#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1grw n VAL 4 N 0.00 0.56 -1.77 -3.33 0.24 -1.26 -5.05 118.33 107.73 1grw n VAL 4 Ca 0.00 -0.14 -0.37 0.00 -2.04 0.00 0.00 64.34 61.79 1grw n VAL 4 Cb 0.00 0.00 0.06 0.00 -1.47 0.00 0.00 33.84 32.43 1grw n VAL 4 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 1grw s PRO 5 N -0.28 2.69 0.40 7.34 0.04 -1.26 -4.83 135.00 139.11 1grw s PRO 5 Ca 0.40 2.09 -0.26 0.00 0.04 0.00 0.00 61.00 63.27 1grw s PRO 5 Cb -0.57 -1.93 -0.09 0.00 0.04 0.00 0.00 34.50 31.95 1grw s PRO 5 CO 0.30 -1.50 1.32 -2.14 0.04 0.00 0.00 177.00 175.02 1grw s PRO 6 N -3.28 3.96 0.00 0.56 0.02 -1.26 -4.91 135.00 130.09 1grw s PRO 6 Ca 0.80 2.20 0.00 0.00 0.02 0.00 0.00 61.00 64.03 1grw s PRO 6 Cb -0.38 -2.77 0.00 0.00 0.02 0.00 0.00 34.50 31.37 1grw s PRO 6 CO 0.41 -0.51 0.00 0.41 -0.33 0.00 0.00 177.00 176.98 1grw n GLY 7 N 0.66 -1.50 3.86 0.52 0.00 -1.26 -5.02 105.19 102.45 1grw n GLY 7 Ca 0.03 -1.60 -0.35 0.00 0.00 0.00 0.00 46.02 44.11 1grw n GLY 7 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1grw s ASP 8 N -1.15 6.69 0.42 1.61 1.11 -1.26 -4.95 116.67 119.14 1grw s ASP 8 Ca 0.00 0.87 0.07 0.00 0.18 0.00 0.00 52.55 53.67 1grw s ASP 8 Cb 0.00 -2.21 -0.05 0.00 1.07 0.00 0.00 42.92 41.74 1grw s ASP 8 CO 0.00 0.13 0.19 0.27 1.18 0.00 0.00 175.17 176.94 1grw s ILE 9 N -1.46 2.23 -0.02 0.77 -4.36 -1.26 -2.83 121.20 114.27 1grw s ILE 9 Ca 0.36 -1.69 0.05 0.00 -0.26 0.00 0.00 60.65 59.11 1grw s ILE 9 Cb -0.14 -2.92 -0.01 0.00 1.25 0.00 0.00 42.46 40.64 1grw s ILE 9 CO 0.19 0.00 -0.18 -1.10 0.24 0.00 0.00 174.94 174.08 1grw s GLN 10 N -3.93 1.61 0.20 0.37 -0.21 -0.27 -4.86 119.66 112.57 1grw s GLN 10 Ca 0.40 -0.66 0.10 0.00 0.02 0.00 0.00 55.36 55.22 1grw s GLN 10 Cb 0.03 -1.50 -0.04 0.00 1.00 0.00 0.00 33.01 32.50 1grw s GLN 10 CO 0.22 0.36 -0.20 0.95 -2.12 0.00 0.00 175.29 174.50 1grw s THR 11 N -0.31 2.13 -0.15 -0.19 -4.23 -1.26 -0.74 115.64 110.88 1grw s THR 11 Ca 0.04 -2.06 -0.03 0.00 -1.18 0.00 0.00 61.69 58.45 1grw s THR 11 Cb -0.08 -2.04 0.05 0.00 1.34 0.00 0.00 72.50 71.77 1grw s THR 11 CO 0.00 -0.27 0.06 -1.10 -0.54 0.00 0.00 174.62 172.77 1grw s GLN 12 N -2.92 0.30 0.68 3.99 -0.21 -0.42 -2.45 119.66 118.63 1grw s GLN 12 Ca 0.20 -0.11 -0.15 0.00 0.02 0.00 0.00 55.36 55.33 1grw s GLN 12 Cb -0.06 -1.65 0.01 0.00 1.00 0.00 0.00 33.01 32.31 1grw s GLN 12 CO 0.09 -0.57 1.12 -2.14 -2.12 0.00 0.00 175.29 171.67 1grw s PRO 13 N 2.03 2.64 0.33 2.91 0.02 -1.26 0.31 135.00 141.99 1grw s PRO 13 Ca 0.02 1.42 0.24 0.00 0.02 0.00 0.00 61.00 62.69 1grw s PRO 13 Cb -0.15 -1.93 0.37 0.00 0.02 0.00 0.00 34.50 32.81 1grw s PRO 13 CO -0.07 -1.38 1.52 0.78 -0.33 0.00 0.00 177.00 177.52 1grw h GLY 14 N -0.14 0.00 0.00 0.52 0.00 -1.89 -3.41 103.07 98.15 1grw h GLY 14 Ca -0.47 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.86 1grw h GLY 14 CO 0.53 0.00 -0.44 -1.30 0.00 0.00 0.00 176.54 175.33 1grw n THR 15 N -2.79 0.00 -3.81 4.70 -2.24 -1.26 -4.83 114.28 104.05 1grw n THR 15 Ca 0.04 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.80 1grw n THR 15 Cb 0.51 0.21 0.00 0.00 -2.10 0.00 0.00 70.33 68.95 1grw n THR 15 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 1grw s LYS 16 N -0.88 0.91 -0.05 -0.78 -2.85 -1.26 -4.27 119.74 110.56 1grw s LYS 16 Ca 0.00 -0.55 0.01 0.00 -1.00 0.00 0.00 55.97 54.43 1grw s LYS 16 Cb 0.00 0.28 0.02 0.00 -2.06 0.00 0.00 37.83 36.07 1grw s LYS 16 CO 0.00 -0.42 -0.06 -1.50 0.10 0.00 0.00 175.35 173.46 1grw s ILE 17 N -2.46 0.66 -0.21 3.79 2.07 -0.89 -4.63 121.20 119.53 1grw s ILE 17 Ca 0.19 -0.21 -0.08 0.00 -1.41 0.00 0.00 60.65 59.14 1grw s ILE 17 Cb -0.00 -0.66 -0.04 0.00 0.13 0.00 0.00 42.46 41.89 1grw s ILE 17 CO 0.01 0.25 0.08 -0.69 -1.91 0.00 0.00 174.94 172.69 1grw s VAL 18 N 0.81 4.81 -0.23 4.00 1.01 -1.26 -1.00 120.40 128.53 1grw s VAL 18 Ca -0.12 -0.02 -0.09 0.00 0.00 0.00 0.00 61.98 61.75 1grw s VAL 18 Cb -0.14 -3.20 -0.05 0.00 0.00 0.00 0.00 36.38 32.99 1grw s VAL 18 CO 0.01 0.41 0.13 -0.36 0.00 0.00 0.00 175.10 175.29 1grw s PHE 19 N 0.78 3.27 0.01 5.22 0.08 0.39 -4.94 117.98 122.78 1grw s PHE 19 Ca 0.04 0.11 -0.19 0.00 0.12 0.00 0.00 56.93 57.02 1grw s PHE 19 Cb -0.13 -2.23 -0.06 0.00 -0.57 0.00 0.00 43.02 40.03 1grw s PHE 19 CO 0.02 0.02 0.54 -0.80 -0.10 0.00 0.00 175.22 174.90 1grw s ASN 20 N 1.01 6.94 1.09 1.36 0.01 -1.26 -1.32 114.94 122.77 1grw s ASN 20 Ca 0.06 1.11 -0.13 0.00 -0.71 0.00 0.00 52.86 53.20 1grw s ASN 20 Cb -0.14 -2.33 0.24 0.00 0.41 0.00 0.00 41.25 39.43 1grw s ASN 20 CO 0.04 0.18 1.06 0.00 -1.51 0.00 0.00 177.10 176.87 1grw s ALA 21 N -0.53 0.14 0.51 0.60 0.00 0.11 -4.72 121.76 117.87 1grw s ALA 21 Ca 0.28 -0.19 -0.22 0.00 0.00 0.00 0.00 51.96 51.83 1grw s ALA 21 Cb -0.18 -3.20 -0.06 0.00 0.00 0.00 0.00 23.12 19.68 1grw s ALA 21 CO 0.16 -3.42 1.29 -1.25 0.00 0.00 0.00 175.76 172.55 1grw s PRO 22 N -4.66 3.39 -0.41 0.00 0.04 -1.26 -5.00 135.00 127.10 1grw s PRO 22 Ca 0.67 2.09 0.05 0.00 0.04 0.00 0.00 61.00 63.84 1grw s PRO 22 Cb -0.22 -2.34 0.49 0.00 0.04 0.00 0.00 34.50 32.47 1grw s PRO 22 CO 0.62 -0.94 1.58 0.66 0.04 0.00 0.00 177.00 178.95 1grw n TYR 23 N -0.78 2.35 -0.55 0.56 4.01 -1.26 -4.40 117.16 117.09 1grw n TYR 23 Ca 0.09 -2.22 0.07 0.00 -0.16 0.00 0.00 57.90 55.68 1grw n TYR 23 Cb 0.46 -0.75 0.20 0.00 -0.31 0.00 0.00 39.34 38.94 1grw n TYR 23 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 1grw n ASP 24 N -0.94 3.37 -3.89 7.72 5.75 -1.26 -0.81 116.55 126.48 1grw n ASP 24 Ca 0.47 -2.46 -0.09 0.00 -0.01 0.00 0.00 54.79 52.70 1grw n ASP 24 Cb 0.96 -0.37 -0.07 0.00 -1.03 0.00 0.00 41.12 40.61 1grw n ASP 24 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1grw s ASP 25 N -1.42 0.12 -0.03 -1.12 -1.08 -1.26 -4.81 116.67 107.07 1grw s ASP 25 Ca 0.32 -0.71 -0.26 0.00 -0.52 0.00 0.00 52.55 51.38 1grw s ASP 25 Cb 0.22 0.35 -0.04 0.00 -1.46 0.00 0.00 42.92 42.00 1grw s ASP 25 CO 0.13 -0.76 0.80 -0.75 0.52 0.00 0.00 175.17 175.11 1grw s LYS 26 N -3.89 4.49 -0.07 4.34 2.20 -1.26 -3.25 119.74 122.30 1grw s LYS 26 Ca 0.08 1.08 0.02 0.00 -0.36 0.00 0.00 55.97 56.79 1grw s LYS 26 Cb 0.05 -3.44 -0.02 0.00 -1.51 0.00 0.00 37.83 32.91 1grw s LYS 26 CO -0.09 0.07 -0.13 -1.01 -0.36 0.00 0.00 175.35 173.83 1grw s HIS 27 N 0.71 2.76 -0.23 4.03 3.76 -0.35 -4.94 115.29 121.04 1grw s HIS 27 Ca 0.42 -0.26 -0.04 0.00 -0.15 0.00 0.00 55.06 55.03 1grw s HIS 27 Cb -0.19 -1.70 -0.01 0.00 1.11 0.00 0.00 32.58 31.80 1grw s HIS 27 CO 0.22 0.10 -0.02 0.99 -0.85 0.00 0.00 174.74 175.18 1grw s THR 28 N -0.45 3.50 0.40 1.30 2.01 -1.26 -0.80 115.64 120.33 1grw s THR 28 Ca 0.06 -0.53 0.08 0.00 0.31 0.00 0.00 61.69 61.61 1grw s THR 28 Cb -0.12 -2.64 -0.03 0.00 0.01 0.00 0.00 72.50 69.72 1grw s THR 28 CO 0.02 0.35 0.29 -0.31 -0.69 0.00 0.00 174.62 174.28 1grw s TYR 29 N 1.48 2.70 0.00 4.92 1.51 0.15 -4.92 117.35 123.19 1grw s TYR 29 Ca 0.05 -0.49 0.04 0.00 -1.01 0.00 0.00 57.07 55.67 1grw s TYR 29 Cb -0.15 -2.02 -0.01 0.00 -0.11 0.00 0.00 41.96 39.67 1grw s TYR 29 CO -0.02 0.05 -0.14 -1.01 -1.11 0.00 0.00 175.55 173.32 1grw s HIS 30 N -2.49 1.24 -0.04 2.71 3.76 -1.26 -0.14 115.29 119.07 1grw s HIS 30 Ca 0.44 -0.27 0.04 0.00 -0.15 0.00 0.00 55.06 55.12 1grw s HIS 30 Cb -0.01 -0.78 -0.00 0.00 1.11 0.00 0.00 32.58 32.90 1grw s HIS 30 CO 0.26 -0.00 -0.16 0.42 -0.85 0.00 0.00 174.74 174.41 1grw s ILE 31 N -0.48 1.32 -0.23 0.60 1.01 -0.22 -4.66 121.20 118.54 1grw s ILE 31 Ca 0.04 -0.65 -0.12 0.00 0.00 0.00 0.00 60.65 59.93 1grw s ILE 31 Cb -0.06 -1.15 -0.05 0.00 0.01 0.00 0.00 42.46 41.22 1grw s ILE 31 CO 0.00 0.39 0.23 -0.75 0.00 0.00 0.00 174.94 174.81 1grw s LYS 32 N 0.14 4.11 -0.19 2.79 2.20 0.15 -0.75 119.74 128.18 1grw s LYS 32 Ca -0.05 -0.12 -0.02 0.00 -0.36 0.00 0.00 55.97 55.41 1grw s LYS 32 Cb -0.12 -3.53 -0.01 0.00 -1.51 0.00 0.00 37.83 32.66 1grw s LYS 32 CO 0.02 0.04 -0.08 0.08 -0.36 0.00 0.00 175.35 175.05 1grw s VAL 33 N 1.10 3.17 -0.10 4.02 1.01 -0.14 -1.30 120.40 128.18 1grw s VAL 33 Ca 0.11 -0.58 0.03 0.00 0.00 0.00 0.00 61.98 61.54 1grw s VAL 33 Cb -0.14 -2.41 -0.01 0.00 0.00 0.00 0.00 36.38 33.82 1grw s VAL 33 CO 0.05 0.46 -0.18 -0.63 0.00 0.00 0.00 175.10 174.80 1grw s ILE 34 N 1.13 2.59 -0.85 2.22 1.01 0.08 -0.66 121.20 126.73 1grw s ILE 34 Ca 0.01 -0.85 -0.20 0.00 0.00 0.00 0.00 60.65 59.62 1grw s ILE 34 Cb -0.14 -2.03 0.11 0.00 0.01 0.00 0.00 42.46 40.41 1grw s ILE 34 CO -0.02 0.55 1.08 0.21 0.00 0.00 0.00 174.94 176.76 1grw s ASN 35 N 0.09 6.49 0.13 3.58 2.47 -0.53 -1.11 114.94 126.07 1grw s ASN 35 Ca -0.08 -1.74 0.25 0.00 0.42 0.00 0.00 52.86 51.71 1grw s ASN 35 Cb -0.15 -2.40 0.94 0.00 -1.45 0.00 0.00 41.25 38.18 1grw s ASN 35 CO 0.05 -1.17 1.77 -1.20 -3.72 0.00 0.00 177.10 172.83 1grw n SER 36 N 6.90 0.46 -4.13 -4.21 7.64 -1.13 -0.35 113.62 118.80 1grw n SER 36 Ca 0.16 0.56 -0.30 0.00 1.01 0.00 0.00 58.87 60.30 1grw n SER 36 Cb 0.48 -0.68 0.19 0.00 -1.01 0.00 0.00 64.21 63.19 1grw n SER 36 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1grw s SER 37 N -3.86 2.64 0.00 6.43 1.04 -1.17 -4.79 113.70 113.98 1grw s SER 37 Ca 0.10 0.43 0.28 0.00 0.48 0.00 0.00 55.95 57.24 1grw s SER 37 Cb 0.13 -0.58 1.04 0.00 0.10 0.00 0.00 66.02 66.72 1grw s SER 37 CO 0.50 -3.04 1.74 0.00 0.98 0.00 0.00 173.24 173.42 1grw n ALA 38 N -4.00 2.64 -2.44 5.32 0.00 -1.26 -4.13 120.51 116.64 1grw n ALA 38 Ca 0.14 -0.43 -0.23 0.00 0.00 0.00 0.00 53.44 52.91 1grw n ALA 38 Cb 0.59 -1.17 -0.11 0.00 0.00 0.00 0.00 19.45 18.76 1grw n ALA 38 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1grw s ARG 39 N -2.06 1.49 0.29 0.00 0.52 -1.26 -4.78 118.95 113.14 1grw s ARG 39 Ca 0.37 -1.59 -0.29 0.00 -0.52 0.00 0.00 55.73 53.69 1grw s ARG 39 Cb 0.21 -1.59 -0.10 0.00 0.52 0.00 0.00 34.95 33.99 1grw s ARG 39 CO 0.36 0.31 1.34 0.50 0.02 0.00 0.00 175.30 177.84 1grw s ARG 40 N -3.13 4.34 0.07 3.54 3.52 -1.26 -4.16 118.95 121.87 1grw s ARG 40 Ca 0.23 2.22 0.04 0.00 -0.13 0.00 0.00 55.73 58.09 1grw s ARG 40 Cb -0.05 -3.10 -0.03 0.00 -1.56 0.00 0.00 34.95 30.21 1grw s ARG 40 CO 0.10 -0.26 -0.12 0.96 -0.81 0.00 0.00 175.30 175.17 1grw s ILE 41 N -0.65 0.99 0.01 4.11 -4.36 -0.68 -1.87 121.20 118.74 1grw s ILE 41 Ca 0.53 -1.36 0.03 0.00 -0.26 0.00 0.00 60.65 59.59 1grw s ILE 41 Cb -0.40 -1.07 -0.03 0.00 1.25 0.00 0.00 42.46 42.21 1grw s ILE 41 CO 0.48 -0.33 -0.04 -0.83 0.24 0.00 0.00 174.94 174.46 1grw s GLY 42 N -1.90 1.80 0.03 6.27 0.00 -0.44 -0.80 107.32 112.28 1grw s GLY 42 Ca -0.01 -1.00 0.00 0.00 0.00 0.00 0.00 44.72 43.71 1grw s GLY 42 CO 0.02 -0.87 -0.04 -2.52 0.00 0.00 0.00 173.10 169.69 1grw s TYR 43 N -1.04 0.35 0.03 1.90 -0.85 -0.10 -1.71 117.35 115.94 1grw s TYR 43 Ca 0.18 -0.59 0.04 0.00 -0.52 0.00 0.00 57.07 56.18 1grw s TYR 43 Cb -0.11 -0.24 -0.02 0.00 0.38 0.00 0.00 41.96 41.96 1grw s TYR 43 CO 0.09 -0.20 -0.11 0.20 -1.52 0.00 0.00 175.55 174.01 1grw s GLY 44 N -1.66 0.65 -0.05 5.49 0.00 0.15 -1.75 107.32 110.14 1grw s GLY 44 Ca -0.12 -0.73 0.02 0.00 0.00 0.00 0.00 44.72 43.89 1grw s GLY 44 CO -0.02 -0.72 -0.10 -0.42 0.00 0.00 0.00 173.10 171.84 1grw s ILE 45 N -0.87 3.43 0.06 0.90 -1.09 0.05 -0.52 121.20 123.15 1grw s ILE 45 Ca -0.01 -0.63 0.03 0.00 -2.23 0.00 0.00 60.65 57.80 1grw s ILE 45 Cb -0.08 -2.40 -0.03 0.00 -1.58 0.00 0.00 42.46 38.38 1grw s ILE 45 CO 0.01 0.56 -0.08 -0.54 -1.23 0.00 0.00 174.94 173.65 1grw s LYS 46 N -0.89 0.64 0.15 2.79 1.02 0.09 -4.89 119.74 118.65 1grw s LYS 46 Ca 0.13 -0.91 0.06 0.00 0.02 0.00 0.00 55.97 55.26 1grw s LYS 46 Cb -0.11 -0.35 -0.04 0.00 -0.52 0.00 0.00 37.83 36.80 1grw s LYS 46 CO 0.02 0.06 -0.12 0.95 -0.92 0.00 0.00 175.35 175.33 1grw s THR 47 N -1.83 1.34 -1.81 2.17 -4.23 -1.26 0.03 115.64 110.05 1grw s THR 47 Ca -0.04 -1.99 0.30 0.00 -1.18 0.00 0.00 61.69 58.78 1grw s THR 47 Cb -0.07 -1.79 0.61 0.00 1.34 0.00 0.00 72.50 72.59 1grw s THR 47 CO -0.00 -0.61 1.99 0.35 -0.54 0.00 0.00 174.62 175.81 1grw n THR 48 N -0.01 0.00 -3.29 3.99 -2.24 -1.11 -4.48 114.28 107.14 1grw n THR 48 Ca -0.11 -0.05 -0.18 0.00 -2.27 0.00 0.00 64.05 61.43 1grw n THR 48 Cb 0.59 -0.22 -0.07 0.00 -2.10 0.00 0.00 70.33 68.53 1grw n THR 48 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1grw s ASN 49 N -2.30 0.97 0.34 3.42 3.84 -1.26 -4.97 114.94 114.98 1grw s ASN 49 Ca 0.35 -2.02 0.03 0.00 0.21 0.00 0.00 52.86 51.44 1grw s ASN 49 Cb 0.21 0.44 0.64 0.00 -0.55 0.00 0.00 41.25 41.99 1grw s ASN 49 CO 0.43 -0.21 1.97 0.24 -2.79 0.00 0.00 177.10 176.73 1grw h MET 50 N 6.41 0.85 -0.27 0.43 2.86 -1.78 0.97 114.93 124.40 1grw h MET 50 Ca 0.11 -0.05 -0.00 0.00 -2.06 0.00 0.00 59.70 57.70 1grw h MET 50 Cb 1.02 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 32.48 1grw h MET 50 CO 0.22 0.56 0.16 0.87 1.06 0.00 0.00 176.91 179.78 1grw h LYS 51 N 0.88 0.36 0.09 1.72 1.57 -1.98 -3.25 116.57 115.95 1grw h LYS 51 Ca 0.30 -0.03 -0.35 0.00 -1.87 0.00 0.00 60.65 58.70 1grw h LYS 51 Cb 0.09 -0.08 -0.03 0.00 0.08 0.00 0.00 32.23 32.30 1grw h LYS 51 CO -0.09 0.28 -1.95 -2.13 -0.57 0.00 0.00 179.45 174.99 1grw n ARG 52 N -4.87 0.72 -4.31 3.15 0.63 -1.16 -4.87 116.66 105.95 1grw n ARG 52 Ca -0.02 0.26 -0.33 0.00 -0.92 0.00 0.00 57.85 56.84 1grw n ARG 52 Cb 0.05 -1.72 -0.09 0.00 0.45 0.00 0.00 32.46 31.15 1grw n ARG 52 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1grw s LEU 53 N -6.75 3.51 -0.04 6.15 1.43 0.33 -1.63 118.68 121.69 1grw s LEU 53 Ca -0.18 0.02 -0.03 0.00 -1.03 0.00 0.00 54.13 52.90 1grw s LEU 53 Cb 0.07 -1.97 0.01 0.00 0.03 0.00 0.00 46.19 44.33 1grw s LEU 53 CO 0.78 0.30 0.10 -0.83 0.23 0.00 0.00 176.35 176.93 1grw s GLY 54 N -1.42 -0.07 0.01 -3.19 0.00 -0.86 -4.30 107.32 97.49 1grw s GLY 54 Ca 0.18 0.31 0.07 0.00 0.00 0.00 0.00 44.72 45.28 1grw s GLY 54 CO 0.09 0.30 -0.20 0.14 0.00 0.00 0.00 173.10 173.43 1grw s VAL 55 N 0.14 1.59 -0.21 1.40 1.01 -1.25 -0.04 120.40 123.04 1grw s VAL 55 Ca -0.01 -1.00 -0.08 0.00 0.00 0.00 0.00 61.98 60.89 1grw s VAL 55 Cb -0.02 -1.35 0.09 0.00 0.00 0.00 0.00 36.38 35.10 1grw s VAL 55 CO -0.00 0.32 0.46 -0.62 0.00 0.00 0.00 175.10 175.26 1grw s ASP 56 N -0.80 -0.45 0.52 3.32 -1.08 -0.36 -3.78 116.67 114.06 1grw s ASP 56 Ca 0.07 1.07 -0.20 0.00 -0.52 0.00 0.00 52.55 52.98 1grw s ASP 56 Cb -0.08 1.36 -0.07 0.00 -1.46 0.00 0.00 42.92 42.68 1grw s ASP 56 CO 0.00 -0.22 1.09 -2.16 0.52 0.00 0.00 175.17 174.41 1grw s PRO 57 N 2.38 3.51 0.00 4.34 0.04 -1.26 -0.76 135.00 143.25 1grw s PRO 57 Ca -0.04 1.51 0.28 0.00 0.04 0.00 0.00 61.00 62.79 1grw s PRO 57 Cb -0.11 -2.04 1.07 0.00 0.04 0.00 0.00 34.50 33.47 1grw s PRO 57 CO -0.14 -0.70 1.77 -0.35 0.04 0.00 0.00 177.00 177.62 1grw n PRO 58 N -1.20 0.55 -3.53 0.56 -0.04 -1.25 -4.86 135.00 125.23 1grw n PRO 58 Ca 0.11 -0.21 -0.10 0.00 -0.04 0.00 0.00 63.50 63.25 1grw n PRO 58 Cb 0.52 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.45 1grw n PRO 58 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1grw n GLY 60 N 0.21 1.15 3.07 0.00 0.00 -0.72 -4.99 105.19 103.91 1grw n GLY 60 Ca -0.10 -0.79 -0.17 0.00 0.00 0.00 0.00 46.02 44.96 1grw n GLY 60 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1grw s VAL 61 N -2.34 0.76 -0.10 1.61 1.01 -1.26 -0.92 120.40 119.16 1grw s VAL 61 Ca 0.00 -0.82 -0.03 0.00 0.00 0.00 0.00 61.98 61.14 1grw s VAL 61 Cb 0.00 -0.72 0.04 0.00 0.00 0.00 0.00 36.38 35.70 1grw s VAL 61 CO 0.00 -0.08 0.04 -0.76 0.00 0.00 0.00 175.10 174.31 1grw s LEU 62 N -1.00 0.48 0.99 3.92 1.02 0.02 -5.00 118.68 119.12 1grw s LEU 62 Ca -0.02 -0.25 -0.12 0.00 0.02 0.00 0.00 54.13 53.76 1grw s LEU 62 Cb -0.07 -0.33 0.18 0.00 0.02 0.00 0.00 46.19 45.99 1grw s LEU 62 CO 0.01 -0.26 1.10 -1.81 0.02 0.00 0.00 176.35 175.40 1grw s ASP 63 N 2.05 2.73 0.27 2.29 1.01 -1.26 -1.68 116.67 122.08 1grw s ASP 63 Ca 0.04 1.20 -0.30 0.00 0.71 0.00 0.00 52.55 54.19 1grw s ASP 63 Cb -0.14 -1.86 -0.13 0.00 1.01 0.00 0.00 42.92 41.80 1grw s ASP 63 CO -0.06 -3.06 1.31 -2.65 0.21 0.00 0.00 175.17 170.92 1grw n PRO 64 N -4.13 1.92 -0.79 8.23 -0.02 -1.26 -1.61 135.00 137.34 1grw n PRO 64 Ca 0.05 0.68 0.00 0.00 -2.02 0.00 0.00 63.50 62.21 1grw n PRO 64 Cb 0.57 -2.27 0.00 0.00 -0.02 0.00 0.00 33.50 31.78 1grw n PRO 64 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1grw n LYS 65 N 1.44 -0.53 -3.08 -0.52 5.02 0.52 -4.99 118.16 116.02 1grw n LYS 65 Ca 0.10 0.13 -0.34 0.00 -2.02 0.00 0.00 58.31 56.18 1grw n LYS 65 Cb 0.32 -4.07 -0.06 0.00 -0.02 0.00 0.00 35.03 31.20 1grw n LYS 65 CO 0.00 0.00 0.00 -2.00 -0.52 0.00 0.00 177.40 174.88 1grw s GLU 66 N -0.95 4.12 0.17 1.97 2.12 -0.64 -4.73 118.70 120.76 1grw s GLU 66 Ca 0.00 0.80 0.10 0.00 0.36 0.00 0.00 54.97 56.23 1grw s GLU 66 Cb 0.00 -2.54 -0.04 0.00 0.26 0.00 0.00 34.13 31.81 1grw s GLU 66 CO 0.00 0.21 -0.21 0.00 -0.54 0.00 0.00 175.26 174.71 1grw s ALA 67 N -1.86 2.23 0.01 6.30 0.00 -1.26 -1.45 121.76 125.73 1grw s ALA 67 Ca 0.52 -1.52 0.02 0.00 0.00 0.00 0.00 51.96 50.97 1grw s ALA 67 Cb -0.12 -0.26 -0.01 0.00 0.00 0.00 0.00 23.12 22.72 1grw s ALA 67 CO 0.18 0.35 -0.07 0.54 0.00 0.00 0.00 175.76 176.76 1grw s VAL 68 N -1.73 0.53 -0.30 0.00 0.11 0.17 -4.98 120.40 114.20 1grw s VAL 68 Ca 0.17 -0.58 -0.05 0.00 -2.93 0.00 0.00 61.98 58.58 1grw s VAL 68 Cb -0.07 -0.51 0.02 0.00 -1.53 0.00 0.00 36.38 34.29 1grw s VAL 68 CO 0.08 -0.05 0.05 -0.22 -3.33 0.00 0.00 175.10 171.63 1grw s LEU 69 N -0.70 3.85 0.08 2.54 2.96 -1.26 -0.96 118.68 125.19 1grw s LEU 69 Ca -0.02 -0.89 -0.06 0.00 -0.22 0.00 0.00 54.13 52.94 1grw s LEU 69 Cb -0.05 -1.83 -0.05 0.00 0.50 0.00 0.00 46.19 44.76 1grw s LEU 69 CO 0.00 -0.22 0.34 -0.76 -1.32 0.00 0.00 176.35 174.39 1grw s LEU 70 N 1.43 4.32 -0.24 -0.68 1.43 0.07 -4.71 118.68 120.30 1grw s LEU 70 Ca 0.00 0.60 -0.05 0.00 -1.03 0.00 0.00 54.13 53.66 1grw s LEU 70 Cb -0.18 -3.03 -0.01 0.00 0.03 0.00 0.00 46.19 43.01 1grw s LEU 70 CO 0.01 0.15 0.01 0.00 0.23 0.00 0.00 176.35 176.75 1grw s ALA 71 N -1.48 2.96 -0.40 4.21 0.00 0.06 -1.06 121.76 126.05 1grw s ALA 71 Ca 0.35 -1.22 -0.09 0.00 0.00 0.00 0.00 51.96 51.00 1grw s ALA 71 Cb -0.13 -1.90 0.07 0.00 0.00 0.00 0.00 23.12 21.15 1grw s ALA 71 CO 0.21 -0.56 0.22 0.08 0.00 0.00 0.00 175.76 175.71 1grw s VAL 72 N 1.52 4.17 0.13 0.00 1.01 0.80 -1.22 120.40 126.81 1grw s VAL 72 Ca 0.05 -1.30 -0.06 0.00 0.00 0.00 0.00 61.98 60.68 1grw s VAL 72 Cb -0.15 -3.50 -0.06 0.00 0.00 0.00 0.00 36.38 32.68 1grw s VAL 72 CO -0.00 -0.42 0.38 -0.94 0.00 0.00 0.00 175.10 174.12 1grw s SER 73 N 1.90 6.52 -0.27 3.32 1.04 0.95 0.32 113.70 127.48 1grw s SER 73 Ca 0.02 0.63 -0.00 0.00 0.48 0.00 0.00 55.95 57.08 1grw s SER 73 Cb -0.22 -2.11 0.08 0.00 0.10 0.00 0.00 66.02 63.87 1grw s SER 73 CO 0.03 0.08 0.03 0.00 0.98 0.00 0.00 173.24 174.36 1grw n ASP 75 N 4.77 -1.22 -4.75 0.00 -0.08 -0.64 -1.21 116.55 113.42 1grw n ASP 75 Ca -0.06 0.17 -0.37 0.00 -1.51 0.00 0.00 54.79 53.02 1grw n ASP 75 Cb 0.44 -1.27 0.04 0.00 2.34 0.00 0.00 41.12 42.67 1grw n ASP 75 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1grw s ALA 76 N -2.46 2.61 0.09 -1.67 0.00 -1.20 -4.74 121.76 114.39 1grw s ALA 76 Ca 0.63 1.16 -0.26 0.00 0.00 0.00 0.00 51.96 53.49 1grw s ALA 76 Cb -0.21 -3.51 0.08 0.00 0.00 0.00 0.00 23.12 19.48 1grw s ALA 76 CO 0.63 -1.31 0.91 -0.59 0.00 0.00 0.00 175.76 175.40 1grw s PHE 77 N -1.44 -0.24 -0.85 0.00 -0.71 0.01 -4.94 117.98 109.80 1grw s PHE 77 Ca 0.76 0.01 -0.14 0.00 -1.04 0.00 0.00 56.93 56.52 1grw s PHE 77 Cb -0.35 0.59 0.21 0.00 -1.21 0.00 0.00 43.02 42.26 1grw s PHE 77 CO 0.39 -0.71 0.83 0.00 -1.34 0.00 0.00 175.22 174.39 1grw s ALA 78 N -3.25 4.01 0.22 1.99 0.00 -1.26 -4.55 121.76 118.93 1grw s ALA 78 Ca 0.09 -3.27 -0.08 0.00 0.00 0.00 0.00 51.96 48.70 1grw s ALA 78 Cb -0.01 -3.60 0.33 0.00 0.00 0.00 0.00 23.12 19.84 1grw s ALA 78 CO -0.03 -2.38 1.76 0.35 0.00 0.00 0.00 175.76 175.47 1grw h PHE 79 N 7.87 0.55 0.00 0.00 3.57 -1.93 -2.12 116.94 124.88 1grw h PHE 79 Ca 0.12 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.65 1grw h PHE 79 Cb 1.03 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 39.63 1grw h PHE 79 CO 1.05 0.17 0.07 0.78 -2.23 0.00 0.00 178.31 178.15 1grw h GLY 80 N 0.53 0.00 0.00 2.40 0.00 -2.01 -3.04 103.07 100.95 1grw h GLY 80 Ca 0.34 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.67 1grw h GLY 80 CO -0.29 0.00 0.00 -1.06 0.00 0.00 0.00 176.54 175.19 1grw n GLN 81 N -2.27 -0.27 -4.18 4.80 6.02 -0.84 -5.11 117.38 115.53 1grw n GLN 81 Ca -0.01 -0.32 -0.29 0.00 -0.01 0.00 0.00 57.00 56.37 1grw n GLN 81 Cb 0.10 -0.81 -0.03 0.00 1.02 0.00 0.00 30.24 30.52 1grw n GLN 81 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 1grw s GLU 82 N -0.05 2.24 -0.09 -1.09 2.02 -0.96 -5.10 118.70 115.66 1grw s GLU 82 Ca 0.00 -2.15 -0.24 0.00 0.02 0.00 0.00 54.97 52.60 1grw s GLU 82 Cb 0.00 -1.91 -0.03 0.00 0.10 0.00 0.00 34.13 32.29 1grw s GLU 82 CO 0.00 -0.53 0.72 -0.51 0.02 0.00 0.00 175.26 174.96 1grw s ASP 83 N -4.15 6.97 0.00 -0.19 1.01 -1.26 -4.93 116.67 114.12 1grw s ASP 83 Ca 0.24 1.17 0.00 0.00 0.71 0.00 0.00 52.55 54.67 1grw s ASP 83 Cb -0.01 -2.42 0.00 0.00 1.01 0.00 0.00 42.92 41.50 1grw s ASP 83 CO 0.15 -0.18 0.58 0.35 0.21 0.00 0.00 175.17 176.28 1grw n THR 84 N 4.01 0.20 0.83 -1.27 -2.24 -1.26 -4.83 114.28 109.71 1grw n THR 84 Ca -0.00 -0.20 0.07 0.00 -2.27 0.00 0.00 64.05 61.65 1grw n THR 84 Cb 0.51 0.94 0.22 0.00 -2.10 0.00 0.00 70.33 69.90 1grw n THR 84 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1grw n ASN 85 N -0.10 2.07 -1.11 3.42 6.94 -1.26 -4.34 115.26 120.87 1grw n ASN 85 Ca 0.00 -1.94 0.02 0.00 -0.02 0.00 0.00 54.58 52.65 1grw n ASN 85 Cb 0.44 -0.23 0.13 0.00 -2.36 0.00 0.00 39.78 37.75 1grw n ASN 85 CO 0.00 0.00 0.00 0.59 -1.03 0.00 0.00 177.26 176.82 1grw n ASN 86 N 0.62 1.77 -4.89 0.53 3.02 -1.26 -5.06 115.26 110.00 1grw n ASN 86 Ca 0.14 -3.22 -0.35 0.00 -0.03 0.00 0.00 54.58 51.13 1grw n ASN 86 Cb 0.34 -0.44 -0.05 0.00 -0.61 0.00 0.00 39.78 39.02 1grw n ASN 86 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 1grw s ASP 87 N -2.92 6.33 0.06 6.41 1.01 -1.26 -4.89 116.67 121.41 1grw s ASP 87 Ca 0.37 0.39 -0.16 0.00 0.71 0.00 0.00 52.55 53.86 1grw s ASP 87 Cb 0.38 -2.01 0.03 0.00 1.01 0.00 0.00 42.92 42.33 1grw s ASP 87 CO -0.09 0.33 0.38 0.00 0.21 0.00 0.00 175.17 176.00 1grw s ARG 88 N -1.51 0.92 -0.12 8.23 1.70 -1.26 -0.16 118.95 126.74 1grw s ARG 88 Ca 0.21 -0.49 -0.02 0.00 -0.47 0.00 0.00 55.73 54.96 1grw s ARG 88 Cb -0.12 0.41 -0.03 0.00 -0.57 0.00 0.00 34.95 34.63 1grw s ARG 88 CO 0.12 -0.32 -0.02 0.42 -1.08 0.00 0.00 175.30 174.41 1grw s ILE 89 N -2.81 4.05 -0.13 4.99 1.01 0.36 -2.74 121.20 125.93 1grw s ILE 89 Ca -0.03 -0.32 0.02 0.00 0.00 0.00 0.00 60.65 60.32 1grw s ILE 89 Cb -0.00 -2.73 0.00 0.00 0.01 0.00 0.00 42.46 39.74 1grw s ILE 89 CO -0.05 0.55 -0.21 -0.89 0.00 0.00 0.00 174.94 174.34 1grw s THR 90 N -0.26 2.24 -0.32 2.92 2.01 0.10 -0.92 115.64 121.42 1grw s THR 90 Ca 0.05 -0.93 -0.12 0.00 0.31 0.00 0.00 61.69 61.01 1grw s THR 90 Cb -0.13 -1.90 -0.02 0.00 0.01 0.00 0.00 72.50 70.46 1grw s THR 90 CO 0.02 0.54 0.21 -0.69 -0.69 0.00 0.00 174.62 174.02 1grw s VAL 91 N 0.68 5.16 -0.01 3.82 1.01 -0.28 -0.73 120.40 130.06 1grw s VAL 91 Ca -0.10 -0.14 0.04 0.00 0.00 0.00 0.00 61.98 61.78 1grw s VAL 91 Cb -0.16 -3.59 -0.03 0.00 0.00 0.00 0.00 36.38 32.59 1grw s VAL 91 CO 0.01 0.08 -0.10 -1.61 0.00 0.00 0.00 175.10 173.48 1grw s GLU 92 N 1.71 2.47 0.09 2.72 2.02 0.32 -0.71 118.70 127.33 1grw s GLU 92 Ca 0.06 -0.75 -0.21 0.00 0.02 0.00 0.00 54.97 54.09 1grw s GLU 92 Cb -0.17 -2.43 0.05 0.00 0.10 0.00 0.00 34.13 31.68 1grw s GLU 92 CO 0.10 0.60 0.50 1.67 0.02 0.00 0.00 175.26 178.15 1grw s TRP 93 N -0.92 -0.39 0.05 1.61 -2.14 -0.09 0.29 118.94 117.35 1grw s TRP 93 Ca 0.15 0.27 -0.10 0.00 2.66 0.00 0.00 56.10 59.09 1grw s TRP 93 Cb -0.11 0.37 0.00 0.00 -3.10 0.00 0.00 33.47 30.63 1grw s TRP 93 CO 0.05 -0.71 0.20 -0.08 -2.66 0.00 0.00 176.95 173.76 1grw s THR 94 N -3.12 0.11 0.31 0.66 -1.32 -0.70 -0.58 115.64 111.01 1grw s THR 94 Ca -0.02 -0.91 -0.29 0.00 -1.21 0.00 0.00 61.69 59.26 1grw s THR 94 Cb -0.00 -0.97 -0.11 0.00 -1.51 0.00 0.00 72.50 69.91 1grw s THR 94 CO -0.07 -0.50 1.50 0.20 -2.21 0.00 0.00 174.62 173.54 1grw s ASN 95 N -2.19 6.46 0.06 8.08 0.01 -1.26 -1.33 114.94 124.78 1grw s ASN 95 Ca -0.04 2.90 -0.30 0.00 -0.71 0.00 0.00 52.86 54.71 1grw s ASN 95 Cb -0.00 -2.64 -0.05 0.00 0.41 0.00 0.00 41.25 38.96 1grw s ASN 95 CO -0.05 -0.82 1.12 0.28 -1.51 0.00 0.00 177.10 176.12 1grw s THR 96 N -0.43 4.24 0.54 1.60 -1.32 -0.78 -4.78 115.64 114.70 1grw s THR 96 Ca 0.58 1.66 -0.21 0.00 -1.21 0.00 0.00 61.69 62.51 1grw s THR 96 Cb -0.45 -4.06 -0.05 0.00 -1.51 0.00 0.00 72.50 66.42 1grw s THR 96 CO 0.52 0.16 1.27 -2.16 -2.21 0.00 0.00 174.62 172.19 1grw s PRO 97 N 0.81 3.25 -0.10 7.08 0.04 -1.26 -4.92 135.00 139.90 1grw s PRO 97 Ca 0.55 2.00 -0.35 0.00 0.04 0.00 0.00 61.00 63.24 1grw s PRO 97 Cb -0.27 -2.21 -0.17 0.00 0.04 0.00 0.00 34.50 31.89 1grw s PRO 97 CO 0.30 -1.03 1.02 -0.25 0.04 0.00 0.00 177.00 177.07 1grw n ASP 98 N -1.04 0.24 -3.71 6.66 8.00 -1.26 -2.56 116.55 122.88 1grw n ASP 98 Ca 0.10 0.99 -0.28 0.00 0.71 0.00 0.00 54.79 56.32 1grw n ASP 98 Cb 0.47 -0.77 0.02 0.00 -0.02 0.00 0.00 41.12 40.82 1grw n ASP 98 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1grw n GLY 99 N 1.78 -1.10 3.32 0.44 0.00 -1.26 -4.99 105.19 103.39 1grw n GLY 99 Ca 0.19 0.48 -0.23 0.00 0.00 0.00 0.00 46.02 46.47 1grw n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1grw s ALA 100 N -3.27 1.95 0.81 4.61 0.00 -1.06 -5.14 121.76 119.66 1grw s ALA 100 Ca 0.27 -1.41 -0.11 0.00 0.00 0.00 0.00 51.96 50.71 1grw s ALA 100 Cb -0.12 -0.21 0.08 0.00 0.00 0.00 0.00 23.12 22.87 1grw s ALA 100 CO 0.88 0.28 1.09 0.00 0.00 0.00 0.00 175.76 178.01 1grw s ALA 101 N -1.74 2.08 -0.99 0.00 0.00 -1.26 -4.93 121.76 114.91 1grw s ALA 101 Ca 0.13 0.05 -0.07 0.00 0.00 0.00 0.00 51.96 52.07 1grw s ALA 101 Cb -0.07 -3.20 -0.04 0.00 0.00 0.00 0.00 23.12 19.80 1grw s ALA 101 CO 0.06 -1.88 2.91 1.17 0.00 0.00 0.00 175.76 178.02 1grw n LYS 102 N -3.57 3.38 -3.65 0.00 4.81 -1.26 -4.75 118.16 113.11 1grw n LYS 102 Ca 0.08 -2.33 -0.14 0.00 -0.87 0.00 0.00 58.31 55.05 1grw n LYS 102 Cb 0.54 -2.47 -0.13 0.00 0.02 0.00 0.00 35.03 32.99 1grw n LYS 102 CO 0.00 0.00 0.00 -1.14 1.17 0.00 0.00 177.40 177.43 1grw s GLN 103 N 0.30 0.15 0.16 1.64 0.74 -1.26 -4.87 119.66 116.51 1grw s GLN 103 Ca 0.63 0.71 -0.32 0.00 0.05 0.00 0.00 55.36 56.43 1grw s GLN 103 Cb 0.25 -0.10 -0.12 0.00 1.10 0.00 0.00 33.01 34.13 1grw s GLN 103 CO -0.09 -0.31 1.74 0.34 -0.55 0.00 0.00 175.29 176.42 1grw n PHE 104 N 5.35 2.59 -4.63 1.67 7.35 -1.26 -5.01 117.46 123.53 1grw n PHE 104 Ca -0.06 0.03 -0.29 0.00 -0.76 0.00 0.00 57.45 56.37 1grw n PHE 104 Cb 0.50 -2.66 -0.17 0.00 0.35 0.00 0.00 39.48 37.50 1grw n PHE 104 CO 0.00 0.00 0.00 1.03 -0.76 0.00 0.00 176.76 177.03 1grw s ARG 105 N 1.73 2.34 0.65 -4.13 0.52 -1.26 -4.99 118.95 113.81 1grw s ARG 105 Ca 0.79 -0.62 0.34 0.00 -0.52 0.00 0.00 55.73 55.73 1grw s ARG 105 Cb -0.54 -1.92 1.89 0.00 0.52 0.00 0.00 34.95 34.89 1grw s ARG 105 CO 0.36 -0.00 2.11 0.00 0.02 0.00 0.00 175.30 177.78 1grw h ARG 106 N 7.21 0.00 -0.46 3.54 3.08 -2.02 -0.77 114.38 124.97 1grw h ARG 106 Ca -0.29 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 59.75 1grw h ARG 106 Cb 1.19 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 31.22 1grw h ARG 106 CO 0.49 0.00 0.24 1.49 -1.07 0.00 0.00 179.97 181.12 1grw h GLU 107 N 0.00 0.64 -0.47 0.04 4.57 -1.99 -2.55 114.58 114.82 1grw h GLU 107 Ca 0.03 -0.06 0.14 0.00 -1.18 0.00 0.00 59.36 58.28 1grw h GLU 107 Cb 0.43 -0.13 -0.02 0.00 -0.16 0.00 0.00 28.75 28.87 1grw h GLU 107 CO -0.00 0.48 0.40 -1.49 -1.18 0.00 0.00 179.01 177.22 1grw h TRP 108 N 0.64 0.00 -0.02 0.92 6.55 -1.53 0.22 115.95 122.74 1grw h TRP 108 Ca 0.16 0.00 0.00 0.00 0.95 0.00 0.00 58.89 60.00 1grw h TRP 108 Cb 0.04 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.34 1grw h TRP 108 CO 0.00 0.00 -0.18 1.19 -1.05 0.00 0.00 178.44 178.40 1grw n PHE 109 N -4.07 0.00 -0.05 0.49 3.01 -0.96 -4.43 117.46 111.44 1grw n PHE 109 Ca 0.08 0.00 -0.06 0.00 1.01 0.00 0.00 57.45 58.49 1grw n PHE 109 Cb 0.60 -0.04 -0.08 0.00 -0.01 0.00 0.00 39.48 39.95 1grw n PHE 109 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 1grw n GLN 110 N 0.08 2.00 -1.55 -1.08 6.02 0.73 -5.01 117.38 118.56 1grw n GLN 110 Ca 0.14 0.01 -0.29 0.00 -0.01 0.00 0.00 57.00 56.84 1grw n GLN 110 Cb 0.42 -1.26 0.17 0.00 1.02 0.00 0.00 30.24 30.59 1grw n GLN 110 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1grw s GLY 111 N -4.43 1.63 0.03 1.08 0.00 -0.87 -4.94 107.32 99.83 1grw s GLY 111 Ca -0.07 -0.79 -0.38 0.00 0.00 0.00 0.00 44.72 43.48 1grw s GLY 111 CO 0.40 -0.11 1.28 1.22 0.00 0.00 0.00 173.10 175.89 1grw n ASP 112 N -3.96 1.16 0.00 1.64 9.92 -1.26 -4.80 116.55 119.25 1grw n ASP 112 Ca 0.10 1.13 0.00 0.00 -0.53 0.00 0.00 54.79 55.49 1grw n ASP 112 Cb 0.59 -1.10 0.00 0.00 -0.64 0.00 0.00 41.12 39.98 1grw n ASP 112 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1grw n GLY 113 N 2.31 -1.28 3.32 0.44 0.00 -1.26 -5.06 105.19 103.65 1grw n GLY 113 Ca 0.19 -1.41 -0.33 0.00 0.00 0.00 0.00 46.02 44.48 1grw n GLY 113 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1grw s MET 114 N -1.93 3.29 -0.12 1.61 -1.94 -1.26 -5.10 119.30 113.84 1grw s MET 114 Ca 0.00 -0.74 0.00 0.00 -1.71 0.00 0.00 55.69 53.25 1grw s MET 114 Cb 0.00 -2.56 -0.02 0.00 2.01 0.00 0.00 34.83 34.27 1grw s MET 114 CO 0.00 0.18 -0.13 0.08 -0.01 0.00 0.00 175.02 175.13 1grw s VAL 115 N 0.41 3.02 0.12 -6.03 1.01 -1.26 -4.60 120.40 113.08 1grw s VAL 115 Ca -0.12 -0.68 0.06 0.00 0.00 0.00 0.00 61.98 61.24 1grw s VAL 115 Cb -0.16 -2.26 -0.04 0.00 0.00 0.00 0.00 36.38 33.92 1grw s VAL 115 CO 0.06 0.53 -0.00 -0.60 0.00 0.00 0.00 175.10 175.09 1grw s ARG 116 N 0.26 2.49 0.01 2.72 3.52 0.26 -4.94 118.95 123.27 1grw s ARG 116 Ca -0.10 -0.94 -0.01 0.00 -0.13 0.00 0.00 55.73 54.56 1grw s ARG 116 Cb -0.16 -2.47 -0.01 0.00 -1.56 0.00 0.00 34.95 30.75 1grw s ARG 116 CO 0.05 0.51 -0.01 -0.98 -0.81 0.00 0.00 175.30 174.06 1grw s ARG 117 N -2.55 0.23 -0.10 5.12 1.70 -1.26 -0.92 118.95 121.18 1grw s ARG 117 Ca 0.26 -0.41 -0.00 0.00 -0.47 0.00 0.00 55.73 55.11 1grw s ARG 117 Cb -0.11 0.09 0.02 0.00 -0.57 0.00 0.00 34.95 34.38 1grw s ARG 117 CO 0.18 -0.04 -0.08 0.21 -1.08 0.00 0.00 175.30 174.50 1grw s LYS 118 N -1.03 1.48 0.14 3.89 2.20 0.12 -5.00 119.74 121.55 1grw s LYS 118 Ca -0.11 -0.25 -0.13 0.00 -0.36 0.00 0.00 55.97 55.11 1grw s LYS 118 Cb -0.07 -1.51 -0.07 0.00 -1.51 0.00 0.00 37.83 34.68 1grw s LYS 118 CO -0.01 -0.22 0.53 -0.80 -0.36 0.00 0.00 175.35 174.49 1grw s ASN 119 N 1.54 6.78 -0.47 1.43 0.01 -1.26 -1.12 114.94 121.85 1grw s ASN 119 Ca 0.02 1.02 0.03 0.00 -0.71 0.00 0.00 52.86 53.22 1grw s ASN 119 Cb -0.13 -2.27 0.15 0.00 0.41 0.00 0.00 41.25 39.41 1grw s ASN 119 CO -0.06 0.10 0.30 -0.76 -1.51 0.00 0.00 177.10 175.17 1grw s LEU 120 N -2.02 2.66 0.53 0.60 1.43 -0.09 -4.87 118.68 116.92 1grw s LEU 120 Ca 0.38 -2.89 -0.22 0.00 -1.03 0.00 0.00 54.13 50.37 1grw s LEU 120 Cb -0.15 -0.96 -0.06 0.00 0.03 0.00 0.00 46.19 45.05 1grw s LEU 120 CO 0.19 -0.22 1.29 -2.65 0.23 0.00 0.00 176.35 175.19 1grw n PRO 121 N 3.17 1.63 -3.55 1.29 -0.02 -1.26 -0.49 135.00 135.77 1grw n PRO 121 Ca 0.15 0.60 -0.37 0.00 -2.02 0.00 0.00 63.50 61.86 1grw n PRO 121 Cb 0.38 -2.49 -0.07 0.00 -0.02 0.00 0.00 33.50 31.30 1grw n PRO 121 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1grw s ILE 122 N -1.30 5.26 -0.07 4.25 -1.09 0.77 -2.09 121.20 126.92 1grw s ILE 122 Ca 0.70 0.61 0.05 0.00 -2.23 0.00 0.00 60.65 59.78 1grw s ILE 122 Cb -0.43 -3.64 -0.01 0.00 -1.58 0.00 0.00 42.46 36.80 1grw s ILE 122 CO 0.50 0.45 -0.24 -0.70 -1.23 0.00 0.00 174.94 173.73 1grw s GLU 123 N -0.01 2.65 -0.23 2.79 2.12 -0.17 -4.57 118.70 121.28 1grw s GLU 123 Ca 0.19 -0.86 -0.10 0.00 0.36 0.00 0.00 54.97 54.56 1grw s GLU 123 Cb -0.14 -2.14 -0.05 0.00 0.26 0.00 0.00 34.13 32.06 1grw s GLU 123 CO 0.06 0.28 0.15 0.71 -0.54 0.00 0.00 175.26 175.93 1grw s TYR 124 N 0.07 3.33 -0.56 5.30 2.02 -1.26 -0.46 117.35 125.79 1grw s TYR 124 Ca -0.10 0.23 -0.04 0.00 -0.37 0.00 0.00 57.07 56.80 1grw s TYR 124 Cb -0.15 -2.24 0.15 0.00 -0.40 0.00 0.00 41.96 39.32 1grw s TYR 124 CO 0.06 0.11 0.38 1.21 -1.57 0.00 0.00 175.55 175.74 1grw s ASN 125 N 0.88 5.36 0.00 2.29 2.47 -0.44 -4.96 114.94 120.55 1grw s ASN 125 Ca 0.07 -2.53 0.32 0.00 0.42 0.00 0.00 52.86 51.14 1grw s ASN 125 Cb -0.13 -1.88 1.86 0.00 -1.45 0.00 0.00 41.25 39.65 1grw s ASN 125 CO 0.03 -0.46 2.20 -0.81 -3.72 0.00 0.00 177.10 174.34