 0.00 0.00 39.34 39.01 2grk n TYR 112 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2grk n GLY 113 N -0.23 3.18 3.78 2.72 0.00 -0.24 -5.02 105.19 109.38 2grk n GLY 113 Ca 0.01 -1.11 -0.39 0.00 0.00 0.00 0.00 46.02 44.53 2grk n GLY 113 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2grk s ILE 114 N 0.00 4.63 0.09 -0.61 1.09 -1.26 -4.99 121.20 120.16 2grk s ILE 114 Ca 0.00 1.44 -0.21 0.00 -1.10 0.00 0.00 60.65 60.78 2grk s ILE 114 Cb 0.00 -4.01 -0.07 0.00 -1.06 0.00 0.00 42.46 37.32 2grk s ILE 114 CO 0.00 0.50 0.63 -0.70 -0.10 0.00 0.00 174.94 175.27 2grk s GLU 115 N -0.85 4.31 0.05 2.79 2.12 -1.26 -3.62 118.70 122.24 2grk s GLU 115 Ca 0.33 0.86 0.03 0.00 0.36 0.00 0.00 54.97 56.54 2grk s GLU 115 Cb -0.21 -3.26 -0.03 0.00 0.26 0.00 0.00 34.13 30.90 2grk s GLU 115 CO 0.22 0.59 -0.09 -1.54 -0.54 0.00 0.00 175.26 173.90 2grk s SER 116 N -1.02 1.06 0.03 -1.70 1.04 -1.26 -5.04 113.70 106.81 2grk s SER 116 Ca 0.31 -0.59 -0.30 0.00 0.48 0.00 0.00 55.95 55.85 2grk s SER 116 Cb -0.20 0.02 -0.09 0.00 0.10 0.00 0.00 66.02 65.85 2grk s SER 116 CO 0.21 -0.19 1.91 -2.84 0.98 0.00 0.00 173.24 173.30 2grk s PRO 117 N -1.75 4.15 -0.42 4.02 0.02 -1.26 -4.45 135.00 135.31 2grk s PRO 117 Ca -0.07 2.55 -0.22 0.00 0.02 0.00 0.00 61.00 63.28 2grk s PRO 117 Cb -0.09 -4.08 0.02 0.00 0.02 0.00 0.00 34.50 30.37 2grk s PRO 117 CO 0.01 -0.93 0.71 0.00 -0.33 0.00 0.00 177.00 176.46 2grk s ALA 118 N 4.21 3.36 0.47 -1.55 0.00 -1.10 -4.21 121.76 122.94 2grk s ALA 118 Ca 0.85 -0.98 0.06 0.00 0.00 0.00 0.00 51.96 51.89 2grk s ALA 118 Cb -0.42 -3.35 -0.01 0.00 0.00 0.00 0.00 23.12 19.34 2grk s ALA 118 CO 0.39 -1.70 0.24 0.96 0.00 0.00 0.00 175.76 175.65 2grk s ILE 119 N 3.01 1.95 0.74 0.00 -4.36 0.32 -4.76 121.20 118.09 2grk s ILE 119 Ca 0.27 -1.64 -0.11 0.00 -0.26 0.00 0.00 60.65 58.90 2grk s ILE 119 Cb -0.13 -2.60 0.04 0.00 1.25 0.00 0.00 42.46 41.02 2grk s ILE 119 CO 0.19 0.00 1.11 0.42 0.24 0.00 0.00 174.94 176.90 2grk s THR 120 N -2.69 2.87 0.36 8.37 -4.23 -1.25 0.63 115.64 119.70 2grk s THR 120 Ca 0.34 0.22 0.07 0.00 -1.18 0.00 0.00 61.69 61.14 2grk s THR 120 Cb 0.01 -3.27 0.31 0.00 1.34 0.00 0.00 72.50 70.89 2grk s THR 120 CO 0.20 -0.34 1.92 -0.74 -0.54 0.00 0.00 174.62 175.11 2grk h HIS 121 N -0.77 0.80 0.06 3.99 2.76 -1.90 -0.19 115.15 119.90 2grk h HIS 121 Ca -0.45 0.02 -0.00 0.00 -2.20 0.00 0.00 60.37 57.74 2grk h HIS 121 Cb 1.29 -0.26 0.00 0.00 1.55 0.00 0.00 27.41 29.99 2grk h HIS 121 CO 0.42 0.37 -0.03 0.93 -1.30 0.00 0.00 177.93 178.32 2grk h GLU 122 N 0.74 -0.07 -0.51 5.26 5.08 -1.93 -2.44 114.58 120.71 2grk h GLU 122 Ca 0.37 0.00 0.15 0.00 -1.00 0.00 0.00 59.36 58.89 2grk h GLU 122 Cb 0.46 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.70 2grk h GLU 122 CO -0.15 0.54 0.45 0.93 -1.00 0.00 0.00 179.01 179.78 2grk h GLU 123 N -0.84 0.00 0.39 2.33 5.08 -1.88 0.12 114.58 119.79 2grk h GLU 123 Ca -0.01 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 2grk h GLU 123 Cb 0.64 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.90 2grk h GLU 123 CO 0.01 0.00 -0.19 0.00 -1.00 0.00 0.00 179.01 177.83 2grk h ALA 124 N 1.57 -0.53 0.00 3.43 0.00 -0.95 -1.98 119.26 120.80 2grk h ALA 124 Ca 0.24 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.97 2grk h ALA 124 Cb 1.14 0.21 0.00 0.00 0.00 0.00 0.00 17.79 19.14 2grk h ALA 124 CO -0.00 -0.56 0.00 -0.07 0.00 0.00 0.00 179.25 178.62 2grk h LEU 125 N -1.01 0.00 -0.04 0.00 3.38 -0.83 -1.40 115.31 115.41 2grk h LEU 125 Ca -0.05 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 2grk h LEU 125 Cb 0.53 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.28 2grk h LEU 125 CO 0.09 0.00 -0.09 0.00 0.09 0.00 0.00 178.44 178.52 2grk h ALA 126 N 2.04 0.07 -0.53 1.53 0.00 -0.72 -2.84 119.26 118.80 2grk h ALA 126 Ca 0.00 -0.33 -0.10 0.00 0.00 0.00 0.00 54.91 54.48 2grk h ALA 126 Cb 0.28 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 2grk h ALA 126 CO 0.00 -0.07 -0.05 1.98 0.00 0.00 0.00 179.25 181.11 2grk h MET 127 N -0.40 0.98 0.00 0.00 1.85 -0.92 -0.96 114.93 115.48 2grk h MET 127 Ca -0.00 -0.34 0.00 0.00 -0.61 0.00 0.00 59.70 58.75 2grk h MET 127 Cb 0.69 -0.07 0.00 0.00 0.43 0.00 0.00 31.60 32.65 2grk h MET 127 CO 0.02 1.01 0.02 0.82 -0.40 0.00 0.00 176.91 178.38 2grk h ILE 128 N 0.85 0.00 0.04 1.77 2.04 -1.30 0.20 117.51 121.11 2grk h ILE 128 Ca 0.14 0.00 -0.28 0.00 1.00 0.00 0.00 64.86 65.73 2grk h ILE 128 Cb 0.61 0.61 -0.03 0.00 -0.74 0.00 0.00 36.82 37.26 2grk h ILE 128 CO 0.04 0.00 -1.50 -1.13 0.00 0.00 0.00 178.15 175.56 2grk h ASN 129 N 0.00 0.14 0.82 1.72 -1.24 -0.96 -3.40 115.58 112.66 2grk h ASN 129 Ca 0.00 -0.65 -0.19 0.00 0.71 0.00 0.00 56.30 56.17 2grk h ASN 129 Cb 0.05 -0.05 -0.02 0.00 0.73 0.00 0.00 38.32 39.03 2grk h ASN 129 CO 0.00 1.61 -0.88 0.44 -1.29 0.00 0.00 177.43 177.31 2grk h ASP 130 N -0.65 0.05 -2.66 1.15 3.32 -0.20 -3.46 116.42 113.96 2grk h ASP 130 Ca -0.37 -0.05 -0.55 0.00 0.02 0.00 0.00 57.03 56.09 2grk h ASP 130 Cb 1.55 -0.02 0.07 0.00 0.22 0.00 0.00 39.33 41.15 2grk h ASP 130 CO -0.11 0.90 0.90 0.00 -1.72 0.00 0.00 179.24 179.21 2grk s ALA 132 N 0.78 -0.06 -0.06 0.00 0.00 -0.92 -4.71 121.76 116.78 2grk s ALA 132 Ca 0.73 -0.23 0.01 0.00 0.00 0.00 0.00 51.96 52.47 2grk s ALA 132 Cb -0.56 0.06 0.02 0.00 0.00 0.00 0.00 23.12 22.64 2grk s ALA 132 CO 0.38 -0.12 -0.06 0.08 0.00 0.00 0.00 175.76 176.04 2grk s VAL 133 N -0.92 0.69 0.03 0.00 1.01 -0.71 -1.27 120.40 119.23 2grk s VAL 133 Ca -0.10 -0.17 0.04 0.00 0.00 0.00 0.00 61.98 61.75 2grk s VAL 133 Cb -0.06 -0.72 -0.04 0.00 0.00 0.00 0.00 36.38 35.57 2grk s VAL 133 CO -0.00 0.28 -0.07 -0.94 0.00 0.00 0.00 175.10 174.37 2grk s SER 134 N 1.17 4.60 -0.03 3.32 1.04 -0.48 0.32 113.70 123.65 2grk s SER 134 Ca -0.06 -0.20 0.06 0.00 0.48 0.00 0.00 55.95 56.23 2grk s SER 134 Cb -0.14 -1.04 -0.02 0.00 0.10 0.00 0.00 66.02 64.92 2grk s SER 134 CO -0.01 0.25 -0.21 -0.63 0.98 0.00 0.00 173.24 173.61 2grk s ILE 135 N -1.06 2.44 -0.23 -1.02 1.01 0.83 -0.98 121.20 122.19 2grk s ILE 135 Ca 0.19 -0.96 -0.03 0.00 0.00 0.00 0.00 60.65 59.84 2grk s ILE 135 Cb -0.11 -1.89 0.11 0.00 0.01 0.00 0.00 42.46 40.57 2grk s ILE 135 CO 0.10 0.58 0.24 0.21 0.00 0.00 0.00 174.94 176.07 2grk s ASN 136 N -0.66 1.51 -0.26 3.58 3.84 -0.50 -0.29 114.94 122.16 2grk s ASN 136 Ca 0.11 -0.38 -0.03 0.00 0.21 0.00 0.00 52.86 52.77 2grk s ASN 136 Cb -0.10 0.41 0.02 0.00 -0.55 0.00 0.00 41.25 41.03 2grk s ASN 136 CO -0.00 -0.35 -0.02 -0.63 -2.79 0.00 0.00 177.10 173.31 2grk s ILE 137 N 2.33 3.13 0.46 -5.21 1.01 -0.09 -0.23 121.20 122.61 2grk s ILE 137 Ca 0.08 -0.97 0.06 0.00 0.00 0.00 0.00 60.65 59.82 2grk s ILE 137 Cb -0.15 -2.61 -0.03 0.00 0.01 0.00 0.00 42.46 39.67 2grk s ILE 137 CO -0.19 0.15 0.16 -0.54 0.00 0.00 0.00 174.94 174.53 2grk s LYS 138 N 1.36 2.19 0.24 2.79 1.02 -0.82 -1.20 119.74 125.32 2grk s LYS 138 Ca 0.00 -2.03 -0.17 0.00 0.02 0.00 0.00 55.97 53.79 2grk s LYS 138 Cb -0.17 -1.86 -0.08 0.00 -0.52 0.00 0.00 37.83 35.20 2grk s LYS 138 CO -0.03 -0.25 0.69 0.00 -0.92 0.00 0.00 175.35 174.85 2grk s SER 140 N -1.88 2.22 0.00 0.00 0.15 0.25 -4.59 113.70 109.85 2grk s SER 140 Ca 0.46 -0.42 0.11 0.00 0.70 0.00 0.00 55.95 56.80 2grk s SER 140 Cb -0.14 -0.21 0.10 0.00 -1.71 0.00 0.00 66.02 64.05 2grk s SER 140 CO 0.20 0.18 0.87 -0.62 1.20 0.00 0.00 173.24 175.07 2grk n GLU 141 N 2.27 0.63 -1.69 5.44 -0.58 -1.26 -4.58 120.64 120.87 2grk n GLU 141 Ca -0.16 -1.20 -0.58 0.00 -0.42 0.00 0.00 57.16 54.81 2grk n GLU 141 Cb 0.54 -1.22 -0.07 0.00 -0.57 0.00 0.00 31.44 30.12 2grk n GLU 141 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 2grk n GLU 142 N 0.62 0.98 -3.94 3.49 4.07 -1.26 -4.94 120.64 119.67 2grk n GLU 142 Ca 0.07 0.36 -0.30 0.00 -0.06 0.00 0.00 57.16 57.23 2grk n GLU 142 Cb 0.28 -2.01 -0.14 0.00 -0.06 0.00 0.00 31.44 29.52 2grk n GLU 142 CO 0.00 0.00 0.00 -1.21 -0.06 0.00 0.00 177.13 175.86 2grk s GLU 143 N 2.80 2.07 0.01 5.31 2.02 -1.26 -4.81 118.70 124.84 2grk s GLU 143 Ca 0.96 -2.77 -0.23 0.00 0.02 0.00 0.00 54.97 52.96 2grk s GLU 143 Cb -1.10 -3.33 0.05 0.00 0.10 0.00 0.00 34.13 29.85 2grk s GLU 143 CO 0.64 -1.15 0.51 -1.59 0.02 0.00 0.00 175.26 173.69 2grk s LYS 144 N -0.53 0.97 0.38 1.61 -2.85 -1.26 -5.14 119.74 112.91 2grk s LYS 144 Ca 0.19 -0.12 -0.27 0.00 -1.00 0.00 0.00 55.97 54.77 2grk s LYS 144 Cb -0.22 0.44 -0.11 0.00 -2.06 0.00 0.00 37.83 35.89 2grk s LYS 144 CO -0.03 -0.32 1.31 -0.25 0.10 0.00 0.00 175.35 176.15 2grk n ASP 145 N 0.69 2.81 -4.77 0.03 9.92 -1.26 -4.88 116.55 119.08 2grk n ASP 145 Ca -0.19 1.17 -0.41 0.00 -0.53 0.00 0.00 54.79 54.83 2grk n ASP 145 Cb 0.59 -1.51 -0.01 0.00 -0.64 0.00 0.00 41.12 39.55 2grk n ASP 145 CO 0.00 0.00 0.00 -0.44 0.13 0.00 0.00 177.20 176.89 2grk s SER 146 N -0.37 6.53 -0.73 -2.24 0.01 -1.26 -4.72 113.70 110.91 2grk s SER 146 Ca 0.57 2.88 -0.04 0.00 1.31 0.00 0.00 55.95 60.68 2grk s SER 146 Cb -0.53 -2.66 0.19 0.00 0.21 0.00 0.00 66.02 63.23 2grk s SER 146 CO 0.61 -0.73 0.58 0.21 0.41 0.00 0.00 173.24 174.32 2grk s ASN 147 N -0.23 5.66 0.09 2.44 3.04 0.11 -4.94 114.94 121.09 2grk s ASN 147 Ca 0.52 -3.07 0.02 0.00 0.04 0.00 0.00 52.86 50.37 2grk s ASN 147 Cb -0.44 -1.92 -0.04 0.00 -1.54 0.00 0.00 41.25 37.31 2grk s ASN 147 CO 0.58 -0.35 0.15 -0.63 -3.04 0.00 0.00 177.10 173.81 2grk s ILE 148 N -0.39 4.92 0.30 -5.21 1.01 -1.26 -3.50 121.20 117.07 2grk s ILE 148 Ca 0.20 -0.66 -0.07 0.00 0.00 0.00 0.00 60.65 60.12 2grk s ILE 148 Cb -0.15 -3.41 -0.06 0.00 0.01 0.00 0.00 42.46 38.84 2grk s ILE 148 CO -0.06 0.08 0.60 -0.54 0.00 0.00 0.00 174.94 175.01 2grk s LYS 149 N -2.60 3.70 0.20 2.79 1.02 -0.80 -4.98 119.74 119.07 2grk s LYS 149 Ca 0.32 0.15 0.01 0.00 0.02 0.00 0.00 55.97 56.47 2grk s LYS 149 Cb -0.12 -2.60 0.14 0.00 -0.52 0.00 0.00 37.83 34.73 2grk s LYS 149 CO 0.25 0.18 1.49 1.79 -0.92 0.00 0.00 175.35 178.14 2grk h THR 150 N 1.43 1.38 -3.95 2.17 1.35 -1.97 -3.44 112.91 109.89 2grk h THR 150 Ca -0.47 -2.05 -0.52 0.00 -0.55 0.00 0.00 66.41 62.82 2grk h THR 150 Cb 1.19 2.04 0.07 0.00 -1.73 0.00 0.00 68.15 69.71 2grk h THR 150 CO 0.66 0.61 0.56 -2.28 -0.25 0.00 0.00 175.52 174.82 2grk s HIS 151 N -3.71 2.93 0.72 4.73 5.04 -1.26 -5.00 115.29 118.75 2grk s HIS 151 Ca -0.05 1.48 -0.15 0.00 -1.54 0.00 0.00 55.06 54.81 2grk s HIS 151 Cb 0.11 -3.53 0.03 0.00 0.04 0.00 0.00 32.58 29.23 2grk s HIS 151 CO 0.82 -1.71 1.19 -2.14 -2.34 0.00 0.00 174.74 170.56 2grk s PRO 152 N -2.28 2.24 0.09 2.88 0.02 -1.26 -4.75 135.00 131.94 2grk s PRO 152 Ca 0.57 1.68 -0.31 0.00 0.02 0.00 0.00 61.00 62.97 2grk s PRO 152 Cb -0.34 -1.85 -0.07 0.00 0.02 0.00 0.00 34.50 32.25 2grk s PRO 152 CO 0.44 -1.74 1.40 0.08 -0.33 0.00 0.00 177.00 176.84 2grk s VAL 153 N -2.07 3.38 -0.24 3.83 1.01 -1.26 -4.98 120.40 120.08 2grk s VAL 153 Ca 0.73 0.96 -0.20 0.00 0.00 0.00 0.00 61.98 63.47 2grk s VAL 153 Cb -0.27 -3.62 -0.02 0.00 0.00 0.00 0.00 36.38 32.47 2grk s VAL 153 CO 0.45 0.06 0.60 -0.76 0.00 0.00 0.00 175.10 175.45 2grk s LEU 154 N 1.37 4.08 0.82 3.92 1.43 -1.26 -5.07 118.68 123.98 2grk s LEU 154 Ca 0.65 0.70 -0.07 0.00 -1.03 0.00 0.00 54.13 54.38 2grk s LEU 154 Cb -0.36 -2.82 0.16 0.00 0.03 0.00 0.00 46.19 43.20 2grk s LEU 154 CO 0.30 -0.32 1.12 -0.83 0.23 0.00 0.00 176.35 176.85 2grk s GLY 155 N 1.40 1.77 0.00 -3.19 0.00 -1.26 -4.77 107.32 101.27 2grk s GLY 155 Ca 0.26 -1.54 0.24 0.00 0.00 0.00 0.00 44.72 43.67 2grk s GLY 155 CO 0.09 -0.89 1.21 -1.14 0.00 0.00 0.00 173.10 172.37 2grk n SER 156 N -3.20 1.32 -3.88 1.64 3.41 -1.22 -1.98 113.62 109.71 2grk n SER 156 Ca 0.15 -1.06 -0.29 0.00 -0.26 0.00 0.00 58.87 57.41 2grk n SER 156 Cb 0.60 0.48 0.03 0.00 -0.26 0.00 0.00 64.21 65.07 2grk n SER 156 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2grk n ASN 157 N -0.74 -4.62 -3.82 4.04 5.15 -1.26 -4.22 115.26 109.79 2grk n ASN 157 Ca 0.08 -0.77 -0.29 0.00 -0.60 0.00 0.00 54.58 53.00 2grk n ASN 157 Cb 0.39 -3.96 -0.16 0.00 -0.53 0.00 0.00 39.78 35.52 2grk n ASN 157 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2grk s ILE 158 N -3.33 0.97 0.45 -1.44 1.01 -1.26 -4.64 121.20 112.96 2grk s ILE 158 Ca 0.61 -0.88 -0.21 0.00 0.00 0.00 0.00 60.65 60.17 2grk s ILE 158 Cb -0.30 -1.39 -0.10 0.00 0.01 0.00 0.00 42.46 40.68 2grk s ILE 158 CO 0.82 -0.19 0.98 -0.94 0.00 0.00 0.00 174.94 175.62 2grk s SER 159 N 1.65 6.72 -1.29 3.58 1.04 -1.26 -4.95 113.70 119.18 2grk s SER 159 Ca -0.03 1.78 -0.07 0.00 0.48 0.00 0.00 55.95 58.12 2grk s SER 159 Cb -0.18 -2.55 0.03 0.00 0.10 0.00 0.00 66.02 63.42 2grk s SER 159 CO -0.08 -0.52 2.66 1.41 0.98 0.00 0.00 173.24 177.69 2grk n HIS 160 N -0.75 2.35 -2.21 5.02 8.25 -1.26 -4.95 115.22 121.66 2grk n HIS 160 Ca 0.08 -2.78 -0.30 0.00 -0.26 0.00 0.00 57.72 54.46 2grk n HIS 160 Cb 0.53 -2.00 0.00 0.00 1.12 0.00 0.00 29.99 29.65 2grk n HIS 160 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 2grk s LYS 161 N -0.05 3.60 -0.56 -0.41 1.02 -1.26 -2.17 119.74 119.91 2grk s LYS 161 Ca 0.60 0.55 -0.05 0.00 0.02 0.00 0.00 55.97 57.09 2grk s LYS 161 Cb 0.20 -2.20 -0.10 0.00 -0.52 0.00 0.00 37.83 35.21 2grk s LYS 161 CO -0.09 -0.40 2.30 1.17 -0.92 0.00 0.00 175.35 177.41 2grk n LYS 162 N -2.46 1.82 -2.22 1.68 4.81 -1.26 -4.88 118.16 115.66 2grk n LYS 162 Ca 0.04 -1.14 -0.27 0.00 -0.87 0.00 0.00 58.31 56.07 2grk n LYS 162 Cb 0.54 -2.19 0.16 0.00 0.02 0.00 0.00 35.03 33.56 2grk n LYS 162 CO 0.00 0.00 0.00 0.14 1.17 0.00 0.00 177.40 178.71 2grk s VAL 163 N 2.61 2.03 0.13 3.15 -7.23 -1.26 -4.94 120.40 114.89 2grk s VAL 163 Ca 0.42 -0.26 -0.11 0.00 -1.81 0.00 0.00 61.98 60.23 2grk s VAL 163 Cb 0.15 -2.77 -0.07 0.00 0.56 0.00 0.00 36.38 34.24 2grk s VAL 163 CO -0.02 0.00 0.14 0.54 -0.31 0.00 0.00 175.10 175.45 2grk n ARG 164 N -3.41 0.00 -3.02 4.82 1.74 -1.18 -4.15 116.66 111.45 2grk n ARG 164 Ca 0.16 0.00 -0.36 0.00 -0.77 0.00 0.00 57.85 56.88 2grk n ARG 164 Cb 0.60 -0.44 -0.06 0.00 -1.02 0.00 0.00 32.46 31.54 2grk n ARG 164 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 2grk s TYR 165 N -0.58 3.60 -0.20 -1.55 5.04 -1.26 0.75 117.35 123.16 2grk s TYR 165 Ca 0.27 1.46 -0.09 0.00 -2.44 0.00 0.00 57.07 56.27 2grk s TYR 165 Cb -0.35 -2.69 0.08 0.00 0.35 0.00 0.00 41.96 39.35 2grk s TYR 165 CO 0.26 0.25 0.45 -2.00 -1.34 0.00 0.00 175.55 173.17 2grk s GLU 166 N -2.20 0.40 -0.47 4.97 2.56 -0.36 -4.74 118.70 118.86 2grk s GLU 166 Ca 0.47 0.96 -0.28 0.00 0.00 0.00 0.00 54.97 56.13 2grk s GLU 166 Cb -0.16 0.17 -0.01 0.00 2.00 0.00 0.00 34.13 36.13 2grk s GLU 166 CO 0.21 -0.20 1.74 0.34 -0.56 0.00 0.00 175.26 176.79 2grk s ASP 167 N 1.97 5.73 0.03 -1.70 2.15 -1.26 -4.44 116.67 119.15 2grk s ASP 167 Ca -0.06 0.76 0.00 0.00 0.43 0.00 0.00 52.55 53.68 2grk s ASP 167 Cb -0.10 -2.53 0.00 0.00 -0.30 0.00 0.00 42.92 39.99 2grk s ASP 167 CO -0.14 -1.94 0.00 -0.38 -0.17 0.00 0.00 175.17 172.55 2grk n ILE 168 N 7.24 0.33 -1.73 4.11 5.41 -1.26 -4.94 119.36 128.52 2grk n ILE 168 Ca 0.20 0.11 -0.42 0.00 1.00 0.00 0.00 62.75 63.64 2grk n ILE 168 Cb 0.49 -1.47 -0.03 0.00 -0.71 0.00 0.00 39.64 37.92 2grk n ILE 168 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 2grk s ILE 169 N -2.00 2.91 0.00 1.39 1.01 -1.26 -1.74 121.20 121.51 2grk s ILE 169 Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 60.65 60.78 2grk s ILE 169 Cb 0.00 -3.08 0.00 0.00 0.01 0.00 0.00 42.46 39.39 2grk s ILE 169 CO 0.00 -0.01 0.00 0.61 0.00 0.00 0.00 174.94 175.54 2grk n GLY 170 N 4.37 0.54 3.75 6.18 0.00 0.15 -4.89 105.19 115.28 2grk n GLY 170 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 2grk n GLY 170 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2grk s SER 171 N -1.00 6.97 -0.66 1.61 1.04 -1.26 -4.87 113.70 115.53 2grk s SER 171 Ca 0.00 2.39 0.05 0.00 0.48 0.00 0.00 55.95 58.88 2grk s SER 171 Cb 0.00 -2.62 0.20 0.00 0.10 0.00 0.00 66.02 63.70 2grk s SER 171 CO 0.00 -0.44 0.57 0.35 0.98 0.00 0.00 173.24 174.69 2grk n THR 172 N 2.11 1.61 -2.90 2.02 -2.24 -1.26 -0.12 114.28 113.51 2grk n THR 172 Ca 0.04 -4.86 -0.41 0.00 -2.27 0.00 0.00 64.05 56.55 2grk n THR 172 Cb 0.43 -2.12 -0.04 0.00 -2.10 0.00 0.00 70.33 66.50 2grk n THR 172 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2grk s ILE 173 N -1.68 4.91 0.10 2.28 -1.09 0.60 -4.96 121.20 121.35 2grk s ILE 173 Ca 0.30 1.64 0.06 0.00 -2.23 0.00 0.00 60.65 60.43 2grk s ILE 173 Cb 0.03 -4.14 -0.03 0.00 -1.58 0.00 0.00 42.46 36.74 2grk s ILE 173 CO -0.12 0.08 -0.17 0.68 -1.23 0.00 0.00 174.94 174.18 2grk s VAL 174 N 1.82 1.39 -0.48 2.92 -7.23 -1.26 -0.91 120.40 116.65 2grk s VAL 174 Ca 0.39 -1.49 -0.21 0.00 -1.81 0.00 0.00 61.98 58.87 2grk s VAL 174 Cb -0.17 -1.36 0.04 0.00 0.56 0.00 0.00 36.38 35.45 2grk s VAL 174 CO 0.15 -0.21 0.68 -0.62 -0.31 0.00 0.00 175.10 174.79 2grk s ASP 175 N -1.97 6.29 0.00 4.85 -1.08 -0.34 -4.92 116.67 119.50 2grk s ASP 175 Ca 0.04 -0.54 0.06 0.00 -0.52 0.00 0.00 52.55 51.59 2grk s ASP 175 Cb -0.09 -2.33 0.27 0.00 -1.46 0.00 0.00 42.92 39.31 2grk s ASP 175 CO 0.03 -0.88 1.17 2.30 0.52 0.00 0.00 175.17 178.31 2grk n ILE 176 N 5.82 1.46 -0.00 4.11 -5.35 -1.26 -1.30 119.36 122.84 2grk n ILE 176 Ca -0.03 0.36 -0.13 0.00 -0.27 0.00 0.00 62.75 62.69 2grk n ILE 176 Cb 0.47 -1.26 -0.10 0.00 -1.74 0.00 0.00 39.64 37.01 2grk n ILE 176 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 2grk h LYS 177 N 0.00 -0.02 0.00 6.28 3.64 -1.98 -3.38 116.57 121.11 2grk h LYS 177 Ca 0.00 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2grk h LYS 177 Cb 0.10 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 31.92 2grk h LYS 177 CO 0.00 0.42 -1.53 0.00 -2.27 0.00 0.00 179.45 176.07 2grk s VAL 179 N -2.81 4.70 0.00 0.00 1.01 -0.42 0.09 120.40 122.98 2grk s VAL 179 Ca -0.04 0.14 0.00 0.00 0.00 0.00 0.00 61.98 62.08 2grk s VAL 179 Cb 0.07 -4.32 0.00 0.00 0.00 0.00 0.00 36.38 32.14 2grk s VAL 179 CO 0.48 -0.76 0.00 1.17 0.00 0.00 0.00 175.10 175.99 2grk n LYS 180 N 6.60 0.00 -4.15 2.72 4.81 1.00 -4.57 118.16 124.56 2grk n LYS 180 Ca -0.01 0.21 -0.25 0.00 -0.87 0.00 0.00 58.31 57.39 2grk n LYS 180 Cb 0.47 -0.65 -0.07 0.00 0.02 0.00 0.00 35.03 34.81 2grk n LYS 180 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 2grk s ASP 181 N -2.33 4.42 -0.28 3.14 1.01 -0.55 -4.78 116.67 117.30 2grk s ASP 181 Ca 0.00 -1.14 -0.22 0.00 0.71 0.00 0.00 52.55 51.90 2grk s ASP 181 Cb 0.00 -0.32 0.09 0.00 1.01 0.00 0.00 42.92 43.70 2grk s ASP 181 CO 0.00 -0.62 0.82 -0.22 0.21 0.00 0.00 175.17 175.36 2grk s LEU 182 N -3.94 -0.70 -0.06 1.23 0.20 0.13 -1.18 118.68 114.37 2grk s LEU 182 Ca 0.38 1.26 0.02 0.00 0.69 0.00 0.00 54.13 56.47 2grk s LEU 182 Cb 0.03 2.23 0.02 0.00 -0.43 0.00 0.00 46.19 48.04 2grk s LEU 182 CO 0.21 -0.21 -0.09 -1.61 -0.29 0.00 0.00 176.35 174.36 2grk s GLU 183 N 0.74 1.33 0.04 1.98 2.02 0.12 -0.26 118.70 124.67 2grk s GLU 183 Ca -0.02 -0.28 0.03 0.00 0.02 0.00 0.00 54.97 54.71 2grk s GLU 183 Cb -0.05 -1.17 -0.02 0.00 0.10 0.00 0.00 34.13 32.99 2grk s GLU 183 CO -0.07 -0.02 -0.08 0.12 0.02 0.00 0.00 175.26 175.22 2grk s PHE 184 N 0.78 0.72 -0.15 1.61 5.36 -1.10 -0.45 117.98 124.75 2grk s PHE 184 Ca -0.13 -0.41 -0.08 0.00 -0.96 0.00 0.00 56.93 55.34 2grk s PHE 184 Cb -0.15 -0.43 0.05 0.00 -0.34 0.00 0.00 43.02 42.15 2grk s PHE 184 CO 0.02 -0.05 0.36 0.45 -1.46 0.00 0.00 175.22 174.54 2grk s SER 185 N -1.31 -0.44 -0.06 6.13 0.15 -0.30 -2.15 113.70 115.72 2grk s SER 185 Ca -0.06 0.78 0.06 0.00 0.70 0.00 0.00 55.95 57.42 2grk s SER 185 Cb -0.08 0.67 -0.01 0.00 -1.71 0.00 0.00 66.02 64.88 2grk s SER 185 CO 0.01 -0.18 -0.24 -0.69 1.20 0.00 0.00 173.24 173.33 2grk s VAL 186 N 1.30 1.99 0.03 4.45 1.01 -0.12 -0.99 120.40 128.07 2grk s VAL 186 Ca -0.09 -1.03 0.05 0.00 0.00 0.00 0.00 61.98 60.91 2grk s VAL 186 Cb -0.09 -1.69 -0.02 0.00 0.00 0.00 0.00 36.38 34.58 2grk s VAL 186 CO -0.11 0.55 -0.14 -0.13 0.00 0.00 0.00 175.10 175.27 2grk s ARG 187 N -0.08 0.96 -0.11 2.72 1.81 0.20 -1.98 118.95 122.47 2grk s ARG 187 Ca -0.05 -0.73 -0.03 0.00 -1.72 0.00 0.00 55.73 53.19 2grk s ARG 187 Cb -0.14 -0.96 0.04 0.00 -0.45 0.00 0.00 34.95 33.44 2grk s ARG 187 CO 0.04 0.24 0.06 0.42 -0.68 0.00 0.00 175.30 175.38 2grk s ILE 188 N -0.80 0.03 0.00 1.52 1.01 -0.82 0.04 121.20 122.18 2grk s ILE 188 Ca 0.02 0.07 0.00 0.00 0.00 0.00 0.00 60.65 60.74 2grk s ILE 188 Cb -0.08 -0.45 0.00 0.00 0.01 0.00 0.00 42.46 41.95 2grk s ILE 188 CO 0.01 -0.02 0.00 0.61 0.00 0.00 0.00 174.94 175.54 2grk n GLY 189 N 5.25 2.33 3.62 6.18 0.00 -0.94 -1.98 105.19 119.64 2grk n GLY 189 Ca -0.06 -1.06 -0.42 0.00 0.00 0.00 0.00 46.02 44.48 2grk n GLY 189 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2grk s ASP 190 N -0.73 6.71 0.00 1.61 -1.08 -1.26 -1.50 116.67 120.41 2grk s ASP 190 Ca 0.00 0.71 0.15 0.00 -0.52 0.00 0.00 52.55 52.89 2grk s ASP 190 Cb 0.00 -2.43 0.87 0.00 -1.46 0.00 0.00 42.92 39.90 2grk s ASP 190 CO 0.00 -0.68 1.32 0.23 0.52 0.00 0.00 175.17 176.56 2grk n MET 191 N 6.36 0.44 -0.08 4.34 2.81 -0.33 -3.00 117.12 127.66 2grk n MET 191 Ca 0.05 0.02 -0.12 0.00 -1.81 0.00 0.00 57.70 55.84 2grk n MET 191 Cb 0.48 -1.50 -0.07 0.00 -0.71 0.00 0.00 33.22 31.41 2grk n MET 191 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2grk s LYS 193 N -2.33 0.36 0.26 0.00 2.20 -1.16 -5.11 119.74 113.96 2grk s LYS 193 Ca -0.22 0.69 -0.28 0.00 -0.36 0.00 0.00 55.97 55.80 2grk s LYS 193 Cb 0.06 0.18 -0.15 0.00 -1.51 0.00 0.00 37.83 36.41 2grk s LYS 193 CO 0.37 -0.09 0.89 0.39 -0.36 0.00 0.00 175.35 176.56 2grk n GLU 194 N 4.07 0.99 -4.01 4.03 1.02 -1.26 -4.51 120.64 120.96 2grk n GLU 194 Ca -0.16 0.35 -0.34 0.00 -0.02 0.00 0.00 57.16 56.99 2grk n GLU 194 Cb 0.56 -1.63 -0.15 0.00 -0.02 0.00 0.00 31.44 30.20 2grk n GLU 194 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2grk s ALA 195 N -0.99 2.58 0.63 0.62 0.00 -1.26 -4.99 121.76 118.36 2grk s ALA 195 Ca 0.61 -1.35 0.16 0.00 0.00 0.00 0.00 51.96 51.38 2grk s ALA 195 Cb -0.77 -1.51 0.65 0.00 0.00 0.00 0.00 23.12 21.49 2grk s ALA 195 CO 0.58 -0.62 1.28 0.66 0.00 0.00 0.00 175.76 177.66 2grk h SER 196 N 7.98 0.00 -0.00 0.00 4.64 -1.98 0.72 113.55 124.91 2grk h SER 196 Ca -0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 2grk h SER 196 Cb 1.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.21 2grk h SER 196 CO 0.59 0.00 -0.07 -0.62 -0.87 0.00 0.00 176.83 175.86 2grk n GLU 197 N -2.95 2.29 -1.40 4.77 1.02 -1.26 -4.71 120.64 118.40 2grk n GLU 197 Ca 0.10 -0.41 -0.11 0.00 -0.02 0.00 0.00 57.16 56.72 2grk n GLU 197 Cb 1.14 -0.89 0.10 0.00 -0.02 0.00 0.00 31.44 31.77 2grk n GLU 197 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2grk n LEU 198 N -0.35 4.01 -3.86 -4.62 4.77 0.24 -4.92 117.00 112.27 2grk n LEU 198 Ca 0.01 -4.38 -0.30 0.00 -0.03 0.00 0.00 56.01 51.31 2grk n LEU 198 Cb 0.07 -0.43 -0.15 0.00 -2.33 0.00 0.00 43.42 40.59 2grk n LEU 198 CO 0.04 1.80 -0.31 -1.61 -1.33 0.00 0.00 177.39 175.99 2grk s GLU 199 N -3.45 1.20 0.14 3.23 0.41 -1.21 -3.96 118.70 115.06 2grk s GLU 199 Ca 0.46 -1.65 0.09 0.00 -0.41 0.00 0.00 54.97 53.46 2grk s GLU 199 Cb 0.39 -2.63 -0.04 0.00 -1.78 0.00 0.00 34.13 30.07 2grk s GLU 199 CO -0.01 -1.00 -0.18 0.14 -0.49 0.00 0.00 175.26 173.72 2grk s VAL 200 N 1.00 2.81 0.26 2.63 -7.23 -0.84 -3.13 120.40 115.91 2grk s VAL 200 Ca 0.12 -1.63 0.01 0.00 -1.81 0.00 0.00 61.98 58.68 2grk s VAL 200 Cb -0.20 -2.32 -0.05 0.00 0.56 0.00 0.00 36.38 34.37 2grk s VAL 200 CO -0.13 0.03 0.09 -0.75 -0.31 0.00 0.00 175.10 174.03 2grk s LYS 201 N -2.35 1.41 -0.01 4.82 2.20 0.23 -1.94 119.74 124.09 2grk s LYS 201 Ca 0.20 -1.76 -0.30 0.00 -0.36 0.00 0.00 55.97 53.75 2grk s LYS 201 Cb -0.10 -0.30 0.10 0.00 -1.51 0.00 0.00 37.83 36.03 2grk s LYS 201 CO 0.11 -0.28 1.07 0.34 -0.36 0.00 0.00 175.35 176.23 2grk s ASP 202 N -3.32 -0.20 0.00 1.43 -1.08 -0.84 -1.22 116.67 111.45 2grk s ASP 202 Ca 0.37 -0.13 0.00 0.00 -0.52 0.00 0.00 52.55 52.27 2grk s ASP 202 Cb 0.08 0.31 0.00 0.00 -1.46 0.00 0.00 42.92 41.84 2grk s ASP 202 CO 0.13 -0.53 0.00 0.61 0.52 0.00 0.00 175.17 175.90 2grk n GLY 203 N -0.32 1.98 3.48 2.66 0.00 -1.20 -0.95 105.19 110.84 2grk n GLY 203 Ca -0.06 -1.02 -0.14 0.00 0.00 0.00 0.00 46.02 44.80 2grk n GLY 203 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2grk s PHE 204 N -2.00 -0.62 -0.25 1.61 -0.71 -0.91 -3.16 117.98 111.93 2grk s PHE 204 Ca 0.00 1.45 -0.10 0.00 -1.04 0.00 0.00 56.93 57.24 2grk s PHE 204 Cb 0.00 0.24 -0.05 0.00 -1.21 0.00 0.00 43.02 42.00 2grk s PHE 204 CO 0.00 -0.35 0.15 0.15 -1.34 0.00 0.00 175.22 173.83 2grk s LYS 205 N 0.04 3.94 -0.37 1.99 3.01 0.15 -2.69 119.74 125.81 2grk s LYS 205 Ca -0.02 -0.33 -0.01 0.00 -1.01 0.00 0.00 55.97 54.60 2grk s LYS 205 Cb -0.04 -3.52 0.10 0.00 -1.01 0.00 0.00 37.83 33.36 2grk s LYS 205 CO 0.02 -0.06 0.13 -0.47 0.51 0.00 0.00 175.35 175.48 2grk s TYR 206 N 1.36 3.60 -0.01 3.18 5.04 0.64 -0.52 117.35 130.64 2grk s TYR 206 Ca 0.07 -2.52 0.00 0.00 -2.44 0.00 0.00 57.07 52.18 2grk s TYR 206 Cb -0.15 -2.98 0.02 0.00 0.35 0.00 0.00 41.96 39.20 2grk s TYR 206 CO 0.06 -0.94 0.00 0.42 -1.34 0.00 0.00 175.55 173.75 2grk s ILE 207 N 1.08 0.09 -1.38 3.14 1.01 -0.86 -0.69 121.20 123.58 2grk s ILE 207 Ca 0.07 0.06 -0.05 0.00 0.00 0.00 0.00 60.65 60.72 2grk s ILE 207 Cb -0.21 -0.15 0.03 0.00 0.01 0.00 0.00 42.46 42.14 2grk s ILE 207 CO -0.05 0.08 0.42 0.47 0.00 0.00 0.00 174.94 175.87 2grk n ASP 208 N 3.67 -4.79 0.00 3.58 9.92 -1.26 -1.21 116.55 126.46 2grk n ASP 208 Ca -0.21 -0.23 0.00 0.00 -0.53 0.00 0.00 54.79 53.82 2grk n ASP 208 Cb 0.54 -3.93 0.00 0.00 -0.64 0.00 0.00 41.12 37.09 2grk n ASP 208 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2grk n GLY 209 N -1.24 3.11 3.63 0.44 0.00 -1.26 -5.01 105.19 104.86 2grk n GLY 209 Ca -0.09 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.53 2grk n GLY 209 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2grk s SER 210 N -0.67 6.56 -0.14 1.61 0.01 -0.35 -5.05 113.70 115.65 2grk s SER 210 Ca 0.00 0.68 -0.16 0.00 1.31 0.00 0.00 55.95 57.77 2grk s SER 210 Cb 0.00 -2.32 -0.04 0.00 0.21 0.00 0.00 66.02 63.87 2grk s SER 210 CO 0.00 -0.31 0.40 -0.69 0.41 0.00 0.00 173.24 173.05 2grk s VAL 211 N 2.25 5.23 -0.06 3.43 1.01 -1.26 -2.04 120.40 128.96 2grk s VAL 211 Ca 0.25 0.78 0.01 0.00 0.00 0.00 0.00 61.98 63.02 2grk s VAL 211 Cb -0.16 -3.74 0.02 0.00 0.00 0.00 0.00 36.38 32.50 2grk s VAL 211 CO 0.09 0.34 -0.08 -0.94 0.00 0.00 0.00 175.10 174.51 2grk s SER 212 N 0.63 1.49 0.07 3.32 1.04 0.32 -4.98 113.70 115.59 2grk s SER 212 Ca 0.22 -0.22 0.00 0.00 0.48 0.00 0.00 55.95 56.43 2grk s SER 212 Cb -0.14 -0.65 0.00 0.00 0.10 0.00 0.00 66.02 65.33 2grk s SER 212 CO 0.08 -0.04 0.02 -0.62 0.98 0.00 0.00 173.24 173.66 2grk n GLU 213 N 4.17 1.65 0.00 4.02 1.02 -1.26 0.30 120.64 130.53 2grk n GLU 213 Ca -0.21 -0.47 0.00 0.00 -0.02 0.00 0.00 57.16 56.46 2grk n GLU 213 Cb 0.51 0.10 0.00 0.00 -0.02 0.00 0.00 31.44 32.03 2grk n GLU 213 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2grk n GLY 214 N 4.17 -0.24 3.46 0.62 0.00 -1.19 -4.96 105.19 107.05 2grk n GLY 214 Ca -0.02 -2.00 -0.31 0.00 0.00 0.00 0.00 46.02 43.70 2grk n GLY 214 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2grk s ALA 215 N -2.00 2.60 0.25 4.61 0.00 -1.26 -3.25 121.76 122.71 2grk s ALA 215 Ca 0.00 -1.15 -0.21 0.00 0.00 0.00 0.00 51.96 50.59 2grk s ALA 215 Cb 0.00 -0.78 0.05 0.00 0.00 0.00 0.00 23.12 22.39 2grk s ALA 215 CO 0.00 0.57 0.86 -0.08 0.00 0.00 0.00 175.76 177.11 2grk s THR 216 N -0.89 0.00 -0.07 0.00 -1.32 -1.26 -5.09 115.64 107.02 2grk s THR 216 Ca 0.14 -0.83 -0.21 0.00 -1.21 0.00 0.00 61.69 59.58 2grk s THR 216 Cb -0.11 -2.32 -0.04 0.00 -1.51 0.00 0.00 72.50 68.53 2grk s THR 216 CO 0.04 0.00 0.59 -0.62 -2.21 0.00 0.00 174.62 172.42 2grk s ASP 217 N -3.03 6.87 -0.24 8.08 2.15 -1.26 -4.24 116.67 125.00 2grk s ASP 217 Ca 0.14 1.04 0.18 0.00 0.43 0.00 0.00 52.55 54.34 2grk s ASP 217 Cb -0.04 -2.35 0.48 0.00 -0.30 0.00 0.00 42.92 40.71 2grk s ASP 217 CO 0.06 -0.01 1.15 0.47 -0.17 0.00 0.00 175.17 176.67 2grk n ASP 218 N 3.41 2.51 0.07 -0.34 8.00 -0.92 -4.80 116.55 124.48 2grk n ASP 218 Ca -0.05 -2.65 0.13 0.00 0.71 0.00 0.00 54.79 52.93 2grk n ASP 218 Cb 0.51 -0.42 0.48 0.00 -0.02 0.00 0.00 41.12 41.68 2grk n ASP 218 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 2grk n THR 219 N -0.54 0.40 -0.39 -3.53 -2.24 -1.23 -3.18 114.28 103.57 2grk n THR 219 Ca 0.19 -0.16 0.05 0.00 -2.27 0.00 0.00 64.05 61.85 2grk n THR 219 Cb 0.88 -0.58 0.10 0.00 -2.10 0.00 0.00 70.33 68.63 2grk n THR 219 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2grk n SER 220 N -1.97 2.54 -0.07 3.42 7.64 -1.26 -4.68 113.62 119.23 2grk n SER 220 Ca 0.06 -2.36 -0.10 0.00 1.01 0.00 0.00 58.87 57.49 2grk n SER 220 Cb 0.39 -0.22 -0.03 0.00 -1.01 0.00 0.00 64.21 63.34 2grk n SER 220 CO 0.00 0.00 0.00 0.25 -3.01 0.00 0.00 175.04 172.28 2grk h LEU 221 N 0.72 0.32 -8.72 -3.43 5.85 -1.89 -3.44 115.31 104.73 2grk h LEU 221 Ca 0.00 -0.09 -0.35 0.00 0.84 0.00 0.00 57.88 58.28 2grk h LEU 221 Cb 0.78 -0.08 -0.15 0.00 0.37 0.00 0.00 40.66 41.58 2grk h LEU 221 CO 0.03 0.32 -0.71 0.27 -0.34 0.00 0.00 178.44 178.01 2grk s ILE 222 N -5.86 1.23 -0.67 4.05 -4.36 -1.26 -4.99 121.20 109.33 2grk s ILE 222 Ca -0.13 -2.08 -0.18 0.00 -0.26 0.00 0.00 60.65 58.00 2grk s ILE 222 Cb 0.09 -1.94 0.12 0.00 1.25 0.00 0.00 42.46 41.97 2grk s ILE 222 CO 0.71 -0.67 0.78 -0.62 0.24 0.00 0.00 174.94 175.38 2grk s ASP 223 N -3.21 6.32 0.48 4.36 -1.08 -1.26 -4.92 116.67 117.36 2grk s ASP 223 Ca 0.19 -1.67 0.13 0.00 -0.52 0.00 0.00 52.55 50.67 2grk s ASP 223 Cb 0.03 -2.31 1.12 0.00 -1.46 0.00 0.00 42.92 40.29 2grk s ASP 223 CO 0.02 -1.05 2.12 0.28 0.52 0.00 0.00 175.17 177.06 2grk h SER 224 N 8.97 0.18 -0.15 -0.34 0.02 -1.98 -1.76 113.55 118.49 2grk h SER 224 Ca -0.18 -0.00 0.04 0.00 -0.84 0.00 0.00 61.79 60.81 2grk h SER 224 Cb 1.07 -0.04 -0.01 0.00 0.14 0.00 0.00 62.40 63.56 2grk h SER 224 CO 1.06 0.13 0.12 0.71 -1.14 0.00 0.00 176.83 177.71 2grk h THR 225 N 0.21 0.79 0.00 -2.27 1.35 -2.03 -0.38 112.91 110.58 2grk h THR 225 Ca 0.06 0.00 -0.16 0.00 -0.55 0.00 0.00 66.41 65.76 2grk h THR 225 Cb -0.02 0.92 -0.02 0.00 -1.73 0.00 0.00 68.15 67.29 2grk h THR 225 CO -0.01 0.00 -0.76 0.11 -0.25 0.00 0.00 175.52 174.61 2grk h LYS 226 N 0.00 0.00 -6.44 4.72 1.57 -1.73 -3.46 116.57 111.22 2grk h LYS 226 Ca 0.07 0.00 -0.60 0.00 -1.87 0.00 0.00 60.65 58.25 2grk h LYS 226 Cb 0.30 0.00 0.14 0.00 0.08 0.00 0.00 32.23 32.76 2grk h LYS 226 CO -0.00 0.76 -0.22 1.28 -0.57 0.00 0.00 179.45 180.70 2grk n LEU 227 N -3.43 0.91 -3.94 2.94 4.77 -0.15 -4.78 117.00 113.32 2grk n LEU 227 Ca 0.00 0.94 -0.26 0.00 -0.03 0.00 0.00 56.01 56.66 2grk n LEU 227 Cb 0.79 -1.19 -0.17 0.00 -2.33 0.00 0.00 43.42 40.52 2grk n LEU 227 CO 0.44 -2.45 -0.45 -0.54 -1.33 0.00 0.00 177.39 173.06 2grk s LYS 228 N -1.77 1.53 0.12 3.23 -0.14 0.15 -4.84 119.74 118.01 2grk s LYS 228 Ca 0.64 -0.29 -0.32 0.00 -1.36 0.00 0.00 55.97 54.64 2grk s LYS 228 Cb -0.58 -1.48 -0.11 0.00 -1.68 0.00 0.00 37.83 33.97 2grk s LYS 228 CO 0.57 -0.17 1.79 0.00 -0.76 0.00 0.00 175.35 176.78 2grk n ALA 229 N 4.54 1.99 -1.00 5.17 0.00 -1.26 -0.94 120.51 129.01 2grk n ALA 229 Ca -0.16 0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.62 2grk n ALA 229 Cb 0.51 -2.54 0.00 0.00 0.00 0.00 0.00 19.45 17.42 2grk n ALA 229 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2grk h VAL 231 N -0.76 0.62 -3.30 0.00 2.07 -1.82 -3.38 116.25 109.69 2grk h VAL 231 Ca 0.00 -0.30 -0.59 0.00 0.82 0.00 0.00 66.70 66.63 2grk h VAL 231 Cb 0.00 1.19 -0.11 0.00 -1.52 0.00 0.00 31.29 30.85 2grk h VAL 231 CO 0.00 0.07 -0.35 -0.83 0.02 0.00 0.00 177.57 176.48 2grk s GLY 232 N -4.15 2.17 0.00 2.17 0.00 -1.26 -5.04 107.32 101.21 2grk s GLY 232 Ca -0.04 -0.50 0.00 0.00 0.00 0.00 0.00 44.72 44.18 2grk s GLY 232 CO 0.58 0.40 0.00 -1.14 0.00 0.00 0.00 173.10 172.95 2grk n SER 233 N 3.63 0.00 -3.92 1.64 3.41 -1.26 -4.00 113.62 113.12 2grk n SER 233 Ca -0.12 0.00 -0.19 0.00 -0.26 0.00 0.00 58.87 58.30 2grk n SER 233 Cb 0.52 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.38 2grk n SER 233 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2grk s LEU 234 N 0.00 1.68 0.00 1.04 1.02 -1.26 -5.10 118.68 116.05 2grk s LEU 234 Ca 0.00 -1.58 0.02 0.00 0.02 0.00 0.00 54.13 52.58 2grk s LEU 234 Cb 0.00 0.24 0.01 0.00 0.02 0.00 0.00 46.19 46.46 2grk s LEU 234 CO 0.00 -0.91 0.55 0.52 0.02 0.00 0.00 176.35 176.53