#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d9y s SER 2 N 0.00 6.11 0.31 1.61 0.01 -1.26 -4.88 113.70 115.60 2d9y s SER 2 Ca 0.00 0.60 0.05 0.00 1.31 0.00 0.00 55.95 57.91 2d9y s SER 2 Cb 0.00 -2.54 0.82 0.00 0.21 0.00 0.00 66.02 64.51 2d9y s SER 2 CO 0.00 -1.66 1.62 0.28 0.41 0.00 0.00 173.24 173.90 2d9y h SER 3 N 11.42 -0.03 -5.00 2.44 0.02 -2.10 -3.47 113.55 116.83 2d9y h SER 3 Ca -0.28 0.22 0.00 0.00 -0.84 0.00 0.00 61.79 60.90 2d9y h SER 3 Cb 1.11 0.30 0.00 0.00 0.14 0.00 0.00 62.40 63.95 2d9y h SER 3 CO 1.13 -0.23 0.00 0.61 -1.14 0.00 0.00 176.83 177.20 2d9y n GLY 4 N -1.38 2.62 3.22 -3.77 0.00 -1.26 -5.07 105.19 99.55 2d9y n GLY 4 Ca 0.24 -1.90 -0.16 0.00 0.00 0.00 0.00 46.02 44.20 2d9y n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2d9y s SER 5 N 0.00 1.81 -1.45 1.61 1.04 -1.26 -4.81 113.70 110.63 2d9y s SER 5 Ca 0.00 -0.84 -0.07 0.00 0.48 0.00 0.00 55.95 55.52 2d9y s SER 5 Cb 0.00 -0.04 0.05 0.00 0.10 0.00 0.00 66.02 66.13 2d9y s SER 5 CO 0.00 -0.20 0.78 -1.20 0.98 0.00 0.00 173.24 173.60 2d9y n SER 6 N 0.45 -2.69 0.00 7.02 7.64 -1.26 -4.89 113.62 119.88 2d9y n SER 6 Ca -0.15 -0.85 -0.00 0.00 1.01 0.00 0.00 58.87 58.88 2d9y n SER 6 Cb 0.58 -3.72 -0.00 0.00 -1.01 0.00 0.00 64.21 60.05 2d9y n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2d9y n GLY 7 N -1.67 -0.01 3.79 0.23 0.00 -1.26 -5.05 105.19 101.22 2d9y n GLY 7 Ca -0.13 -0.01 -0.37 0.00 0.00 0.00 0.00 46.02 45.51 2d9y n GLY 7 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2d9y s ASN 8 N -4.98 6.65 0.02 1.61 3.84 -1.26 -5.09 114.94 115.73 2d9y s ASN 8 Ca -0.01 0.78 0.00 0.00 0.21 0.00 0.00 52.86 53.84 2d9y s ASN 8 Cb 0.00 -2.23 -0.02 0.00 -0.55 0.00 0.00 41.25 38.46 2d9y s ASN 8 CO 0.01 0.20 -0.03 0.00 -2.79 0.00 0.00 177.10 174.49 2d9y s ALA 9 N -0.30 0.14 1.23 1.71 0.00 -1.26 -5.14 121.76 118.14 2d9y s ALA 9 Ca 0.22 -0.46 -0.20 0.00 0.00 0.00 0.00 51.96 51.52 2d9y s ALA 9 Cb -0.15 0.10 0.30 0.00 0.00 0.00 0.00 23.12 23.37 2d9y s ALA 9 CO 0.09 -0.10 1.11 -1.25 0.00 0.00 0.00 175.76 175.61 2d9y s PRO 10 N -1.10 -1.44 -0.12 0.00 0.04 -1.26 -5.03 135.00 126.08 2d9y s PRO 10 Ca -0.11 -0.15 -0.06 0.00 0.04 0.00 0.00 61.00 60.72 2d9y s PRO 10 Cb -0.07 -1.58 -0.04 0.00 0.04 0.00 0.00 34.50 32.85 2d9y s PRO 10 CO -0.01 -3.84 0.10 0.08 0.04 0.00 0.00 177.00 173.37 2d9y s VAL 11 N -3.01 5.12 -0.14 -0.36 1.01 -1.26 -4.66 120.40 117.10 2d9y s VAL 11 Ca 0.72 0.07 -0.14 0.00 0.00 0.00 0.00 61.98 62.62 2d9y s VAL 11 Cb -0.08 -3.23 -0.12 0.00 0.00 0.00 0.00 36.38 32.95 2d9y s VAL 11 CO 0.56 0.58 0.22 0.74 0.00 0.00 0.00 175.10 177.20 2d9y h THR 12 N 4.18 0.68 -3.10 3.92 2.02 -1.80 -3.49 112.91 115.32 2d9y h THR 12 Ca -0.51 -1.60 -0.12 0.00 0.77 0.00 0.00 66.41 64.94 2d9y h THR 12 Cb 1.21 1.38 -0.21 0.00 -1.74 0.00 0.00 68.15 68.79 2d9y h THR 12 CO 0.60 0.23 -0.31 -0.75 0.37 0.00 0.00 175.52 175.66 2d9y s LYS 13 N -2.04 0.61 -0.22 6.66 2.20 -1.08 -5.01 119.74 120.87 2d9y s LYS 13 Ca -0.14 -0.17 -0.16 0.00 -0.36 0.00 0.00 55.97 55.14 2d9y s LYS 13 Cb 0.01 0.27 0.06 0.00 -1.51 0.00 0.00 37.83 36.66 2d9y s LYS 13 CO 0.35 -0.16 0.56 0.00 -0.36 0.00 0.00 175.35 175.74 2d9y s ALA 14 N -1.20 -1.43 -0.15 3.13 0.00 -1.26 0.12 121.76 120.97 2d9y s ALA 14 Ca -0.13 1.79 -0.34 0.00 0.00 0.00 0.00 51.96 53.28 2d9y s ALA 14 Cb -0.05 -1.06 0.14 0.00 0.00 0.00 0.00 23.12 22.15 2d9y s ALA 14 CO 0.04 -0.30 1.29 0.20 0.00 0.00 0.00 175.76 176.99 2d9y s GLY 15 N 0.94 -0.33 -0.21 0.00 0.00 0.26 -5.00 107.32 102.98 2d9y s GLY 15 Ca -0.05 1.35 -0.29 0.00 0.00 0.00 0.00 44.72 45.72 2d9y s GLY 15 CO -0.08 0.40 1.38 -0.98 0.00 0.00 0.00 173.10 173.82 2d9y s TRP 16 N -2.31 2.56 -0.01 1.90 0.52 -1.26 -1.43 118.94 118.91 2d9y s TRP 16 Ca 0.12 0.79 0.05 0.00 0.02 0.00 0.00 56.10 57.08 2d9y s TRP 16 Cb 0.01 -3.77 -0.01 0.00 -1.15 0.00 0.00 33.47 28.55 2d9y s TRP 16 CO -0.04 -2.15 -0.15 -0.51 0.02 0.00 0.00 176.95 174.11 2d9y s LEU 17 N 4.18 2.02 -0.27 2.99 1.43 0.15 -4.71 118.68 124.46 2d9y s LEU 17 Ca 0.60 -0.28 -0.19 0.00 -1.03 0.00 0.00 54.13 53.23 2d9y s LEU 17 Cb -0.22 -0.79 -0.02 0.00 0.03 0.00 0.00 46.19 45.19 2d9y s LEU 17 CO 0.22 0.18 0.57 -0.36 0.23 0.00 0.00 176.35 177.19 2d9y s PHE 18 N -0.33 3.25 -0.28 0.29 0.40 -1.08 -1.54 117.98 118.69 2d9y s PHE 18 Ca 0.05 0.65 -0.11 0.00 -0.60 0.00 0.00 56.93 56.92 2d9y s PHE 18 Cb -0.06 -2.82 -0.05 0.00 0.51 0.00 0.00 43.02 40.60 2d9y s PHE 18 CO -0.00 -0.35 0.19 0.21 0.70 0.00 0.00 175.22 175.96 2d9y s LYS 19 N 2.44 3.89 0.13 0.44 2.20 -0.97 -1.35 119.74 126.51 2d9y s LYS 19 Ca 0.23 -0.36 -0.35 0.00 -0.36 0.00 0.00 55.97 55.13 2d9y s LYS 19 Cb -0.15 -3.66 -0.15 0.00 -1.51 0.00 0.00 37.83 32.36 2d9y s LYS 19 CO 0.10 -0.20 1.44 0.94 -0.36 0.00 0.00 175.35 177.26 2d9y n GLN 20 N 5.06 1.62 -1.85 4.03 7.27 -1.13 -3.37 117.38 129.02 2d9y n GLN 20 Ca -0.14 0.58 -0.37 0.00 0.07 0.00 0.00 57.00 57.15 2d9y n GLN 20 Cb 0.52 -2.28 0.05 0.00 2.41 0.00 0.00 30.24 30.94 2d9y n GLN 20 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2d9y s ALA 21 N 0.63 2.51 -0.12 1.69 0.00 -0.27 -4.93 121.76 121.27 2d9y s ALA 21 Ca 0.81 1.17 -0.13 0.00 0.00 0.00 0.00 51.96 53.81 2d9y s ALA 21 Cb -0.82 -3.52 -0.04 0.00 0.00 0.00 0.00 23.12 18.74 2d9y s ALA 21 CO 0.43 -1.41 -0.25 0.45 0.00 0.00 0.00 175.76 174.99 2d9y n SER 22 N -1.64 1.43 -4.53 0.00 2.88 -1.26 -4.78 113.62 105.72 2d9y n SER 22 Ca 0.14 0.24 -0.42 0.00 -1.33 0.00 0.00 58.87 57.50 2d9y n SER 22 Cb 0.48 -0.65 -0.08 0.00 -0.75 0.00 0.00 64.21 63.21 2d9y n SER 22 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2d9y s SER 23 N -5.47 6.28 0.00 -3.46 1.04 -1.26 -4.93 113.70 105.90 2d9y s SER 23 Ca -0.21 -0.27 0.00 0.00 0.48 0.00 0.00 55.95 55.95 2d9y s SER 23 Cb 0.03 -2.27 0.00 0.00 0.10 0.00 0.00 66.02 63.88 2d9y s SER 23 CO 0.30 -0.58 0.00 0.61 0.98 0.00 0.00 173.24 174.55 2d9y n GLY 24 N 4.94 0.11 3.50 7.32 0.00 -1.26 -5.05 105.19 114.75 2d9y n GLY 24 Ca -0.05 -2.29 -0.41 0.00 0.00 0.00 0.00 46.02 43.27 2d9y n GLY 24 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2d9y n VAL 25 N -0.26 2.04 -2.29 1.61 0.24 -1.26 -4.78 118.33 113.63 2d9y n VAL 25 Ca 0.00 -0.50 -0.34 0.00 -2.04 0.00 0.00 64.34 61.46 2d9y n VAL 25 Cb 0.00 -0.72 -0.04 0.00 -1.47 0.00 0.00 33.84 31.61 2d9y n VAL 25 CO 0.00 0.00 0.00 -0.54 -2.14 0.00 0.00 176.83 174.15 2d9y s LYS 26 N -1.74 3.11 0.38 7.34 1.02 -1.26 -4.78 119.74 123.81 2d9y s LYS 26 Ca 0.64 -1.40 0.07 0.00 0.02 0.00 0.00 55.97 55.30 2d9y s LYS 26 Cb -0.59 -5.35 -0.07 0.00 -0.52 0.00 0.00 37.83 31.30 2d9y s LYS 26 CO 0.57 -3.20 -0.02 1.14 -0.92 0.00 0.00 175.35 172.93 2d9y s GLN 27 N 5.60 1.86 -0.21 1.68 -2.07 -1.26 -4.97 119.66 120.29 2d9y s GLN 27 Ca 0.62 -2.02 -0.04 0.00 -1.82 0.00 0.00 55.36 52.09 2d9y s GLN 27 Cb 0.01 -1.54 -0.02 0.00 -1.09 0.00 0.00 33.01 30.37 2d9y s GLN 27 CO 0.09 -0.01 -0.02 -1.58 -1.32 0.00 0.00 175.29 172.44 2d9y s TRP 28 N -2.77 2.99 -0.23 9.60 0.52 -1.26 -1.12 118.94 126.67 2d9y s TRP 28 Ca 0.34 -0.68 -0.06 0.00 0.02 0.00 0.00 56.10 55.72 2d9y s TRP 28 Cb 0.08 -2.08 -0.03 0.00 -1.15 0.00 0.00 33.47 30.29 2d9y s TRP 28 CO 0.17 -0.38 0.04 -0.80 0.02 0.00 0.00 176.95 176.00 2d9y s ASN 29 N 1.19 5.01 0.05 2.95 0.01 -1.22 -4.95 114.94 118.00 2d9y s ASN 29 Ca 0.03 -0.20 -0.31 0.00 -0.71 0.00 0.00 52.86 51.67 2d9y s ASN 29 Cb -0.14 -1.88 -0.07 0.00 0.41 0.00 0.00 41.25 39.56 2d9y s ASN 29 CO 0.00 0.02 1.48 -0.75 -1.51 0.00 0.00 177.10 176.34 2d9y s LYS 30 N 1.30 4.26 0.01 -0.60 2.20 -1.26 -2.28 119.74 123.37 2d9y s LYS 30 Ca 0.04 2.12 -0.05 0.00 -0.36 0.00 0.00 55.97 57.73 2d9y s LYS 30 Cb -0.15 -3.49 -0.01 0.00 -1.51 0.00 0.00 37.83 32.67 2d9y s LYS 30 CO 0.02 -0.60 0.07 0.50 -0.36 0.00 0.00 175.35 174.99 2d9y s ARG 31 N 2.14 0.45 -0.16 4.03 6.06 -0.59 -4.98 118.95 125.89 2d9y s ARG 31 Ca 0.67 -0.54 -0.28 0.00 -2.50 0.00 0.00 55.73 53.08 2d9y s ARG 31 Cb -0.36 0.18 -0.01 0.00 0.06 0.00 0.00 34.95 34.82 2d9y s ARG 31 CO 0.29 -0.10 0.97 -0.46 -2.50 0.00 0.00 175.30 173.50 2d9y s TRP 32 N -1.64 3.43 -0.06 5.12 -0.11 -0.64 -0.68 118.94 124.36 2d9y s TRP 32 Ca -0.13 1.46 0.03 0.00 1.22 0.00 0.00 56.10 58.68 2d9y s TRP 32 Cb -0.07 -3.17 -0.02 0.00 -1.50 0.00 0.00 33.47 28.71 2d9y s TRP 32 CO -0.00 -0.31 -0.14 -0.06 -4.62 0.00 0.00 176.95 171.82 2d9y s PHE 33 N 2.44 2.73 -0.24 5.86 0.40 -0.51 0.02 117.98 128.68 2d9y s PHE 33 Ca 0.44 -0.23 -0.03 0.00 -0.60 0.00 0.00 56.93 56.51 2d9y s PHE 33 Cb -0.17 -1.67 0.08 0.00 0.51 0.00 0.00 43.02 41.77 2d9y s PHE 33 CO 0.13 0.13 0.09 0.08 0.70 0.00 0.00 175.22 176.34 2d9y s VAL 34 N -0.55 0.29 -0.14 -0.44 1.01 0.16 -0.58 120.40 120.15 2d9y s VAL 34 Ca 0.08 -0.71 -0.29 0.00 0.00 0.00 0.00 61.98 61.06 2d9y s VAL 34 Cb -0.12 -1.05 -0.02 0.00 0.00 0.00 0.00 36.38 35.19 2d9y s VAL 34 CO 0.01 -0.48 1.35 -0.22 0.00 0.00 0.00 175.10 175.77 2d9y s LEU 35 N 1.94 4.21 0.00 3.92 2.96 0.33 -1.13 118.68 130.91 2d9y s LEU 35 Ca 0.05 1.82 0.03 0.00 -0.22 0.00 0.00 54.13 55.81 2d9y s LEU 35 Cb -0.17 -3.54 0.03 0.00 0.50 0.00 0.00 46.19 43.02 2d9y s LEU 35 CO -0.20 -0.80 0.28 0.55 -1.32 0.00 0.00 176.35 174.86 2d9y n VAL 36 N 5.40 0.00 -1.55 1.68 3.14 0.42 -2.34 118.33 125.08 2d9y n VAL 36 Ca 0.15 -1.60 -0.60 0.00 -2.96 0.00 0.00 64.34 59.32 2d9y n VAL 36 Cb 0.44 -0.13 -0.09 0.00 -1.06 0.00 0.00 33.84 33.00 2d9y n VAL 36 CO 0.00 0.00 0.00 -0.90 -6.46 0.00 0.00 176.83 169.47 2d9y n ASP 37 N -1.85 1.53 -2.51 6.55 5.75 -1.26 -0.16 116.55 124.61 2d9y n ASP 37 Ca -0.02 0.90 -0.08 0.00 -0.01 0.00 0.00 54.79 55.58 2d9y n ASP 37 Cb 0.46 -1.01 -0.02 0.00 -1.03 0.00 0.00 41.12 39.52 2d9y n ASP 37 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2d9y n ARG 38 N 5.98 -2.14 -3.96 0.11 1.74 -1.26 -4.78 116.66 112.35 2d9y n ARG 38 Ca 0.38 0.03 -0.09 0.00 -0.77 0.00 0.00 57.85 57.39 2d9y n ARG 38 Cb 0.04 -3.57 -0.04 0.00 -1.02 0.00 0.00 32.46 27.87 2d9y n ARG 38 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2d9y s LEU 40 N -3.03 -0.50 0.06 0.00 2.96 -0.63 0.16 118.68 117.70 2d9y s LEU 40 Ca 0.20 0.88 0.08 0.00 -0.22 0.00 0.00 54.13 55.07 2d9y s LEU 40 Cb -0.02 1.17 -0.03 0.00 0.50 0.00 0.00 46.19 47.81 2d9y s LEU 40 CO 0.10 -0.23 -0.22 -0.36 -1.32 0.00 0.00 176.35 174.33 2d9y s PHE 41 N 2.46 2.46 0.14 5.38 0.40 -0.28 -0.87 117.98 127.66 2d9y s PHE 41 Ca -0.02 -0.32 0.10 0.00 -0.60 0.00 0.00 56.93 56.09 2d9y s PHE 41 Cb -0.12 -1.40 -0.04 0.00 0.51 0.00 0.00 43.02 41.97 2d9y s PHE 41 CO -0.12 0.25 -0.23 1.52 0.70 0.00 0.00 175.22 177.34 2d9y s TYR 42 N -0.94 2.05 0.19 0.36 1.13 -1.22 0.35 117.35 119.27 2d9y s TYR 42 Ca 0.14 -0.40 -0.01 0.00 -1.41 0.00 0.00 57.07 55.39 2d9y s TYR 42 Cb -0.10 -1.07 -0.04 0.00 -1.10 0.00 0.00 41.96 39.64 2d9y s TYR 42 CO 0.05 0.34 0.11 0.71 -2.51 0.00 0.00 175.55 174.25 2d9y s TYR 43 N -1.45 1.12 0.23 -3.49 1.51 0.10 -3.01 117.35 112.37 2d9y s TYR 43 Ca 0.14 -1.32 -0.06 0.00 -1.01 0.00 0.00 57.07 54.82 2d9y s TYR 43 Cb -0.09 -0.57 0.37 0.00 -0.11 0.00 0.00 41.96 41.57 2d9y s TYR 43 CO 0.07 -0.58 1.77 0.87 -1.11 0.00 0.00 175.55 176.57 2d9y h LYS 44 N 2.66 0.58 0.00 -0.62 6.56 -1.85 -1.71 116.57 122.19 2d9y h LYS 44 Ca -0.36 -0.04 -0.07 0.00 -1.06 0.00 0.00 60.65 59.13 2d9y h LYS 44 Cb 1.24 -0.13 -0.01 0.00 -0.57 0.00 0.00 32.23 32.76 2d9y h LYS 44 CO 0.55 0.39 0.07 -0.25 -2.06 0.00 0.00 179.45 178.15 2d9y n ASP 45 N -4.87 -1.09 -0.33 0.86 8.00 -1.26 -4.17 116.55 113.69 2d9y n ASP 45 Ca 0.12 -1.94 0.32 0.00 0.71 0.00 0.00 54.79 54.00 2d9y n ASP 45 Cb 0.31 1.87 0.68 0.00 -0.02 0.00 0.00 41.12 43.96 2d9y n ASP 45 CO 0.00 0.00 0.00 1.05 -0.39 0.00 0.00 177.20 177.86 2d9y h GLU 46 N 0.00 0.11 -1.25 -1.24 4.11 -1.95 0.11 114.58 114.47 2d9y h GLU 46 Ca -0.17 -0.01 0.38 0.00 0.07 0.00 0.00 59.36 59.63 2d9y h GLU 46 Cb 0.67 -0.02 -0.10 0.00 0.50 0.00 0.00 28.75 29.80 2d9y h GLU 46 CO 0.22 0.07 0.83 0.87 0.07 0.00 0.00 179.01 181.07 2d9y h LYS 47 N 0.11 0.17 -6.26 1.06 1.57 -1.97 -3.44 116.57 107.81 2d9y h LYS 47 Ca 0.59 -0.01 -0.46 0.00 -1.87 0.00 0.00 60.65 58.90 2d9y h LYS 47 Cb 2.09 -0.04 -0.23 0.00 0.08 0.00 0.00 32.23 34.13 2d9y h LYS 47 CO -0.11 0.11 -0.68 -0.85 -0.57 0.00 0.00 179.45 177.35 2d9y n GLU 48 N -4.56 -0.86 0.00 3.15 0.28 0.39 -4.76 120.64 114.29 2d9y n GLU 48 Ca 0.32 0.09 -0.12 0.00 -0.16 0.00 0.00 57.16 57.29 2d9y n GLU 48 Cb 1.26 -3.08 -0.14 0.00 1.43 0.00 0.00 31.44 30.92 2d9y n GLU 48 CO 0.00 0.00 0.00 1.05 -0.16 0.00 0.00 177.13 178.02 2d9y h GLU 49 N -0.80 0.08 -4.80 3.44 4.11 -1.85 -3.45 114.58 111.30 2d9y h GLU 49 Ca -0.46 -0.13 -0.62 0.00 0.07 0.00 0.00 59.36 58.23 2d9y h GLU 49 Cb 1.01 0.05 -0.35 0.00 0.50 0.00 0.00 28.75 29.96 2d9y h GLU 49 CO 0.60 0.74 -0.84 0.45 0.07 0.00 0.00 179.01 180.02 2d9y s SER 50 N -6.42 2.76 0.06 3.06 0.15 -1.26 -5.11 113.70 106.94 2d9y s SER 50 Ca -0.08 -0.51 -0.30 0.00 0.70 0.00 0.00 55.95 55.76 2d9y s SER 50 Cb 0.08 -1.24 -0.05 0.00 -1.71 0.00 0.00 66.02 63.10 2d9y s SER 50 CO 0.82 -0.02 1.05 -0.63 1.20 0.00 0.00 173.24 175.65 2d9y s ILE 51 N 1.29 4.47 -0.23 6.45 1.01 -1.26 -4.51 121.20 128.41 2d9y s ILE 51 Ca 0.02 1.86 -0.14 0.00 0.00 0.00 0.00 60.65 62.39 2d9y s ILE 51 Cb -0.14 -4.19 -0.17 0.00 0.01 0.00 0.00 42.46 37.98 2d9y s ILE 51 CO -0.08 0.19 -0.06 0.18 0.00 0.00 0.00 174.94 175.17 2d9y n LEU 52 N 3.49 2.14 -3.60 2.97 4.77 -1.16 -5.04 117.00 120.57 2d9y n LEU 52 Ca 0.06 0.29 -0.14 0.00 -0.03 0.00 0.00 56.01 56.19 2d9y n LEU 52 Cb 0.49 -0.92 -0.06 0.00 -2.33 0.00 0.00 43.42 40.60 2d9y n LEU 52 CO 0.53 0.56 0.25 -0.83 -1.33 0.00 0.00 177.39 176.57 2d9y s GLY 53 N -5.43 -0.39 -0.06 -0.72 0.00 -1.26 -5.08 107.32 94.38 2d9y s GLY 53 Ca -0.33 0.58 0.04 0.00 0.00 0.00 0.00 44.72 45.02 2d9y s GLY 53 CO 0.57 0.29 -0.19 -1.35 0.00 0.00 0.00 173.10 172.42 2d9y s SER 54 N -1.87 3.56 -0.31 1.64 1.04 -1.26 -3.40 113.70 113.09 2d9y s SER 54 Ca -0.06 -0.37 0.02 0.00 0.48 0.00 0.00 55.95 56.03 2d9y s SER 54 Cb -0.01 -0.90 0.08 0.00 0.10 0.00 0.00 66.02 65.29 2d9y s SER 54 CO -0.00 0.28 -0.00 -0.63 0.98 0.00 0.00 173.24 173.86 2d9y s ILE 55 N -0.34 2.40 -0.80 -1.02 1.01 -0.05 -5.00 121.20 117.39 2d9y s ILE 55 Ca 0.02 -1.95 -0.25 0.00 0.00 0.00 0.00 60.65 58.47 2d9y s ILE 55 Cb -0.12 -2.58 -0.04 0.00 0.01 0.00 0.00 42.46 39.72 2d9y s ILE 55 CO 0.02 -0.34 1.92 -2.16 0.00 0.00 0.00 174.94 174.38 2d9y s PRO 56 N 1.03 2.57 -1.10 2.79 0.04 -1.26 -1.60 135.00 137.48 2d9y s PRO 56 Ca 0.01 0.03 -0.08 0.00 0.04 0.00 0.00 61.00 61.01 2d9y s PRO 56 Cb -0.20 -4.82 -0.07 0.00 0.04 0.00 0.00 34.50 29.45 2d9y s PRO 56 CO -0.06 -3.16 2.97 1.28 0.04 0.00 0.00 177.00 178.07 2d9y n LEU 57 N 13.57 7.64 -0.07 -3.56 4.77 -1.14 -4.47 117.00 133.75 2d9y n LEU 57 Ca 0.33 -4.20 -0.05 0.00 -0.03 0.00 0.00 56.01 52.06 2d9y n LEU 57 Cb 0.49 -1.45 -0.02 0.00 -2.33 0.00 0.00 43.42 40.10 2d9y n LEU 57 CO 0.64 1.96 -0.28 0.25 -1.33 0.00 0.00 177.39 178.63 2d9y h LEU 58 N 5.96 0.00 -4.61 2.23 5.85 -1.75 -2.94 115.31 120.05 2d9y h LEU 58 Ca 0.65 -0.06 -0.48 0.00 0.84 0.00 0.00 57.88 58.82 2d9y h LEU 58 Cb 0.59 0.00 -0.41 0.00 0.37 0.00 0.00 40.66 41.21 2d9y h LEU 58 CO 1.30 0.77 -0.91 -0.24 -0.34 0.00 0.00 178.44 179.02 2d9y n SER 59 N -4.63 3.55 -4.95 1.25 2.88 -1.24 -4.30 113.62 106.18 2d9y n SER 59 Ca -0.08 -3.28 -0.24 0.00 -1.33 0.00 0.00 58.87 53.95 2d9y n SER 59 Cb 0.26 -0.46 0.03 0.00 -0.75 0.00 0.00 64.21 63.28 2d9y n SER 59 CO 0.00 0.00 0.00 -0.36 -1.23 0.00 0.00 175.04 173.45 2d9y s PHE 60 N -3.47 3.13 -0.47 0.66 0.40 -1.24 -3.97 117.98 113.03 2d9y s PHE 60 Ca 0.41 0.29 0.02 0.00 -0.60 0.00 0.00 56.93 57.05 2d9y s PHE 60 Cb 0.41 -2.57 0.12 0.00 0.51 0.00 0.00 43.02 41.50 2d9y s PHE 60 CO -0.07 -0.65 0.22 0.50 0.70 0.00 0.00 175.22 175.92 2d9y s ARG 61 N -4.75 1.95 -0.14 0.44 3.52 0.11 -4.31 118.95 115.77 2d9y s ARG 61 Ca 0.52 -2.27 -0.16 0.00 -0.13 0.00 0.00 55.73 53.70 2d9y s ARG 61 Cb -0.10 -3.41 -0.04 0.00 -1.56 0.00 0.00 34.95 29.84 2d9y s ARG 61 CO 0.40 -1.07 0.37 0.08 -0.81 0.00 0.00 175.30 174.28 2d9y s VAL 62 N 0.32 5.25 -0.25 7.11 1.01 -1.26 -3.27 120.40 129.32 2d9y s VAL 62 Ca 0.14 0.72 -0.29 0.00 0.00 0.00 0.00 61.98 62.55 2d9y s VAL 62 Cb -0.22 -3.71 0.17 0.00 0.00 0.00 0.00 36.38 32.62 2d9y s VAL 62 CO -0.04 0.37 1.24 0.00 0.00 0.00 0.00 175.10 176.68 2d9y s ALA 63 N 0.47 -2.07 0.03 5.51 0.00 -0.92 -4.87 121.76 119.92 2d9y s ALA 63 Ca 0.21 1.77 -0.31 0.00 0.00 0.00 0.00 51.96 53.63 2d9y s ALA 63 Cb -0.14 -1.31 -0.16 0.00 0.00 0.00 0.00 23.12 21.51 2d9y s ALA 63 CO 0.07 -0.24 0.79 0.00 0.00 0.00 0.00 175.76 176.38 2d9y n ALA 64 N 0.83 -3.01 -0.81 0.00 0.00 -1.26 -1.94 120.51 114.32 2d9y n ALA 64 Ca -0.05 0.47 -0.34 0.00 0.00 0.00 0.00 53.44 53.52 2d9y n ALA 64 Cb 0.58 -1.43 0.12 0.00 0.00 0.00 0.00 19.45 18.71 2d9y n ALA 64 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 2d9y n VAL 65 N 0.99 0.00 -3.64 0.00 0.24 -0.99 -4.66 118.33 110.27 2d9y n VAL 65 Ca 0.16 -0.25 -0.24 0.00 -2.04 0.00 0.00 64.34 61.97 2d9y n VAL 65 Cb 0.10 -0.48 -0.02 0.00 -1.47 0.00 0.00 33.84 31.96 2d9y n VAL 65 CO 0.00 0.00 0.00 -1.10 -2.14 0.00 0.00 176.83 173.59 2d9y s GLN 66 N -3.24 3.49 0.00 7.34 -0.21 -1.26 -4.97 119.66 120.80 2d9y s GLN 66 Ca 0.53 -0.45 0.13 0.00 0.02 0.00 0.00 55.36 55.59 2d9y s GLN 66 Cb -0.16 -2.78 0.78 0.00 1.00 0.00 0.00 33.01 31.85 2d9y s GLN 66 CO 0.69 0.31 1.21 -0.35 -2.12 0.00 0.00 175.29 175.03 2d9y n PRO 67 N -1.31 0.49 -2.57 2.91 -0.04 -1.26 -2.90 135.00 130.32 2d9y n PRO 67 Ca -0.06 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.26 2d9y n PRO 67 Cb 0.56 -1.42 0.02 0.00 -0.04 0.00 0.00 33.50 32.62 2d9y n PRO 67 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2d9y n SER 68 N -0.92 2.77 -0.01 3.54 3.41 -1.26 -4.76 113.62 116.39 2d9y n SER 68 Ca 0.10 -2.97 0.00 0.00 -0.26 0.00 0.00 58.87 55.74 2d9y n SER 68 Cb 0.05 -0.48 0.01 0.00 -0.26 0.00 0.00 64.21 63.52 2d9y n SER 68 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2d9y n ASP 69 N -0.36 1.42 -3.21 4.04 9.92 -1.14 -4.99 116.55 122.23 2d9y n ASP 69 Ca 0.21 -1.77 -0.23 0.00 -0.53 0.00 0.00 54.79 52.47 2d9y n ASP 69 Cb 0.79 -0.02 0.05 0.00 -0.64 0.00 0.00 41.12 41.30 2d9y n ASP 69 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 2d9y n ASN 70 N -0.39 -6.24 -4.36 -2.24 4.13 -1.26 -4.93 115.26 99.96 2d9y n ASN 70 Ca 0.01 -0.37 -0.46 0.00 1.68 0.00 0.00 54.58 55.43 2d9y n ASN 70 Cb 0.34 -5.00 -0.02 0.00 -1.54 0.00 0.00 39.78 33.56 2d9y n ASN 70 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 2d9y s ILE 71 N -3.23 5.42 -0.19 2.41 -1.09 -1.26 -4.90 121.20 118.36 2d9y s ILE 71 Ca 0.40 -2.31 -0.02 0.00 -2.23 0.00 0.00 60.65 56.49 2d9y s ILE 71 Cb -0.18 -4.56 0.06 0.00 -1.58 0.00 0.00 42.46 36.20 2d9y s ILE 71 CO 0.49 -1.16 2.33 -1.20 -1.23 0.00 0.00 174.94 174.17 2d9y n SER 72 N 4.54 5.93 -3.79 3.58 7.64 -1.26 -4.80 113.62 125.47 2d9y n SER 72 Ca 0.17 -2.78 -0.13 0.00 1.01 0.00 0.00 58.87 57.13 2d9y n SER 72 Cb 0.47 -1.15 -0.14 0.00 -1.01 0.00 0.00 64.21 62.38 2d9y n SER 72 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2d9y s ARG 73 N -0.81 0.08 0.58 1.43 0.52 -1.26 -5.16 118.95 114.33 2d9y s ARG 73 Ca 0.29 0.25 -0.12 0.00 -0.52 0.00 0.00 55.73 55.63 2d9y s ARG 73 Cb 0.19 -0.10 -0.05 0.00 0.52 0.00 0.00 34.95 35.51 2d9y s ARG 73 CO -0.03 -0.11 1.00 0.15 0.02 0.00 0.00 175.30 176.33 2d9y s LYS 74 N 0.71 3.71 -1.28 3.54 1.02 -1.26 -4.11 119.74 122.07 2d9y s LYS 74 Ca -0.05 0.78 -0.03 0.00 0.02 0.00 0.00 55.97 56.68 2d9y s LYS 74 Cb -0.07 -2.12 0.01 0.00 -0.52 0.00 0.00 37.83 35.13 2d9y s LYS 74 CO -0.03 -0.45 1.01 0.72 -0.92 0.00 0.00 175.35 175.69 2d9y n HIS 75 N -2.33 -2.37 -4.68 3.18 8.25 -1.26 -4.43 115.22 111.58 2d9y n HIS 75 Ca 0.06 0.95 -0.28 0.00 -0.26 0.00 0.00 57.72 58.19 2d9y n HIS 75 Cb 0.54 -4.92 -0.14 0.00 1.12 0.00 0.00 29.99 26.59 2d9y n HIS 75 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 2d9y s THR 76 N -3.39 1.95 0.27 1.59 2.01 -1.26 -0.28 115.64 116.54 2d9y s THR 76 Ca 0.21 -1.39 0.04 0.00 0.31 0.00 0.00 61.69 60.86 2d9y s THR 76 Cb -0.10 -1.70 -0.06 0.00 0.01 0.00 0.00 72.50 70.66 2d9y s THR 76 CO 0.75 0.23 0.02 0.72 -0.69 0.00 0.00 174.62 175.65 2d9y s PHE 77 N -0.87 1.74 0.07 4.92 -0.71 -0.41 -2.33 117.98 120.39 2d9y s PHE 77 Ca 0.10 -0.92 0.08 0.00 -1.04 0.00 0.00 56.93 55.15 2d9y s PHE 77 Cb -0.10 -1.05 -0.03 0.00 -1.21 0.00 0.00 43.02 40.63 2d9y s PHE 77 CO 0.03 -0.00 -0.22 -1.59 -1.34 0.00 0.00 175.22 172.09 2d9y s LYS 78 N -3.87 1.36 -0.19 1.99 -2.85 -0.82 -1.69 119.74 113.68 2d9y s LYS 78 Ca 0.32 -1.08 -0.04 0.00 -1.00 0.00 0.00 55.97 54.17 2d9y s LYS 78 Cb 0.07 -1.58 0.06 0.00 -2.06 0.00 0.00 37.83 34.32 2d9y s LYS 78 CO 0.12 0.39 0.07 0.00 0.10 0.00 0.00 175.35 176.02 2d9y s ALA 79 N -0.95 0.72 0.04 0.59 0.00 0.16 -2.16 121.76 120.16 2d9y s ALA 79 Ca 0.08 -0.55 0.02 0.00 0.00 0.00 0.00 51.96 51.52 2d9y s ALA 79 Cb -0.09 -1.13 -0.02 0.00 0.00 0.00 0.00 23.12 21.87 2d9y s ALA 79 CO 0.03 -1.21 -0.08 -1.83 0.00 0.00 0.00 175.76 172.67 2d9y s GLU 80 N 2.00 0.53 0.54 0.00 -1.05 -1.20 0.71 118.70 120.23 2d9y s GLU 80 Ca 0.01 -0.68 -0.09 0.00 -0.15 0.00 0.00 54.97 54.06 2d9y s GLU 80 Cb -0.17 -0.35 0.13 0.00 -0.44 0.00 0.00 34.13 33.30 2d9y s GLU 80 CO -0.10 0.07 0.72 1.58 0.95 0.00 0.00 175.26 178.48 2d9y n HIS 81 N 1.69 -3.97 -0.29 4.83 -0.00 -1.11 0.06 115.22 116.43 2d9y n HIS 81 Ca -0.21 -0.64 -0.04 0.00 -0.00 0.00 0.00 57.72 56.84 2d9y n HIS 81 Cb 0.55 -0.57 0.01 0.00 -0.00 0.00 0.00 29.99 29.99 2d9y n HIS 81 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2d9y n ALA 82 N -3.51 3.95 0.00 1.57 0.00 -1.25 -4.28 120.51 116.99 2d9y n ALA 82 Ca -0.12 -0.39 0.00 0.00 0.00 0.00 0.00 53.44 52.93 2d9y n ALA 82 Cb 0.32 -1.08 0.00 0.00 0.00 0.00 0.00 19.45 18.68 2d9y n ALA 82 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2d9y n GLY 83 N 1.01 0.73 0.78 0.00 0.00 -1.26 -5.10 105.19 101.35 2d9y n GLY 83 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 2d9y n GLY 83 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2d9y n VAL 84 N 0.00 0.00 -3.57 1.61 0.31 -1.26 -5.15 118.33 110.27 2d9y n VAL 84 Ca 0.00 0.00 -0.16 0.00 -0.01 0.00 0.00 64.34 64.17 2d9y n VAL 84 Cb 0.00 -0.36 -0.06 0.00 -0.91 0.00 0.00 33.84 32.51 2d9y n VAL 84 CO 0.00 0.00 0.00 -0.60 -1.32 0.00 0.00 176.83 174.91 2d9y s ARG 85 N -0.51 0.99 -0.09 5.55 6.06 -1.26 -4.99 118.95 124.71 2d9y s ARG 85 Ca 0.00 0.06 -0.04 0.00 -2.50 0.00 0.00 55.73 53.26 2d9y s ARG 85 Cb 0.00 0.46 -0.04 0.00 0.06 0.00 0.00 34.95 35.44 2d9y s ARG 85 CO 0.00 -0.32 0.06 0.99 -2.50 0.00 0.00 175.30 173.53 2d9y s THR 86 N -1.54 4.82 0.21 4.11 2.01 -1.26 -2.75 115.64 121.24 2d9y s THR 86 Ca -0.10 -0.10 0.11 0.00 0.31 0.00 0.00 61.69 61.91 2d9y s THR 86 Cb -0.01 -3.08 -0.04 0.00 0.01 0.00 0.00 72.50 69.37 2d9y s THR 86 CO 0.06 0.57 -0.22 -0.31 -0.69 0.00 0.00 174.62 174.04 2d9y s TYR 87 N -0.98 2.18 -0.03 4.92 1.51 0.22 -4.93 117.35 120.23 2d9y s TYR 87 Ca 0.15 -0.38 -0.01 0.00 -1.01 0.00 0.00 57.07 55.82 2d9y s TYR 87 Cb -0.12 -1.05 0.03 0.00 -0.11 0.00 0.00 41.96 40.71 2d9y s TYR 87 CO 0.05 0.51 0.05 -0.06 -1.11 0.00 0.00 175.55 174.98 2d9y s PHE 88 N -1.97 0.04 -0.05 2.71 0.08 -1.26 -0.66 117.98 116.87 2d9y s PHE 88 Ca 0.22 0.22 0.02 0.00 0.12 0.00 0.00 56.93 57.50 2d9y s PHE 88 Cb -0.07 -0.36 0.01 0.00 -0.57 0.00 0.00 43.02 42.04 2d9y s PHE 88 CO 0.10 -0.15 -0.10 -0.06 -0.10 0.00 0.00 175.22 174.92 2d9y s PHE 89 N 1.67 1.17 -0.16 0.36 0.08 -0.68 -2.82 117.98 117.60 2d9y s PHE 89 Ca -0.02 -0.38 -0.05 0.00 0.12 0.00 0.00 56.93 56.60 2d9y s PHE 89 Cb -0.12 -0.88 -0.03 0.00 -0.57 0.00 0.00 43.02 41.41 2d9y s PHE 89 CO -0.03 -0.21 0.00 0.45 -0.10 0.00 0.00 175.22 175.33 2d9y s SER 90 N 0.60 5.13 -0.18 1.36 0.15 -0.46 -1.29 113.70 119.02 2d9y s SER 90 Ca -0.11 -0.03 -0.09 0.00 0.70 0.00 0.00 55.95 56.42 2d9y s SER 90 Cb -0.14 -1.83 -0.05 0.00 -1.71 0.00 0.00 66.02 62.30 2d9y s SER 90 CO 0.02 0.19 0.11 0.00 1.20 0.00 0.00 173.24 174.76 2d9y s ALA 91 N 0.27 3.66 0.23 5.45 0.00 0.62 -2.64 121.76 129.34 2d9y s ALA 91 Ca -0.00 -0.69 -0.08 0.00 0.00 0.00 0.00 51.96 51.18 2d9y s ALA 91 Cb -0.13 -2.06 0.37 0.00 0.00 0.00 0.00 23.12 21.29 2d9y s ALA 91 CO 0.02 0.26 1.68 0.93 0.00 0.00 0.00 175.76 178.66 2d9y h GLU 92 N 6.32 0.22 -6.21 0.00 5.08 -1.85 -3.42 114.58 114.72 2d9y h GLU 92 Ca -0.43 -0.01 -0.55 0.00 -1.00 0.00 0.00 59.36 57.37 2d9y h GLU 92 Cb 1.17 -0.05 -0.09 0.00 0.50 0.00 0.00 28.75 30.28 2d9y h GLU 92 CO 0.71 0.14 -0.62 -1.12 -1.00 0.00 0.00 179.01 177.12 2d9y s SER 93 N -5.26 4.75 0.29 1.42 0.01 -1.26 -5.01 113.70 108.65 2d9y s SER 93 Ca -0.13 -0.56 0.08 0.00 1.31 0.00 0.00 55.95 56.65 2d9y s SER 93 Cb 0.20 -0.97 0.44 0.00 0.21 0.00 0.00 66.02 65.90 2d9y s SER 93 CO 0.75 -0.00 1.68 1.55 0.41 0.00 0.00 173.24 177.62 2d9y h PRO 94 N 1.83 0.17 -0.89 12.44 0.13 -1.92 -3.08 132.00 140.69 2d9y h PRO 94 Ca -0.45 -0.09 -0.01 0.00 -0.87 0.00 0.00 66.00 64.58 2d9y h PRO 94 Cb 1.25 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.34 2d9y h PRO 94 CO 0.60 0.61 0.53 1.05 -0.23 0.00 0.00 178.00 180.56 2d9y h GLU 95 N 0.14 1.22 0.37 0.86 4.11 -1.96 -3.04 114.58 116.29 2d9y h GLU 95 Ca 0.01 -0.12 -0.02 0.00 0.07 0.00 0.00 59.36 59.30 2d9y h GLU 95 Cb 0.88 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 29.89 2d9y h GLU 95 CO 0.07 0.86 -0.18 0.93 0.07 0.00 0.00 179.01 180.76 2d9y h GLU 96 N 1.23 -0.48 -0.55 1.06 5.08 -1.93 -2.23 114.58 116.76 2d9y h GLU 96 Ca 0.32 0.03 0.05 0.00 -1.00 0.00 0.00 59.36 58.76 2d9y h GLU 96 Cb -0.03 0.11 -0.07 0.00 0.50 0.00 0.00 28.75 29.26 2d9y h GLU 96 CO -0.06 -0.18 -0.32 0.94 -1.00 0.00 0.00 179.01 178.39 2d9y n GLN 97 N -5.19 -0.24 -0.07 2.33 7.27 -1.17 -0.39 117.38 119.92 2d9y n GLN 97 Ca -0.10 1.17 -0.07 0.00 0.07 0.00 0.00 57.00 58.06 2d9y n GLN 97 Cb 0.28 -1.72 -0.01 0.00 2.41 0.00 0.00 30.24 31.19 2d9y n GLN 97 CO 0.00 0.00 0.00 0.93 0.07 0.00 0.00 177.06 178.06 2d9y h GLU 98 N 0.00 0.10 -0.64 3.69 5.08 -1.61 -1.85 114.58 119.36 2d9y h GLU 98 Ca 0.09 -0.01 0.13 0.00 -1.00 0.00 0.00 59.36 58.57 2d9y h GLU 98 Cb 0.23 -0.02 -0.12 0.00 0.50 0.00 0.00 28.75 29.33 2d9y h GLU 98 CO -0.52 0.07 -0.19 0.00 -1.00 0.00 0.00 179.01 177.37 2d9y h ALA 99 N 1.22 0.35 0.73 3.43 0.00 -0.07 -2.06 119.26 122.87 2d9y h ALA 99 Ca 0.12 0.24 -0.04 0.00 0.00 0.00 0.00 54.91 55.24 2d9y h ALA 99 Cb 0.15 0.55 0.01 0.00 0.00 0.00 0.00 17.79 18.49 2d9y h ALA 99 CO -0.19 -0.46 -0.35 -1.49 0.00 0.00 0.00 179.25 176.75 2d9y h TRP 100 N -0.03 -0.91 -1.75 0.00 4.06 -0.34 0.20 115.95 117.18 2d9y h TRP 100 Ca 0.30 -0.02 0.53 0.00 2.06 0.00 0.00 58.89 61.76 2d9y h TRP 100 Cb 0.49 0.30 -0.09 0.00 -1.00 0.00 0.00 29.16 28.87 2d9y h TRP 100 CO -0.55 -0.55 1.23 -0.89 -3.56 0.00 0.00 178.44 174.12 2d9y n ILE 101 N -5.49 -0.06 -0.10 1.49 5.41 -0.73 -0.30 119.36 119.57 2d9y n ILE 101 Ca -0.14 1.50 -0.20 0.00 1.00 0.00 0.00 62.75 64.90 2d9y n ILE 101 Cb 0.40 -2.48 -0.10 0.00 -0.71 0.00 0.00 39.64 36.75 2d9y n ILE 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2d9y n GLN 102 N -4.03 0.55 0.04 0.38 1.13 -0.91 -2.19 117.38 112.35 2d9y n GLN 102 Ca 0.42 0.52 -0.16 0.00 -1.94 0.00 0.00 57.00 55.84 2d9y n GLN 102 Cb 1.82 -1.70 -0.10 0.00 0.11 0.00 0.00 30.24 30.37 2d9y n GLN 102 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2d9y h ALA 103 N -0.64 -0.94 0.03 -1.58 0.00 0.25 0.27 119.26 116.64 2d9y h ALA 103 Ca -0.35 -0.08 -0.24 0.00 0.00 0.00 0.00 54.91 54.25 2d9y h ALA 103 Cb 1.24 0.97 0.00 0.00 0.00 0.00 0.00 17.79 20.00 2d9y h ALA 103 CO -0.21 -1.11 -1.00 0.00 0.00 0.00 0.00 179.25 176.93 2d9y h MET 104 N -0.65 0.40 -0.79 0.00 -0.00 -1.11 -3.24 114.93 109.54 2d9y h MET 104 Ca 0.02 -0.46 0.07 0.00 -0.00 0.00 0.00 59.70 59.32 2d9y h MET 104 Cb 0.71 0.14 -0.06 0.00 -0.00 0.00 0.00 31.60 32.39 2d9y h MET 104 CO -0.37 1.14 0.47 0.78 -0.00 0.00 0.00 176.91 178.92 2d9y h GLY 105 N 1.25 1.20 1.20 -3.00 0.00 -1.12 -1.13 103.07 101.46 2d9y h GLY 105 Ca -0.09 -0.32 -0.08 0.00 0.00 0.00 0.00 47.33 46.84 2d9y h GLY 105 CO 0.17 0.19 0.06 1.05 0.00 0.00 0.00 176.54 178.01 2d9y h GLU 106 N 0.83 0.98 0.00 4.80 4.11 -0.53 0.35 114.58 125.11 2d9y h GLU 106 Ca 0.36 -0.26 -0.03 0.00 0.07 0.00 0.00 59.36 59.49 2d9y h GLU 106 Cb 0.24 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.37 2d9y h GLU 106 CO -0.20 0.93 -0.16 0.00 0.07 0.00 0.00 179.01 179.64 2d9y h ALA 107 N 1.14 1.10 0.07 1.06 0.00 -1.36 -3.08 119.26 118.18 2d9y h ALA 107 Ca 0.18 -0.15 -0.35 0.00 0.00 0.00 0.00 54.91 54.59 2d9y h ALA 107 Cb 0.45 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.18 2d9y h ALA 107 CO 0.02 0.20 -2.02 0.00 0.00 0.00 0.00 179.25 177.45 2d9y n ALA 108 N -2.22 1.16 -1.57 0.00 0.00 -0.51 -4.33 120.51 113.05 2d9y n ALA 108 Ca -0.01 -0.76 -0.30 0.00 0.00 0.00 0.00 53.44 52.38 2d9y n ALA 108 Cb 0.34 -0.61 0.19 0.00 0.00 0.00 0.00 19.45 19.37 2d9y n ALA 108 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 2d9y s ARG 109 N -2.56 0.24 -0.14 0.00 1.70 0.12 -3.59 118.95 114.72 2d9y s ARG 109 Ca -0.19 -0.11 -0.07 0.00 -0.47 0.00 0.00 55.73 54.89 2d9y s ARG 109 Cb 0.07 -1.77 0.05 0.00 -0.57 0.00 0.00 34.95 32.74 2d9y s ARG 109 CO 0.77 -2.73 0.34 0.08 -1.08 0.00 0.00 175.30 172.67 2d9y s VAL 110 N -3.45 -0.04 -0.05 4.99 1.01 -1.26 -4.91 120.40 116.69 2d9y s VAL 110 Ca 0.70 0.12 -0.01 0.00 0.00 0.00 0.00 61.98 62.79 2d9y s VAL 110 Cb -0.09 -0.51 0.03 0.00 0.00 0.00 0.00 36.38 35.81 2d9y s VAL 110 CO 0.54 0.05 0.01 -1.58 0.00 0.00 0.00 175.10 174.12 2d9y s GLN 111 N 1.37 0.36 0.29 2.72 2.00 -1.26 -5.13 119.66 120.01 2d9y s GLN 111 Ca -0.09 0.13 -0.29 0.00 -2.00 0.00 0.00 55.36 53.11 2d9y s GLN 111 Cb -0.09 -0.67 -0.10 0.00 0.80 0.00 0.00 33.01 32.95 2d9y s GLN 111 CO -0.11 -0.22 1.36 0.45 -0.50 0.00 0.00 175.29 176.27 2d9y s SER 112 N 1.53 6.73 0.00 6.67 0.15 -1.26 -5.02 113.70 122.49 2d9y s SER 112 Ca -0.02 2.67 0.00 0.00 0.70 0.00 0.00 55.95 59.29 2d9y s SER 112 Cb -0.13 -2.64 0.00 0.00 -1.71 0.00 0.00 66.02 61.54 2d9y s SER 112 CO -0.03 -0.60 0.00 0.61 1.20 0.00 0.00 173.24 174.42 2d9y n GLY 113 N 1.42 2.52 0.00 9.45 0.00 -1.26 -4.93 105.19 112.39 2d9y n GLY 113 Ca 0.03 -1.79 0.06 0.00 0.00 0.00 0.00 46.02 44.32 2d9y n GLY 113 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2d9y n PRO 114 N 0.00 0.49 -3.45 1.61 -0.04 -1.26 -4.83 135.00 127.52 2d9y n PRO 114 Ca 0.00 0.00 -0.25 0.00 -0.04 0.00 0.00 63.50 63.21 2d9y n PRO 114 Cb 0.00 -1.37 0.03 0.00 -0.04 0.00 0.00 33.50 32.11 2d9y n PRO 114 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2d9y n SER 115 N -0.87 -5.06 0.07 3.54 3.41 -1.26 -4.88 113.62 108.57 2d9y n SER 115 Ca 0.09 -0.49 -0.23 0.00 -0.26 0.00 0.00 58.87 57.98 2d9y n SER 115 Cb 0.04 -4.08 -0.15 0.00 -0.26 0.00 0.00 64.21 59.76 2d9y n SER 115 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2d9y h SER 116 N -1.61 0.61 0.00 4.04 4.64 -2.03 -3.56 113.55 115.63 2d9y h SER 116 Ca -0.52 -0.92 0.00 0.00 -0.47 0.00 0.00 61.79 59.88 2d9y h SER 116 Cb 1.35 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 2d9y h SER 116 CO 0.59 1.74 0.00 0.61 -0.87 0.00 0.00 176.83 178.90