#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 5.16 -0.87 1.61 0.15 -1.26 -5.06 113.70 113.43 2d9y s SER 2 Ca 0.00 0.12 -0.21 0.00 0.70 0.00 0.00 55.95 56.55 2d9y s SER 2 Cb 0.00 -1.44 0.09 0.00 -1.71 0.00 0.00 66.02 62.95 2d9y s SER 2 CO 0.00 0.37 1.18 -0.55 1.20 0.00 0.00 173.24 175.45 2d9y s SER 3 N -0.84 6.44 0.47 5.45 0.15 -1.26 -4.91 113.70 119.21 2d9y s SER 3 Ca 0.13 -1.49 0.00 0.00 0.70 0.00 0.00 55.95 55.28 2d9y s SER 3 Cb -0.11 -2.46 0.00 0.00 -1.71 0.00 0.00 66.02 61.73 2d9y s SER 3 CO 0.02 -1.34 0.00 0.61 1.20 0.00 0.00 173.24 173.73 2d9y n GLY 4 N 5.80 1.21 2.72 9.45 0.00 -1.26 -4.08 105.19 119.04 2d9y n GLY 4 Ca 0.18 0.65 -0.22 0.00 0.00 0.00 0.00 46.02 46.63 2d9y n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2d9y s SER 5 N -4.00 1.47 0.31 1.61 0.15 -1.26 -5.15 113.70 106.82 2d9y s SER 5 Ca 0.00 -0.06 0.11 0.00 0.70 0.00 0.00 55.95 56.70 2d9y s SER 5 Cb 0.00 -0.31 -0.06 0.00 -1.71 0.00 0.00 66.02 63.94 2d9y s SER 5 CO 0.00 -0.23 -0.14 -0.94 1.20 0.00 0.00 173.24 173.13 2d9y s SER 6 N 2.06 3.72 -0.13 5.45 1.04 -1.26 -4.98 113.70 119.60 2d9y s SER 6 Ca 0.05 -1.08 -0.07 0.00 0.48 0.00 0.00 55.95 55.33 2d9y s SER 6 Cb -0.12 -0.35 0.03 0.00 0.10 0.00 0.00 66.02 65.67 2d9y s SER 6 CO -0.05 -0.07 0.14 0.61 0.98 0.00 0.00 173.24 174.85 2d9y n GLY 7 N -0.72 -4.38 3.85 7.32 0.00 -1.26 -5.02 105.19 104.98 2d9y n GLY 7 Ca -0.05 0.93 -0.36 0.00 0.00 0.00 0.00 46.02 46.53 2d9y n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2d9y s ASN 8 N -0.53 6.19 0.16 1.61 2.20 -1.26 -5.08 114.94 118.23 2d9y s ASN 8 Ca -0.16 0.41 -0.20 0.00 -0.94 0.00 0.00 52.86 51.96 2d9y s ASN 8 Cb 0.01 -1.96 0.05 0.00 -2.00 0.00 0.00 41.25 37.35 2d9y s ASN 8 CO 0.52 0.40 0.55 0.00 -2.94 0.00 0.00 177.10 175.62 2d9y s ALA 9 N -1.02 -1.31 0.67 3.54 0.00 -1.26 -5.16 121.76 117.22 2d9y s ALA 9 Ca 0.15 0.20 -0.15 0.00 0.00 0.00 0.00 51.96 52.16 2d9y s ALA 9 Cb -0.12 0.83 0.00 0.00 0.00 0.00 0.00 23.12 23.84 2d9y s ALA 9 CO 0.04 -0.76 1.11 -1.25 0.00 0.00 0.00 175.76 174.90 2d9y s PRO 10 N -3.79 2.77 0.47 0.00 0.04 -1.26 -4.81 135.00 128.41 2d9y s PRO 10 Ca 0.03 1.37 -0.25 0.00 0.04 0.00 0.00 61.00 62.20 2d9y s PRO 10 Cb -0.01 -1.95 -0.08 0.00 0.04 0.00 0.00 34.50 32.51 2d9y s PRO 10 CO -0.10 -1.27 1.41 0.28 0.04 0.00 0.00 177.00 177.36 2d9y n VAL 11 N -2.49 2.99 -0.10 -0.36 0.31 -1.26 -4.46 118.33 112.96 2d9y n VAL 11 Ca 0.10 -0.50 -0.20 0.00 -0.01 0.00 0.00 64.34 63.74 2d9y n VAL 11 Cb 0.52 -1.80 -0.11 0.00 -0.91 0.00 0.00 33.84 31.55 2d9y n VAL 11 CO 0.00 0.00 0.00 0.74 -1.32 0.00 0.00 176.83 176.25 2d9y h THR 12 N 2.11 0.89 -2.66 2.52 2.02 -1.64 -3.49 112.91 112.67 2d9y h THR 12 Ca -0.51 -2.08 -0.10 0.00 0.77 0.00 0.00 66.41 64.50 2d9y h THR 12 Cb 1.28 2.09 -0.20 0.00 -1.74 0.00 0.00 68.15 69.58 2d9y h THR 12 CO 0.60 0.30 -0.12 -0.75 0.37 0.00 0.00 175.52 175.93 2d9y s LYS 13 N -2.33 0.78 -0.13 6.66 2.20 -1.03 -5.02 119.74 120.87 2d9y s LYS 13 Ca -0.27 0.03 -0.07 0.00 -0.36 0.00 0.00 55.97 55.31 2d9y s LYS 13 Cb 0.05 0.36 0.05 0.00 -1.51 0.00 0.00 37.83 36.78 2d9y s LYS 13 CO 0.56 -0.22 0.30 0.00 -0.36 0.00 0.00 175.35 175.63 2d9y s ALA 14 N -1.14 -0.73 -0.04 3.13 0.00 -1.26 0.63 121.76 122.34 2d9y s ALA 14 Ca -0.12 1.18 -0.30 0.00 0.00 0.00 0.00 51.96 52.72 2d9y s ALA 14 Cb -0.03 -0.77 0.11 0.00 0.00 0.00 0.00 23.12 22.43 2d9y s ALA 14 CO 0.06 -0.26 1.03 0.20 0.00 0.00 0.00 175.76 176.80 2d9y s GLY 15 N 1.40 -0.38 -0.23 0.00 0.00 0.55 -5.00 107.32 103.67 2d9y s GLY 15 Ca -0.09 1.06 -0.29 0.00 0.00 0.00 0.00 44.72 45.40 2d9y s GLY 15 CO -0.10 0.34 1.28 -0.98 0.00 0.00 0.00 173.10 173.64 2d9y s TRP 16 N -2.86 2.77 -0.10 1.90 0.52 -1.26 -0.75 118.94 119.17 2d9y s TRP 16 Ca 0.08 0.95 0.03 0.00 0.02 0.00 0.00 56.10 57.17 2d9y s TRP 16 Cb -0.01 -3.69 0.01 0.00 -1.15 0.00 0.00 33.47 28.64 2d9y s TRP 16 CO -0.06 -1.71 -0.17 -0.51 0.02 0.00 0.00 176.95 174.52 2d9y s LEU 17 N 3.93 1.83 -0.17 2.99 1.43 0.19 -4.65 118.68 124.23 2d9y s LEU 17 Ca 0.55 -0.45 -0.29 0.00 -1.03 0.00 0.00 54.13 52.92 2d9y s LEU 17 Cb -0.19 -1.14 -0.02 0.00 0.03 0.00 0.00 46.19 44.87 2d9y s LEU 17 CO 0.18 0.06 1.37 -0.36 0.23 0.00 0.00 176.35 177.84 2d9y s PHE 18 N 0.72 2.60 -0.48 0.29 0.40 -1.10 -2.06 117.98 118.36 2d9y s PHE 18 Ca -0.12 0.80 -0.19 0.00 -0.60 0.00 0.00 56.93 56.82 2d9y s PHE 18 Cb -0.16 -3.68 0.04 0.00 0.51 0.00 0.00 43.02 39.74 2d9y s PHE 18 CO 0.03 -2.20 0.60 0.21 0.70 0.00 0.00 175.22 174.56 2d9y s LYS 19 N 3.80 3.16 0.69 0.44 2.20 0.14 -2.72 119.74 127.45 2d9y s LYS 19 Ca 0.60 -0.73 -0.18 0.00 -0.36 0.00 0.00 55.97 55.30 2d9y s LYS 19 Cb -0.23 -4.04 -0.15 0.00 -1.51 0.00 0.00 37.83 31.90 2d9y s LYS 19 CO 0.20 -1.11 -0.39 0.94 -0.36 0.00 0.00 175.35 174.63 2d9y n GLN 20 N 6.11 0.00 -2.76 4.03 7.27 -1.23 -2.87 117.38 127.93 2d9y n GLN 20 Ca -0.05 0.00 -0.43 0.00 0.07 0.00 0.00 57.00 56.59 2d9y n GLN 20 Cb 0.46 -1.00 -0.03 0.00 2.41 0.00 0.00 30.24 32.09 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 -1.99 3.06 0.22 1.69 0.00 0.13 -4.79 121.76 120.07 2d9y s ALA 21 Ca 0.50 -2.29 -0.13 0.00 0.00 0.00 0.00 51.96 50.05 2d9y s ALA 21 Cb -0.37 -4.18 0.27 0.00 0.00 0.00 0.00 23.12 18.84 2d9y s ALA 21 CO 0.72 -3.16 1.62 0.66 0.00 0.00 0.00 175.76 175.60 2d9y h SER 22 N 9.39 -0.60 -0.82 0.00 4.64 -1.88 -3.42 113.55 120.85 2d9y h SER 22 Ca 0.04 0.20 -0.54 0.00 -0.47 0.00 0.00 61.79 61.02 2d9y h SER 22 Cb 1.03 0.41 -0.02 0.00 -0.31 0.00 0.00 62.40 63.51 2d9y h SER 22 CO 1.24 -0.22 -0.26 -0.94 -0.87 0.00 0.00 176.83 175.78 2d9y s SER 23 N -5.23 4.86 0.95 4.97 1.04 -1.26 -5.03 113.70 114.00 2d9y s SER 23 Ca -0.14 -1.02 0.00 0.00 0.48 0.00 0.00 55.95 55.26 2d9y s SER 23 Cb 0.20 0.18 0.00 0.00 0.10 0.00 0.00 66.02 66.50 2d9y s SER 23 CO 0.74 -1.09 0.00 0.61 0.98 0.00 0.00 173.24 174.49 2d9y n GLY 24 N -1.87 0.22 3.62 7.32 0.00 -1.26 -4.75 105.19 108.48 2d9y n GLY 24 Ca 0.05 -0.88 -0.36 0.00 0.00 0.00 0.00 46.02 44.83 2d9y n GLY 24 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2d9y n VAL 25 N -0.75 3.05 -2.26 1.61 3.14 -1.26 -4.83 118.33 117.04 2d9y n VAL 25 Ca 0.00 -0.39 -0.33 0.00 -2.96 0.00 0.00 64.34 60.65 2d9y n VAL 25 Cb 0.00 -1.13 -0.04 0.00 -1.06 0.00 0.00 33.84 31.61 2d9y n VAL 25 CO 0.00 0.00 0.00 -0.54 -6.46 0.00 0.00 176.83 169.83 2d9y s LYS 26 N -3.28 3.03 0.50 1.45 -0.14 -1.26 -4.72 119.74 115.32 2d9y s LYS 26 Ca 0.74 -1.26 0.02 0.00 -1.36 0.00 0.00 55.97 54.11 2d9y s LYS 26 Cb -0.35 -5.31 -0.02 0.00 -1.68 0.00 0.00 37.83 30.47 2d9y s LYS 26 CO 0.49 -3.24 0.04 1.14 -0.76 0.00 0.00 175.35 173.02 2d9y s GLN 27 N 5.78 2.18 -0.09 1.68 -2.07 -1.26 -4.94 119.66 120.93 2d9y s GLN 27 Ca 0.62 -2.33 0.01 0.00 -1.82 0.00 0.00 55.36 51.85 2d9y s GLN 27 Cb -0.00 -1.60 0.02 0.00 -1.09 0.00 0.00 33.01 30.34 2d9y s GLN 27 CO 0.07 -0.34 -0.11 -1.58 -1.32 0.00 0.00 175.29 172.01 2d9y s TRP 28 N -2.85 1.53 -0.18 9.60 0.52 -1.26 0.19 118.94 126.49 2d9y s TRP 28 Ca 0.12 -0.66 -0.04 0.00 0.02 0.00 0.00 56.10 55.54 2d9y s TRP 28 Cb 0.02 -1.17 -0.02 0.00 -1.15 0.00 0.00 33.47 31.15 2d9y s TRP 28 CO 0.06 -0.38 -0.03 -0.80 0.02 0.00 0.00 176.95 175.82 2d9y s ASN 29 N 1.06 4.72 0.12 2.95 0.01 -1.14 -4.90 114.94 117.76 2d9y s ASN 29 Ca -0.07 -0.20 -0.31 0.00 -0.71 0.00 0.00 52.86 51.58 2d9y s ASN 29 Cb -0.15 -1.79 -0.07 0.00 0.41 0.00 0.00 41.25 39.65 2d9y s ASN 29 CO -0.01 0.10 1.27 -0.75 -1.51 0.00 0.00 177.10 176.20 2d9y s LYS 30 N 0.77 4.40 0.08 -0.60 2.20 -1.26 0.27 119.74 125.59 2d9y s LYS 30 Ca -0.01 1.93 -0.06 0.00 -0.36 0.00 0.00 55.97 57.47 2d9y s LYS 30 Cb -0.14 -3.27 -0.01 0.00 -1.51 0.00 0.00 37.83 32.89 2d9y s LYS 30 CO 0.02 -0.28 0.12 0.50 -0.36 0.00 0.00 175.35 175.35 2d9y s ARG 31 N 0.63 0.76 -0.46 4.03 6.06 -0.87 -4.90 118.95 124.20 2d9y s ARG 31 Ca 0.59 -1.04 -0.23 0.00 -2.50 0.00 0.00 55.73 52.55 2d9y s ARG 31 Cb -0.33 0.30 0.03 0.00 0.06 0.00 0.00 34.95 35.00 2d9y s ARG 31 CO 0.32 -0.21 0.76 -0.46 -2.50 0.00 0.00 175.30 173.21 2d9y s TRP 32 N -3.87 3.00 -0.19 5.12 -0.00 -0.82 0.52 118.94 122.70 2d9y s TRP 32 Ca 0.06 0.08 -0.08 0.00 -0.00 0.00 0.00 56.10 56.16 2d9y s TRP 32 Cb 0.06 -3.62 -0.04 0.00 -0.00 0.00 0.00 33.47 29.86 2d9y s TRP 32 CO -0.11 -0.99 0.07 -0.06 -0.00 0.00 0.00 176.95 175.86 2d9y s PHE 33 N 3.22 3.23 -0.29 5.86 0.40 0.08 -0.46 117.98 130.01 2d9y s PHE 33 Ca 0.28 0.02 0.01 0.00 -0.60 0.00 0.00 56.93 56.64 2d9y s PHE 33 Cb -0.13 -2.10 0.09 0.00 0.51 0.00 0.00 43.02 41.39 2d9y s PHE 33 CO 0.21 0.09 0.04 0.08 0.70 0.00 0.00 175.22 176.35 2d9y s VAL 34 N 0.54 1.37 -0.12 -0.44 1.01 0.35 -0.33 120.40 122.77 2d9y s VAL 34 Ca 0.03 -1.53 -0.29 0.00 0.00 0.00 0.00 61.98 60.19 2d9y s VAL 34 Cb -0.13 -1.91 -0.03 0.00 0.00 0.00 0.00 36.38 34.31 2d9y s VAL 34 CO 0.01 -0.48 1.44 -0.22 0.00 0.00 0.00 175.10 175.85 2d9y s LEU 35 N 1.40 4.23 0.00 3.92 2.96 0.21 -1.76 118.68 129.63 2d9y s LEU 35 Ca 0.05 1.91 -0.03 0.00 -0.22 0.00 0.00 54.13 55.84 2d9y s LEU 35 Cb -0.18 -3.54 0.08 0.00 0.50 0.00 0.00 46.19 43.05 2d9y s LEU 35 CO -0.15 -0.85 0.49 0.55 -1.32 0.00 0.00 176.35 175.07 2d9y n VAL 36 N 5.46 0.00 -0.22 1.68 3.14 0.13 -1.99 118.33 126.54 2d9y n VAL 36 Ca 0.15 -0.56 -0.06 0.00 -2.96 0.00 0.00 64.34 60.92 2d9y n VAL 36 Cb 0.44 -1.45 -0.05 0.00 -1.06 0.00 0.00 33.84 31.72 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 -3.14 -0.55 0.00 6.55 5.68 -1.26 -3.83 116.55 120.00 2d9y n ASP 37 Ca 0.07 0.95 0.00 0.00 -0.50 0.00 0.00 54.79 55.31 2d9y n ASP 37 Cb 0.25 -0.13 0.00 0.00 -1.14 0.00 0.00 41.12 40.10 2d9y n ASP 37 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 2d9y n ARG 38 N -4.68 1.37 -2.07 0.11 1.74 -1.26 -4.92 116.66 106.95 2d9y n ARG 38 Ca 0.01 0.00 -0.29 0.00 -0.77 0.00 0.00 57.85 56.81 2d9y n ARG 38 Cb 0.14 -0.72 0.19 0.00 -1.02 0.00 0.00 32.46 31.05 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 -5.80 0.32 0.44 0.00 2.96 0.89 0.21 118.68 117.69 2d9y s LEU 40 Ca 0.75 -0.46 0.08 0.00 -0.22 0.00 0.00 54.13 54.28 2d9y s LEU 40 Cb -0.03 -0.23 0.01 0.00 0.50 0.00 0.00 46.19 46.45 2d9y s LEU 40 CO 0.52 -0.33 0.54 -0.36 -1.32 0.00 0.00 176.35 175.41 2d9y s PHE 41 N 2.14 2.57 0.03 5.38 0.08 -0.72 0.30 117.98 127.77 2d9y s PHE 41 Ca 0.03 -0.48 -0.21 0.00 0.12 0.00 0.00 56.93 56.39 2d9y s PHE 41 Cb -0.15 -2.29 0.04 0.00 -0.57 0.00 0.00 43.02 40.05 2d9y s PHE 41 CO -0.08 -0.44 0.47 1.52 -0.10 0.00 0.00 175.22 176.60 2d9y s TYR 42 N -2.43 -0.35 0.01 0.36 -0.85 -1.21 -0.50 117.35 112.38 2d9y s TYR 42 Ca 0.53 0.40 -0.01 0.00 -0.52 0.00 0.00 57.07 57.47 2d9y s TYR 42 Cb -0.07 0.27 -0.01 0.00 0.38 0.00 0.00 41.96 42.53 2d9y s TYR 42 CO 0.32 -0.59 -0.01 0.71 -1.52 0.00 0.00 175.55 174.46 2d9y s TYR 43 N -2.28 0.19 0.43 -3.49 1.51 0.39 -3.43 117.35 110.67 2d9y s TYR 43 Ca -0.06 -0.38 0.24 0.00 -1.01 0.00 0.00 57.07 55.86 2d9y s TYR 43 Cb -0.01 -0.14 1.26 0.00 -0.11 0.00 0.00 41.96 42.96 2d9y s TYR 43 CO -0.01 -0.16 1.74 0.87 -1.11 0.00 0.00 175.55 176.89 2d9y h LYS 44 N 4.91 0.25 0.00 -0.62 1.79 -1.90 -2.17 116.57 118.83 2d9y h LYS 44 Ca -0.30 -0.01 -0.23 0.00 -2.18 0.00 0.00 60.65 57.92 2d9y h LYS 44 Cb 1.21 -0.06 -0.06 0.00 -1.58 0.00 0.00 32.23 31.75 2d9y h LYS 44 CO 0.43 0.16 -0.16 -0.40 -1.08 0.00 0.00 179.45 178.40 2d9y n ASP 45 N -4.55 -0.83 -1.98 0.86 5.75 -1.26 -4.46 116.55 110.07 2d9y n ASP 45 Ca 0.28 -2.37 -0.08 0.00 -0.01 0.00 0.00 54.79 52.60 2d9y n ASP 45 Cb 1.07 1.62 -0.12 0.00 -1.03 0.00 0.00 41.12 42.66 2d9y n ASP 45 CO 0.00 0.00 0.00 -1.84 -0.11 0.00 0.00 177.20 175.25 2d9y n GLU 46 N -0.41 1.52 -0.09 0.11 0.28 -1.26 -3.86 120.64 116.93 2d9y n GLU 46 Ca 0.02 -0.68 -0.07 0.00 -0.16 0.00 0.00 57.16 56.27 2d9y n GLU 46 Cb 0.41 -1.76 -0.16 0.00 1.43 0.00 0.00 31.44 31.37 2d9y n GLU 46 CO 0.00 0.00 0.00 0.36 -0.16 0.00 0.00 177.13 177.33 2d9y n LYS 47 N 2.38 0.70 -4.44 3.44 2.85 -1.26 -4.98 118.16 116.85 2d9y n LYS 47 Ca 0.29 -0.04 -0.39 0.00 -1.05 0.00 0.00 58.31 57.13 2d9y n LYS 47 Cb 0.71 -1.52 -0.08 0.00 -0.65 0.00 0.00 35.03 33.49 2d9y n LYS 47 CO 0.00 0.00 0.00 -0.85 -0.05 0.00 0.00 177.40 176.50 2d9y n GLU 48 N -2.68 -0.78 -0.02 -1.58 0.28 -1.25 -4.82 120.64 109.78 2d9y n GLU 48 Ca -0.29 0.12 -0.03 0.00 -0.16 0.00 0.00 57.16 56.81 2d9y n GLU 48 Cb 1.08 -4.31 -0.01 0.00 1.43 0.00 0.00 31.44 29.63 2d9y n GLU 48 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 2d9y n GLU 49 N -4.17 0.15 -3.83 3.44 -0.58 -1.26 -4.94 120.64 109.45 2d9y n GLU 49 Ca -0.02 0.06 -0.36 0.00 -0.42 0.00 0.00 57.16 56.42 2d9y n GLU 49 Cb 0.52 -0.72 -0.13 0.00 -0.57 0.00 0.00 31.44 30.54 2d9y n GLU 49 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 2d9y s SER 50 N -4.69 5.11 0.29 1.62 0.01 -1.26 -5.08 113.70 109.71 2d9y s SER 50 Ca -0.08 -1.64 -0.30 0.00 1.31 0.00 0.00 55.95 55.24 2d9y s SER 50 Cb 0.01 -1.78 -0.12 0.00 0.21 0.00 0.00 66.02 64.34 2d9y s SER 50 CO 0.12 -0.41 1.62 -0.38 0.41 0.00 0.00 173.24 174.60 2d9y n ILE 51 N 4.62 0.97 -0.06 1.44 5.41 -1.26 -4.90 119.36 125.58 2d9y n ILE 51 Ca -0.07 -0.24 -0.21 0.00 1.00 0.00 0.00 62.75 63.22 2d9y n ILE 51 Cb 0.42 -1.99 -0.13 0.00 -0.71 0.00 0.00 39.64 37.23 2d9y n ILE 51 CO 0.00 0.00 0.00 0.18 0.00 0.00 0.00 176.55 176.73 2d9y n LEU 52 N 2.27 2.60 -3.75 1.39 4.77 -1.22 -5.00 117.00 118.06 2d9y n LEU 52 Ca 0.09 0.14 -0.13 0.00 -0.03 0.00 0.00 56.01 56.07 2d9y n LEU 52 Cb 0.37 -1.01 -0.10 0.00 -2.33 0.00 0.00 43.42 40.35 2d9y n LEU 52 CO 0.64 0.79 0.04 -0.83 -1.33 0.00 0.00 177.39 176.70 2d9y s GLY 53 N -5.79 -0.23 0.03 -0.72 0.00 -1.26 -5.10 107.32 94.25 2d9y s GLY 53 Ca -0.28 0.76 0.03 0.00 0.00 0.00 0.00 44.72 45.23 2d9y s GLY 53 CO 0.67 0.59 -0.05 -0.45 0.00 0.00 0.00 173.10 173.87 2d9y s SER 54 N -0.42 4.77 -0.28 1.64 0.15 -1.26 -3.35 113.70 114.96 2d9y s SER 54 Ca -0.05 -0.15 0.01 0.00 0.70 0.00 0.00 55.95 56.46 2d9y s SER 54 Cb -0.03 -1.13 0.08 0.00 -1.71 0.00 0.00 66.02 63.23 2d9y s SER 54 CO 0.02 0.25 0.01 -0.63 1.20 0.00 0.00 173.24 174.10 2d9y s ILE 55 N -1.09 1.49 0.17 6.45 1.01 0.15 -4.99 121.20 124.39 2d9y s ILE 55 Ca 0.19 -1.50 -0.30 0.00 0.00 0.00 0.00 60.65 59.04 2d9y s ILE 55 Cb -0.11 -1.93 -0.08 0.00 0.01 0.00 0.00 42.46 40.34 2d9y s ILE 55 CO 0.10 -0.37 1.32 -2.16 0.00 0.00 0.00 174.94 173.83 2d9y s PRO 56 N 1.36 4.38 -0.44 2.79 0.04 -1.26 -0.08 135.00 141.79 2d9y s PRO 56 Ca 0.02 2.04 0.09 0.00 0.04 0.00 0.00 61.00 63.20 2d9y s PRO 56 Cb -0.18 -3.21 0.39 0.00 0.04 0.00 0.00 34.50 31.53 2d9y s PRO 56 CO -0.12 -0.28 0.94 1.28 0.04 0.00 0.00 177.00 178.86 2d9y n LEU 57 N 2.95 3.05 0.03 -3.56 4.77 -1.25 -4.85 117.00 118.14 2d9y n LEU 57 Ca 0.07 -4.98 -0.02 0.00 -0.03 0.00 0.00 56.01 51.05 2d9y n LEU 57 Cb 0.43 -0.02 -0.01 0.00 -2.33 0.00 0.00 43.42 41.48 2d9y n LEU 57 CO 0.58 2.14 0.08 0.25 -1.33 0.00 0.00 177.39 179.11 2d9y h LEU 58 N 2.88 -0.12 -4.45 2.23 5.85 -1.83 -2.60 115.31 117.27 2d9y h LEU 58 Ca 0.12 0.00 -0.43 0.00 0.84 0.00 0.00 57.88 58.42 2d9y h LEU 58 Cb 0.87 0.03 -0.42 0.00 0.37 0.00 0.00 40.66 41.51 2d9y h LEU 58 CO 0.69 0.20 -0.94 -1.20 -0.34 0.00 0.00 178.44 176.84 2d9y n SER 59 N -3.98 3.54 -3.85 1.25 7.64 -1.24 -3.99 113.62 113.00 2d9y n SER 59 Ca -0.02 -3.05 -0.30 0.00 1.01 0.00 0.00 58.87 56.52 2d9y n SER 59 Cb 0.06 -0.40 0.21 0.00 -1.01 0.00 0.00 64.21 63.07 2d9y n SER 59 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 2d9y n PHE 60 N -0.65 -3.98 -3.72 1.43 3.01 -1.26 -4.84 117.46 107.44 2d9y n PHE 60 Ca 0.29 -1.15 -0.30 0.00 1.01 0.00 0.00 57.45 57.30 2d9y n PHE 60 Cb 0.89 -1.05 -0.13 0.00 -0.01 0.00 0.00 39.48 39.18 2d9y n PHE 60 CO 0.00 0.00 0.00 0.50 1.01 0.00 0.00 176.76 178.27 2d9y s ARG 61 N -5.84 1.16 -0.18 -1.08 3.52 0.97 -4.67 118.95 112.84 2d9y s ARG 61 Ca 0.75 -1.80 -0.11 0.00 -0.13 0.00 0.00 55.73 54.44 2d9y s ARG 61 Cb -0.03 -2.28 -0.05 0.00 -1.56 0.00 0.00 34.95 31.03 2d9y s ARG 61 CO 0.53 -1.12 0.18 0.08 -0.81 0.00 0.00 175.30 174.16 2d9y s VAL 62 N 0.64 5.38 -0.18 7.11 1.01 -1.26 -2.20 120.40 130.91 2d9y s VAL 62 Ca 0.16 0.30 -0.33 0.00 0.00 0.00 0.00 61.98 62.11 2d9y s VAL 62 Cb -0.23 -3.51 0.14 0.00 0.00 0.00 0.00 36.38 32.78 2d9y s VAL 62 CO -0.05 0.44 1.17 0.00 0.00 0.00 0.00 175.10 176.67 2d9y s ALA 63 N 0.24 -2.04 0.17 5.51 0.00 -0.92 -4.84 121.76 119.88 2d9y s ALA 63 Ca 0.11 1.58 -0.31 0.00 0.00 0.00 0.00 51.96 53.34 2d9y s ALA 63 Cb -0.12 -0.34 -0.17 0.00 0.00 0.00 0.00 23.12 22.50 2d9y s ALA 63 CO 0.00 -0.52 0.80 0.00 0.00 0.00 0.00 175.76 176.05 2d9y n ALA 64 N 0.08 -2.33 -0.66 0.00 0.00 -1.26 -1.73 120.51 114.61 2d9y n ALA 64 Ca -0.02 0.47 -0.17 0.00 0.00 0.00 0.00 53.44 53.72 2d9y n ALA 64 Cb 0.59 -1.76 0.25 0.00 0.00 0.00 0.00 19.45 18.52 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 0.59 0.00 -4.28 0.00 0.24 -0.69 -4.68 118.33 109.50 2d9y n VAL 65 Ca 0.17 -0.21 -0.15 0.00 -2.04 0.00 0.00 64.34 62.10 2d9y n VAL 65 Cb 0.22 -1.05 -0.10 0.00 -1.47 0.00 0.00 33.84 31.44 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 -5.09 1.17 0.00 7.34 -1.52 -1.26 -5.01 119.66 115.29 2d9y s GLN 66 Ca 0.63 -1.54 0.14 0.00 -1.95 0.00 0.00 55.36 52.65 2d9y s GLN 66 Cb -0.09 -0.66 0.63 0.00 -0.22 0.00 0.00 33.01 32.67 2d9y s GLN 66 CO 0.51 0.03 1.44 -0.35 -0.25 0.00 0.00 175.29 176.67 2d9y n PRO 67 N -0.29 0.05 0.05 2.91 -0.04 -1.26 -2.05 135.00 134.37 2d9y n PRO 67 Ca -0.08 0.23 0.12 0.00 -0.04 0.00 0.00 63.50 63.73 2d9y n PRO 67 Cb 0.62 -1.50 0.18 0.00 -0.04 0.00 0.00 33.50 32.76 2d9y n PRO 67 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2d9y n SER 68 N -1.45 0.66 -0.43 3.54 7.64 -1.26 -3.59 113.62 118.74 2d9y n SER 68 Ca 0.04 0.07 0.14 0.00 1.01 0.00 0.00 58.87 60.14 2d9y n SER 68 Cb 0.16 0.19 0.57 0.00 -1.01 0.00 0.00 64.21 64.11 2d9y n SER 68 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2d9y n ASP 69 N -2.03 1.34 -2.61 6.43 8.00 -0.87 -4.92 116.55 121.89 2d9y n ASP 69 Ca 0.04 -1.43 -0.19 0.00 0.71 0.00 0.00 54.79 53.91 2d9y n ASP 69 Cb 0.43 0.00 0.04 0.00 -0.02 0.00 0.00 41.12 41.56 2d9y n ASP 69 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2d9y n ASN 70 N 0.04 -5.38 -4.41 -2.24 4.13 -1.24 -4.94 115.26 101.22 2d9y n ASN 70 Ca 0.19 -0.27 -0.45 0.00 1.68 0.00 0.00 54.58 55.73 2d9y n ASN 70 Cb 0.33 -4.18 -0.02 0.00 -1.54 0.00 0.00 39.78 34.37 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 -3.10 5.05 -0.13 2.41 -1.09 -1.26 -4.89 121.20 118.20 2d9y s ILE 71 Ca 0.29 -1.99 -0.01 0.00 -2.23 0.00 0.00 60.65 56.70 2d9y s ILE 71 Cb -0.13 -4.70 0.03 0.00 -1.58 0.00 0.00 42.46 36.08 2d9y s ILE 71 CO 0.36 -1.37 2.30 -1.20 -1.23 0.00 0.00 174.94 173.80 2d9y n SER 72 N 5.60 5.75 -3.80 3.58 7.64 -1.26 -4.76 113.62 126.36 2d9y n SER 72 Ca 0.22 -2.67 -0.23 0.00 1.01 0.00 0.00 58.87 57.20 2d9y n SER 72 Cb 0.48 -1.16 -0.17 0.00 -1.01 0.00 0.00 64.21 62.34 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 -0.52 0.77 0.51 1.43 0.52 -1.26 -5.14 118.95 115.27 2d9y s ARG 73 Ca 0.23 0.04 -0.20 0.00 -0.52 0.00 0.00 55.73 55.28 2d9y s ARG 73 Cb 0.15 -1.07 -0.07 0.00 0.52 0.00 0.00 34.95 34.49 2d9y s ARG 73 CO -0.02 -0.28 1.12 0.15 0.02 0.00 0.00 175.30 176.29 2d9y s LYS 74 N 1.87 3.53 -0.98 3.54 -0.14 -1.26 -3.57 119.74 122.73 2d9y s LYS 74 Ca 0.04 1.61 -0.05 0.00 -1.36 0.00 0.00 55.97 56.21 2d9y s LYS 74 Cb -0.12 -2.13 0.01 0.00 -1.68 0.00 0.00 37.83 33.91 2d9y s LYS 74 CO -0.05 -0.70 0.85 0.72 -0.76 0.00 0.00 175.35 175.41 2d9y n HIS 75 N -1.03 -2.05 -5.23 3.18 8.25 -1.26 -4.58 115.22 112.50 2d9y n HIS 75 Ca 0.10 0.74 -0.31 0.00 -0.26 0.00 0.00 57.72 58.00 2d9y n HIS 75 Cb 0.50 -4.05 -0.16 0.00 1.12 0.00 0.00 29.99 27.40 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 -3.24 1.99 0.27 1.59 2.01 -1.23 -0.34 115.64 116.69 2d9y s THR 76 Ca 0.36 -1.04 0.08 0.00 0.31 0.00 0.00 61.69 61.39 2d9y s THR 76 Cb -0.16 -1.67 -0.05 0.00 0.01 0.00 0.00 72.50 70.62 2d9y s THR 76 CO 0.54 0.56 -0.11 0.72 -0.69 0.00 0.00 174.62 175.64 2d9y s PHE 77 N -0.25 2.02 0.03 4.92 -0.71 -0.27 -1.70 117.98 122.01 2d9y s PHE 77 Ca -0.00 -0.58 0.05 0.00 -1.04 0.00 0.00 56.93 55.35 2d9y s PHE 77 Cb -0.13 -1.06 -0.02 0.00 -1.21 0.00 0.00 43.02 40.60 2d9y s PHE 77 CO 0.02 0.41 -0.14 -1.59 -1.34 0.00 0.00 175.22 172.59 2d9y s LYS 78 N -3.66 0.97 -0.16 1.99 -2.85 -0.71 -1.54 119.74 113.79 2d9y s LYS 78 Ca 0.28 -0.70 0.00 0.00 -1.00 0.00 0.00 55.97 54.56 2d9y s LYS 78 Cb 0.01 -0.97 0.03 0.00 -2.06 0.00 0.00 37.83 34.84 2d9y s LYS 78 CO 0.12 0.25 -0.12 0.00 0.10 0.00 0.00 175.35 175.70 2d9y s ALA 79 N -0.73 1.78 0.06 0.59 0.00 -0.50 -2.18 121.76 120.79 2d9y s ALA 79 Ca 0.02 -0.91 0.04 0.00 0.00 0.00 0.00 51.96 51.11 2d9y s ALA 79 Cb -0.07 -1.09 -0.03 0.00 0.00 0.00 0.00 23.12 21.93 2d9y s ALA 79 CO 0.01 -0.52 -0.11 -2.00 0.00 0.00 0.00 175.76 173.14 2d9y s GLU 80 N 1.51 0.69 -0.18 0.00 2.12 -0.93 -0.39 118.70 121.51 2d9y s GLU 80 Ca 0.03 -0.88 0.16 0.00 0.36 0.00 0.00 54.97 54.64 2d9y s GLU 80 Cb -0.14 -0.57 0.70 0.00 0.26 0.00 0.00 34.13 34.37 2d9y s GLU 80 CO -0.10 0.12 1.61 1.58 -0.54 0.00 0.00 175.26 177.93 2d9y n HIS 81 N 1.33 1.56 -2.59 5.30 -0.00 -1.20 -0.02 115.22 119.60 2d9y n HIS 81 Ca -0.22 -0.73 -0.05 0.00 -0.00 0.00 0.00 57.72 56.71 2d9y n HIS 81 Cb 0.54 -0.38 0.02 0.00 -0.00 0.00 0.00 29.99 30.18 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 0.41 -0.44 0.00 1.57 0.00 -1.26 -4.36 120.51 116.43 2d9y n ALA 82 Ca 0.25 0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.73 2d9y n ALA 82 Cb 1.01 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 19.04 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 -0.97 3.22 0.08 0.00 0.00 -1.26 -5.00 105.19 101.27 2d9y n GLY 83 Ca -0.04 -0.64 -0.02 0.00 0.00 0.00 0.00 46.02 45.32 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 -0.13 -3.56 1.61 0.31 -1.26 -4.76 118.33 110.54 2d9y n VAL 84 Ca 0.00 1.23 -0.11 0.00 -0.01 0.00 0.00 64.34 65.45 2d9y n VAL 84 Cb 0.00 -1.59 -0.05 0.00 -0.91 0.00 0.00 33.84 31.29 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 -3.64 0.67 -0.38 5.55 6.06 -1.26 -5.01 118.95 120.93 2d9y s ARG 85 Ca -0.02 0.07 -0.00 0.00 -2.50 0.00 0.00 55.73 53.27 2d9y s ARG 85 Cb 0.02 0.31 0.11 0.00 0.06 0.00 0.00 34.95 35.45 2d9y s ARG 85 CO 0.12 -0.23 0.14 0.99 -2.50 0.00 0.00 175.30 173.82 2d9y s THR 86 N -1.51 2.89 0.47 4.11 2.01 -1.26 -3.25 115.64 119.10 2d9y s THR 86 Ca -0.01 -2.16 -0.06 0.00 0.31 0.00 0.00 61.69 59.77 2d9y s THR 86 Cb -0.01 -3.03 -0.04 0.00 0.01 0.00 0.00 72.50 69.44 2d9y s THR 86 CO 0.00 -0.65 0.79 -0.31 -0.69 0.00 0.00 174.62 173.76 2d9y s TYR 87 N 1.05 3.55 -0.03 4.92 1.51 0.47 -4.91 117.35 123.91 2d9y s TYR 87 Ca 0.09 0.87 -0.01 0.00 -1.01 0.00 0.00 57.07 57.01 2d9y s TYR 87 Cb -0.21 -2.34 0.03 0.00 -0.11 0.00 0.00 41.96 39.33 2d9y s TYR 87 CO -0.06 -0.25 0.06 -0.06 -1.11 0.00 0.00 175.55 174.13 2d9y s PHE 88 N -2.67 -0.02 -0.02 2.71 0.08 -1.26 -1.41 117.98 115.40 2d9y s PHE 88 Ca 0.48 0.22 0.02 0.00 0.12 0.00 0.00 56.93 57.77 2d9y s PHE 88 Cb -0.10 -0.20 0.00 0.00 -0.57 0.00 0.00 43.02 42.15 2d9y s PHE 88 CO 0.42 -0.11 -0.07 -0.06 -0.10 0.00 0.00 175.22 175.31 2d9y s PHE 89 N 1.10 0.71 -0.13 0.36 0.08 -0.59 -3.51 117.98 116.00 2d9y s PHE 89 Ca -0.09 -0.15 0.00 0.00 0.12 0.00 0.00 56.93 56.81 2d9y s PHE 89 Cb -0.13 -0.50 -0.01 0.00 -0.57 0.00 0.00 43.02 41.81 2d9y s PHE 89 CO -0.04 -0.06 -0.14 0.45 -0.10 0.00 0.00 175.22 175.34 2d9y s SER 90 N 0.10 3.96 -0.07 1.36 0.15 -1.10 -1.11 113.70 116.98 2d9y s SER 90 Ca -0.01 -0.34 -0.11 0.00 0.70 0.00 0.00 55.95 56.18 2d9y s SER 90 Cb -0.06 -1.60 -0.05 0.00 -1.71 0.00 0.00 66.02 62.60 2d9y s SER 90 CO -0.00 0.16 0.28 0.00 1.20 0.00 0.00 173.24 174.88 2d9y s ALA 91 N 0.35 3.76 0.20 5.45 0.00 0.54 -2.70 121.76 129.37 2d9y s ALA 91 Ca -0.11 -0.43 -0.11 0.00 0.00 0.00 0.00 51.96 51.31 2d9y s ALA 91 Cb -0.16 -2.21 0.17 0.00 0.00 0.00 0.00 23.12 20.92 2d9y s ALA 91 CO 0.06 0.49 1.84 0.93 0.00 0.00 0.00 175.76 179.07 2d9y h GLU 92 N 5.08 0.76 -6.20 0.00 5.08 -1.85 -3.44 114.58 114.01 2d9y h GLU 92 Ca -0.52 -0.05 -0.58 0.00 -1.00 0.00 0.00 59.36 57.22 2d9y h GLU 92 Cb 1.22 -0.17 -0.11 0.00 0.50 0.00 0.00 28.75 30.18 2d9y h GLU 92 CO 0.62 0.50 -0.69 -1.12 -1.00 0.00 0.00 179.01 177.33 2d9y s SER 93 N -5.69 4.19 0.22 1.42 0.01 -1.26 -5.04 113.70 107.55 2d9y s SER 93 Ca -0.13 -0.79 -0.02 0.00 1.31 0.00 0.00 55.95 56.32 2d9y s SER 93 Cb 0.15 -0.64 0.20 0.00 0.21 0.00 0.00 66.02 65.94 2d9y s SER 93 CO 0.76 0.01 1.58 1.55 0.41 0.00 0.00 173.24 177.55 2d9y h PRO 94 N 2.02 0.55 -0.97 12.44 0.13 -1.93 -3.00 132.00 141.25 2d9y h PRO 94 Ca -0.43 -0.29 0.02 0.00 -0.87 0.00 0.00 66.00 64.43 2d9y h PRO 94 Cb 1.25 0.01 -0.05 0.00 0.13 0.00 0.00 31.00 32.34 2d9y h PRO 94 CO 0.60 0.88 0.64 1.05 -0.23 0.00 0.00 178.00 180.95 2d9y h GLU 95 N 0.45 1.25 -0.01 0.86 4.11 -1.98 -2.81 114.58 116.45 2d9y h GLU 95 Ca 0.03 -0.08 -0.00 0.00 0.07 0.00 0.00 59.36 59.39 2d9y h GLU 95 Cb 0.94 -0.28 -0.00 0.00 0.50 0.00 0.00 28.75 29.91 2d9y h GLU 95 CO 0.08 0.83 -0.00 0.93 0.07 0.00 0.00 179.01 180.92 2d9y h GLU 96 N 1.29 0.02 -0.60 1.06 5.08 -1.95 -2.45 114.58 117.03 2d9y h GLU 96 Ca 0.36 -0.01 0.06 0.00 -1.00 0.00 0.00 59.36 58.78 2d9y h GLU 96 Cb -0.10 -0.00 -0.08 0.00 0.50 0.00 0.00 28.75 29.06 2d9y h GLU 96 CO -0.09 0.37 -0.44 0.37 -1.00 0.00 0.00 179.01 178.23 2d9y h GLN 97 N -0.34 -0.10 -0.17 2.33 4.15 -1.36 0.23 115.11 119.85 2d9y h GLN 97 Ca 0.00 0.01 0.03 0.00 0.77 0.00 0.00 58.65 59.46 2d9y h GLN 97 Cb 0.37 0.02 -0.03 0.00 0.21 0.00 0.00 27.48 28.05 2d9y h GLN 97 CO 0.00 -0.07 -0.04 0.93 -1.93 0.00 0.00 178.83 177.72 2d9y h GLU 98 N -0.10 -0.00 -0.74 1.69 4.39 -1.59 -1.40 114.58 116.82 2d9y h GLU 98 Ca 0.10 0.00 0.17 0.00 0.34 0.00 0.00 59.36 59.96 2d9y h GLU 98 Cb 0.36 0.00 -0.12 0.00 -0.10 0.00 0.00 28.75 28.89 2d9y h GLU 98 CO -0.62 -0.00 0.13 0.00 -1.16 0.00 0.00 179.01 177.35 2d9y h ALA 99 N 1.17 0.91 0.53 3.43 0.00 -0.64 -2.42 119.26 122.24 2d9y h ALA 99 Ca 0.08 0.19 -0.03 0.00 0.00 0.00 0.00 54.91 55.16 2d9y h ALA 99 Cb 0.13 0.29 0.01 0.00 0.00 0.00 0.00 17.79 18.21 2d9y h ALA 99 CO -0.18 -0.38 -0.26 -1.49 0.00 0.00 0.00 179.25 176.95 2d9y h TRP 100 N 0.21 -0.66 -1.17 0.00 4.06 -0.05 0.14 115.95 118.47 2d9y h TRP 100 Ca 0.42 -0.02 0.38 0.00 2.06 0.00 0.00 58.89 61.73 2d9y h TRP 100 Cb 0.73 0.22 -0.09 0.00 -1.00 0.00 0.00 29.16 29.02 2d9y h TRP 100 CO -0.31 -0.41 0.79 -0.89 -3.56 0.00 0.00 178.44 174.06 2d9y n ILE 101 N -4.44 -0.12 -0.09 1.49 5.41 -0.58 0.25 119.36 121.28 2d9y n ILE 101 Ca -0.09 1.26 -0.14 0.00 1.00 0.00 0.00 62.75 64.78 2d9y n ILE 101 Cb 0.28 -2.07 -0.07 0.00 -0.71 0.00 0.00 39.64 37.07 2d9y n ILE 101 CO 0.00 0.00 0.00 1.56 0.00 0.00 0.00 176.55 178.11 2d9y h GLN 102 N 0.00 0.00 -0.38 0.38 4.20 -1.31 -1.44 115.11 116.57 2d9y h GLN 102 Ca 0.67 0.00 0.08 0.00 0.06 0.00 0.00 58.65 59.46 2d9y h GLN 102 Cb 2.33 0.00 -0.08 0.00 0.30 0.00 0.00 27.48 30.03 2d9y h GLN 102 CO -0.23 0.59 -0.19 0.00 -0.67 0.00 0.00 178.83 178.33 2d9y h ALA 103 N -0.66 0.08 0.21 3.87 0.00 0.27 0.19 119.26 123.22 2d9y h ALA 103 Ca -0.18 0.13 -0.32 0.00 0.00 0.00 0.00 54.91 54.54 2d9y h ALA 103 Cb 0.92 0.46 0.02 0.00 0.00 0.00 0.00 17.79 19.20 2d9y h ALA 103 CO -0.11 -0.56 -1.48 0.00 0.00 0.00 0.00 179.25 177.10 2d9y h MET 104 N -0.13 0.44 -0.36 0.00 -0.00 -0.59 -3.33 114.93 110.96 2d9y h MET 104 Ca 0.19 -0.75 0.06 0.00 -0.00 0.00 0.00 59.70 59.19 2d9y h MET 104 Cb 0.42 0.28 -0.05 0.00 -0.00 0.00 0.00 31.60 32.24 2d9y h MET 104 CO -0.46 1.35 0.04 0.78 -0.00 0.00 0.00 176.91 178.62 2d9y h GLY 105 N 0.68 0.39 0.33 -3.00 0.00 -0.87 -1.98 103.07 98.62 2d9y h GLY 105 Ca -0.24 0.01 0.12 0.00 0.00 0.00 0.00 47.33 47.22 2d9y h GLY 105 CO 0.24 -0.05 0.42 1.05 0.00 0.00 0.00 176.54 178.19 2d9y h GLU 106 N 0.15 0.62 -0.18 4.80 4.11 -0.76 0.20 114.58 123.52 2d9y h GLU 106 Ca 0.17 -0.04 0.05 0.00 0.07 0.00 0.00 59.36 59.62 2d9y h GLU 106 Cb 0.22 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 2d9y h GLU 106 CO -0.26 0.41 0.16 0.00 0.07 0.00 0.00 179.01 179.40 2d9y h ALA 107 N 1.51 1.97 0.06 1.06 0.00 -1.47 -1.28 119.26 121.11 2d9y h ALA 107 Ca 0.42 -0.01 -0.29 0.00 0.00 0.00 0.00 54.91 55.03 2d9y h ALA 107 Cb 0.53 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.31 2d9y h ALA 107 CO -0.32 -0.26 -1.56 0.00 0.00 0.00 0.00 179.25 177.11 2d9y h ALA 108 N 1.85 0.46 -2.30 0.00 0.00 -0.25 -3.39 119.26 115.63 2d9y h ALA 108 Ca 0.09 -1.22 -0.49 0.00 0.00 0.00 0.00 54.91 53.28 2d9y h ALA 108 Cb 0.41 0.33 0.01 0.00 0.00 0.00 0.00 17.79 18.53 2d9y h ALA 108 CO -0.00 1.32 0.14 -0.98 0.00 0.00 0.00 179.25 179.73 2d9y s ARG 109 N -2.62 3.80 0.00 0.00 1.70 -0.39 -3.61 118.95 117.83 2d9y s ARG 109 Ca -0.08 0.52 -0.03 0.00 -0.47 0.00 0.00 55.73 55.67 2d9y s ARG 109 Cb 0.08 -2.36 -0.01 0.00 -0.57 0.00 0.00 34.95 32.09 2d9y s ARG 109 CO 0.83 -0.06 0.05 0.08 -1.08 0.00 0.00 175.30 175.12 2d9y s VAL 110 N -2.40 0.07 -0.41 4.99 1.01 -1.26 -4.86 120.40 117.55 2d9y s VAL 110 Ca 0.52 -0.62 -0.16 0.00 0.00 0.00 0.00 61.98 61.73 2d9y s VAL 110 Cb -0.10 -0.28 0.02 0.00 0.00 0.00 0.00 36.38 36.01 2d9y s VAL 110 CO 0.31 -0.34 0.36 -1.58 0.00 0.00 0.00 175.10 173.86 2d9y s GLN 111 N -1.07 3.10 -0.61 2.72 0.74 -1.26 -4.94 119.66 118.34 2d9y s GLN 111 Ca -0.12 -0.83 -0.00 0.00 0.05 0.00 0.00 55.36 54.46 2d9y s GLN 111 Cb -0.07 -3.95 0.51 0.00 1.10 0.00 0.00 33.01 30.60 2d9y s GLN 111 CO 0.00 -0.76 2.00 -1.13 -0.55 0.00 0.00 175.29 174.85 2d9y n SER 112 N 5.37 6.66 -0.44 6.67 3.41 -1.26 -4.95 113.62 129.08 2d9y n SER 112 Ca -0.09 -3.74 0.00 0.00 -0.26 0.00 0.00 58.87 54.77 2d9y n SER 112 Cb 0.47 -0.93 0.00 0.00 -0.26 0.00 0.00 64.21 63.49 2d9y n SER 112 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2d9y n GLY 113 N -0.98 1.60 3.63 5.00 0.00 -1.26 -5.02 105.19 108.16 2d9y n GLY 113 Ca 0.62 -1.94 -0.43 0.00 0.00 0.00 0.00 46.02 44.27 2d9y n GLY 113 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2d9y s PRO 114 N 2.83 3.78 -0.17 1.61 0.04 -1.26 -4.99 135.00 136.83 2d9y s PRO 114 Ca 0.00 1.64 -0.19 0.00 0.04 0.00 0.00 61.00 62.49 2d9y s PRO 114 Cb 0.00 -4.04 -0.03 0.00 0.04 0.00 0.00 34.50 30.47 2d9y s PRO 114 CO 0.00 -1.32 0.55 0.45 0.04 0.00 0.00 177.00 176.72 2d9y s SER 115 N 4.29 6.65 -0.14 6.66 0.15 -1.26 -4.98 113.70 125.07 2d9y s SER 115 Ca 0.71 0.78 -0.17 0.00 0.70 0.00 0.00 55.95 57.98 2d9y s SER 115 Cb -0.25 -2.31 -0.14 0.00 -1.71 0.00 0.00 66.02 61.61 2d9y s SER 115 CO 0.29 -0.15 0.31 0.28 1.20 0.00 0.00 173.24 175.17 2d9y h SER 116 N 7.24 0.00 0.00 5.45 0.02 -2.04 -3.56 113.55 120.65 2d9y h SER 116 Ca -0.35 -0.49 0.00 0.00 -0.84 0.00 0.00 61.79 60.11 2d9y h SER 116 Cb 1.16 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.70 2d9y h SER 116 CO 0.75 0.94 0.00 0.61 -1.14 0.00 0.00 176.83 178.00