#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 6.54 -0.65 1.61 0.15 -1.26 -4.99 113.70 115.11 2d9y s SER 2 Ca 0.00 -2.04 -0.26 0.00 0.70 0.00 0.00 55.95 54.35 2d9y s SER 2 Cb 0.00 -2.33 -0.02 0.00 -1.71 0.00 0.00 66.02 61.97 2d9y s SER 2 CO 0.00 -0.96 1.80 -0.55 1.20 0.00 0.00 173.24 174.74 2d9y s SER 3 N 3.23 5.36 0.00 5.45 0.15 -1.26 -4.85 113.70 121.78 2d9y s SER 3 Ca 0.23 0.18 0.00 0.00 0.70 0.00 0.00 55.95 57.06 2d9y s SER 3 Cb -0.11 -2.53 0.00 0.00 -1.71 0.00 0.00 66.02 61.66 2d9y s SER 3 CO -0.05 -2.34 0.00 0.61 1.20 0.00 0.00 173.24 172.66 2d9y n GLY 4 N 5.75 2.02 3.12 9.45 0.00 -1.26 -5.19 105.19 119.09 2d9y n GLY 4 Ca 0.20 -0.83 -0.10 0.00 0.00 0.00 0.00 46.02 45.29 2d9y n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2d9y s SER 5 N 0.62 0.89 0.23 1.61 0.01 -1.26 -5.05 113.70 110.76 2d9y s SER 5 Ca 0.00 -0.91 -0.06 0.00 1.31 0.00 0.00 55.95 56.29 2d9y s SER 5 Cb 0.00 0.11 0.38 0.00 0.21 0.00 0.00 66.02 66.72 2d9y s SER 5 CO 0.00 -0.45 1.78 0.28 0.41 0.00 0.00 173.24 175.25 2d9y h SER 6 N 3.33 0.48 0.00 2.44 0.02 -2.03 -3.40 113.55 114.39 2d9y h SER 6 Ca -0.35 0.07 -0.10 0.00 -0.84 0.00 0.00 61.79 60.57 2d9y h SER 6 Cb 1.17 -0.01 -0.13 0.00 0.14 0.00 0.00 62.40 63.56 2d9y h SER 6 CO 0.60 0.26 -0.10 0.61 -1.14 0.00 0.00 176.83 177.06 2d9y n GLY 7 N -1.31 -1.41 0.11 -3.77 0.00 -1.26 -5.03 105.19 92.52 2d9y n GLY 7 Ca 0.12 0.84 -0.12 0.00 0.00 0.00 0.00 46.02 46.87 2d9y n GLY 7 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 2d9y h ASN 8 N 3.16 0.25 -4.19 1.61 -1.07 -2.00 -3.44 115.58 109.90 2d9y h ASN 8 Ca -0.23 -0.30 -0.52 0.00 0.07 0.00 0.00 56.30 55.32 2d9y h ASN 8 Cb 1.18 -0.07 0.13 0.00 -2.07 0.00 0.00 38.32 37.49 2d9y h ASN 8 CO -0.09 0.49 0.38 0.00 0.07 0.00 0.00 177.43 178.28 2d9y s ALA 9 N -5.00 2.28 0.73 4.14 0.00 -1.26 -5.00 121.76 117.65 2d9y s ALA 9 Ca -0.14 0.71 -0.12 0.00 0.00 0.00 0.00 51.96 52.40 2d9y s ALA 9 Cb 0.06 -3.39 0.03 0.00 0.00 0.00 0.00 23.12 19.82 2d9y s ALA 9 CO 0.71 -1.59 1.10 -1.25 0.00 0.00 0.00 175.76 174.73 2d9y s PRO 10 N -4.01 2.48 0.29 0.00 0.04 -1.26 -4.96 135.00 127.57 2d9y s PRO 10 Ca 0.70 1.26 -0.30 0.00 0.04 0.00 0.00 61.00 62.70 2d9y s PRO 10 Cb -0.25 -1.92 -0.11 0.00 0.04 0.00 0.00 34.50 32.26 2d9y s PRO 10 CO 0.43 -1.48 1.57 0.08 0.04 0.00 0.00 177.00 177.64 2d9y s VAL 11 N -2.68 2.15 -0.12 -0.36 1.01 -1.26 -4.86 120.40 114.29 2d9y s VAL 11 Ca 0.63 0.13 -0.24 0.00 0.00 0.00 0.00 61.98 62.50 2d9y s VAL 11 Cb -0.18 -3.08 -0.27 0.00 0.00 0.00 0.00 36.38 32.85 2d9y s VAL 11 CO 0.50 0.02 0.68 0.74 0.00 0.00 0.00 175.10 177.05 2d9y h THR 12 N 3.40 1.46 -2.61 3.92 2.02 -1.86 -3.49 112.91 115.75 2d9y h THR 12 Ca -0.47 -2.38 -0.06 0.00 0.77 0.00 0.00 66.41 64.26 2d9y h THR 12 Cb 1.22 3.06 -0.17 0.00 -1.74 0.00 0.00 68.15 70.52 2d9y h THR 12 CO 0.79 0.61 0.06 -0.75 0.37 0.00 0.00 175.52 176.60 2d9y s LYS 13 N -2.34 1.03 -0.24 6.66 2.20 -1.09 -5.00 119.74 120.96 2d9y s LYS 13 Ca -0.19 -0.12 -0.14 0.00 -0.36 0.00 0.00 55.97 55.16 2d9y s LYS 13 Cb 0.01 0.47 0.07 0.00 -1.51 0.00 0.00 37.83 36.87 2d9y s LYS 13 CO 0.73 -0.36 0.59 0.00 -0.36 0.00 0.00 175.35 175.95 2d9y s ALA 14 N -2.11 -1.56 -0.16 3.13 0.00 -1.26 -0.45 121.76 119.35 2d9y s ALA 14 Ca -0.07 2.05 -0.34 0.00 0.00 0.00 0.00 51.96 53.59 2d9y s ALA 14 Cb -0.01 -1.21 0.14 0.00 0.00 0.00 0.00 23.12 22.03 2d9y s ALA 14 CO 0.01 -0.33 1.22 0.20 0.00 0.00 0.00 175.76 176.86 2d9y s GLY 15 N 1.39 -0.31 -0.31 0.00 0.00 -0.11 -5.01 107.32 102.97 2d9y s GLY 15 Ca -0.09 1.45 -0.29 0.00 0.00 0.00 0.00 44.72 45.80 2d9y s GLY 15 CO -0.15 0.47 1.37 -0.98 0.00 0.00 0.00 173.10 173.81 2d9y s TRP 16 N -2.43 2.54 0.04 1.90 0.52 -1.26 -1.72 118.94 118.52 2d9y s TRP 16 Ca 0.10 0.78 0.08 0.00 0.02 0.00 0.00 56.10 57.08 2d9y s TRP 16 Cb -0.00 -3.99 -0.03 0.00 -1.15 0.00 0.00 33.47 28.30 2d9y s TRP 16 CO -0.05 -1.95 -0.23 -0.51 0.02 0.00 0.00 176.95 174.23 2d9y s LEU 17 N 4.71 2.15 -0.18 2.99 1.43 -0.44 -4.76 118.68 124.59 2d9y s LEU 17 Ca 0.60 -0.53 -0.17 0.00 -1.03 0.00 0.00 54.13 52.99 2d9y s LEU 17 Cb -0.17 -1.11 -0.04 0.00 0.03 0.00 0.00 46.19 44.90 2d9y s LEU 17 CO 0.26 0.21 0.46 -0.36 0.23 0.00 0.00 176.35 177.15 2d9y s PHE 18 N -0.76 3.41 -0.15 0.29 0.40 -1.06 -1.14 117.98 118.97 2d9y s PHE 18 Ca 0.09 0.75 -0.05 0.00 -0.60 0.00 0.00 56.93 57.12 2d9y s PHE 18 Cb -0.09 -2.58 -0.04 0.00 0.51 0.00 0.00 43.02 40.82 2d9y s PHE 18 CO 0.02 0.01 0.04 0.21 0.70 0.00 0.00 175.22 176.20 2d9y s LYS 19 N 1.21 3.64 0.37 0.44 2.20 0.00 -1.50 119.74 126.11 2d9y s LYS 19 Ca 0.23 -0.37 -0.28 0.00 -0.36 0.00 0.00 55.97 55.19 2d9y s LYS 19 Cb -0.15 -3.06 -0.10 0.00 -1.51 0.00 0.00 37.83 33.01 2d9y s LYS 19 CO 0.09 0.42 1.37 -1.14 -0.36 0.00 0.00 175.35 175.73 2d9y s GLN 20 N -0.07 4.16 0.73 4.03 0.74 -1.04 -1.60 119.66 126.61 2d9y s GLN 20 Ca 0.05 2.32 -0.15 0.00 0.05 0.00 0.00 55.36 57.63 2d9y s GLN 20 Cb -0.12 -2.95 0.04 0.00 1.10 0.00 0.00 33.01 31.08 2d9y s GLN 20 CO 0.01 -0.40 1.24 0.00 -0.55 0.00 0.00 175.29 175.60 2d9y s ALA 21 N -1.16 2.10 -0.15 1.58 0.00 -0.64 -4.90 121.76 118.59 2d9y s ALA 21 Ca 0.52 1.00 0.01 0.00 0.00 0.00 0.00 51.96 53.49 2d9y s ALA 21 Cb -0.42 -3.51 0.02 0.00 0.00 0.00 0.00 23.12 19.21 2d9y s ALA 21 CO 0.55 -1.95 -0.17 -1.12 0.00 0.00 0.00 175.76 173.07 2d9y s SER 22 N -1.83 2.82 -0.51 0.00 0.01 -1.26 -4.74 113.70 108.19 2d9y s SER 22 Ca 0.77 -0.54 -0.00 0.00 1.31 0.00 0.00 55.95 57.49 2d9y s SER 22 Cb -0.32 -1.28 0.00 0.00 0.21 0.00 0.00 66.02 64.62 2d9y s SER 22 CO 0.45 -0.00 0.42 -0.24 0.41 0.00 0.00 173.24 174.29 2d9y n SER 23 N 4.48 -2.14 -0.63 2.44 2.88 -1.26 -5.01 113.62 114.39 2d9y n SER 23 Ca -0.19 -0.26 0.00 0.00 -1.33 0.00 0.00 58.87 57.09 2d9y n SER 23 Cb 0.51 -2.44 0.00 0.00 -0.75 0.00 0.00 64.21 61.53 2d9y n SER 23 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2d9y n GLY 24 N -1.06 0.68 3.30 0.46 0.00 -1.26 -5.16 105.19 102.14 2d9y n GLY 24 Ca -0.11 -0.74 -0.34 0.00 0.00 0.00 0.00 46.02 44.83 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 0.00 0.00 -1.70 1.61 0.24 -1.26 -4.81 118.33 112.41 2d9y n VAL 25 Ca 0.00 -0.25 -0.39 0.00 -2.04 0.00 0.00 64.34 61.66 2d9y n VAL 25 Cb 0.00 -0.50 -0.02 0.00 -1.47 0.00 0.00 33.84 31.86 2d9y n VAL 25 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 2d9y n LYS 26 N -0.99 4.19 -3.48 7.34 4.76 -1.26 -4.64 118.16 124.08 2d9y n LYS 26 Ca 0.03 -2.92 -0.22 0.00 -2.87 0.00 0.00 58.31 52.33 2d9y n LYS 26 Cb 0.58 -2.68 0.00 0.00 -1.84 0.00 0.00 35.03 31.09 2d9y n LYS 26 CO 0.00 0.00 0.00 1.14 -1.37 0.00 0.00 177.40 177.17 2d9y s GLN 27 N 0.17 2.42 -0.05 1.97 -2.07 -1.26 -4.98 119.66 115.87 2d9y s GLN 27 Ca 0.61 -1.68 0.03 0.00 -1.82 0.00 0.00 55.36 52.50 2d9y s GLN 27 Cb 0.19 -2.40 0.00 0.00 -1.09 0.00 0.00 33.01 29.71 2d9y s GLN 27 CO -0.08 -0.49 -0.13 -1.58 -1.32 0.00 0.00 175.29 171.68 2d9y s TRP 28 N -2.60 1.45 -0.12 9.60 0.52 -1.26 -1.62 118.94 124.91 2d9y s TRP 28 Ca 0.48 -0.45 0.01 0.00 0.02 0.00 0.00 56.10 56.15 2d9y s TRP 28 Cb -0.04 -1.02 -0.01 0.00 -1.15 0.00 0.00 33.47 31.25 2d9y s TRP 28 CO 0.29 -0.19 -0.15 0.54 0.02 0.00 0.00 176.95 177.46 2d9y s ASN 29 N 0.31 3.84 0.30 2.95 2.20 -0.63 -4.92 114.94 118.99 2d9y s ASN 29 Ca -0.08 -0.37 -0.29 0.00 -0.94 0.00 0.00 52.86 51.18 2d9y s ASN 29 Cb -0.12 -1.56 -0.10 0.00 -2.00 0.00 0.00 41.25 37.46 2d9y s ASN 29 CO 0.02 0.17 1.19 -0.75 -2.94 0.00 0.00 177.10 174.79 2d9y s LYS 30 N 0.33 4.51 -0.16 3.55 2.20 -1.26 -0.82 119.74 128.10 2d9y s LYS 30 Ca -0.12 1.99 -0.23 0.00 -0.36 0.00 0.00 55.97 57.24 2d9y s LYS 30 Cb -0.16 -3.14 0.06 0.00 -1.51 0.00 0.00 37.83 33.08 2d9y s LYS 30 CO 0.06 0.03 0.60 0.50 -0.36 0.00 0.00 175.35 176.18 2d9y s ARG 31 N -1.57 0.80 -0.20 4.03 6.06 -0.29 -4.90 118.95 122.87 2d9y s ARG 31 Ca 0.47 0.59 -0.29 0.00 -2.50 0.00 0.00 55.73 54.00 2d9y s ARG 31 Cb -0.35 0.38 -0.01 0.00 0.06 0.00 0.00 34.95 35.03 2d9y s ARG 31 CO 0.46 -0.16 1.31 -0.46 -2.50 0.00 0.00 175.30 173.95 2d9y s TRP 32 N -0.23 2.73 -0.08 5.12 -0.11 -1.02 -1.32 118.94 124.03 2d9y s TRP 32 Ca -0.04 0.92 0.01 0.00 1.22 0.00 0.00 56.10 58.21 2d9y s TRP 32 Cb -0.03 -3.65 -0.02 0.00 -1.50 0.00 0.00 33.47 28.26 2d9y s TRP 32 CO 0.04 -1.85 -0.11 -0.06 -4.62 0.00 0.00 176.95 170.34 2d9y s PHE 33 N 3.84 2.82 -0.30 5.86 0.40 -0.70 -0.92 117.98 128.98 2d9y s PHE 33 Ca 0.57 -0.23 -0.02 0.00 -0.60 0.00 0.00 56.93 56.64 2d9y s PHE 33 Cb -0.21 -1.73 0.10 0.00 0.51 0.00 0.00 43.02 41.69 2d9y s PHE 33 CO 0.18 0.11 0.11 0.08 0.70 0.00 0.00 175.22 176.40 2d9y s VAL 34 N -0.41 0.52 0.09 -0.44 1.01 0.35 -0.94 120.40 120.59 2d9y s VAL 34 Ca 0.05 -1.13 -0.31 0.00 0.00 0.00 0.00 61.98 60.59 2d9y s VAL 34 Cb -0.12 -1.39 -0.09 0.00 0.00 0.00 0.00 36.38 34.78 2d9y s VAL 34 CO 0.02 -0.67 1.70 -0.22 0.00 0.00 0.00 175.10 175.93 2d9y s LEU 35 N 1.80 4.38 0.00 3.92 2.96 0.40 -2.26 118.68 129.88 2d9y s LEU 35 Ca 0.09 2.57 0.01 0.00 -0.22 0.00 0.00 54.13 56.58 2d9y s LEU 35 Cb -0.17 -3.56 0.01 0.00 0.50 0.00 0.00 46.19 42.97 2d9y s LEU 35 CO -0.29 -0.92 0.08 0.55 -1.32 0.00 0.00 176.35 174.46 2d9y n VAL 36 N 4.71 0.00 -1.68 1.68 3.14 0.30 -2.66 118.33 123.82 2d9y n VAL 36 Ca 0.16 -0.84 -0.45 0.00 -2.96 0.00 0.00 64.34 60.25 2d9y n VAL 36 Cb 0.40 -0.11 -0.04 0.00 -1.06 0.00 0.00 33.84 33.03 2d9y n VAL 36 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 2d9y n ASP 37 N -1.58 3.58 -2.81 6.55 2.03 -1.26 -2.22 116.55 120.84 2d9y n ASP 37 Ca -0.04 1.00 -0.17 0.00 0.52 0.00 0.00 54.79 56.10 2d9y n ASP 37 Cb 0.23 -1.45 -0.03 0.00 -0.72 0.00 0.00 41.12 39.15 2d9y n ASP 37 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2d9y n ARG 38 N 5.49 -1.36 -3.75 -0.67 1.74 -1.26 -4.72 116.66 112.14 2d9y n ARG 38 Ca 0.19 0.06 -0.01 0.00 -0.77 0.00 0.00 57.85 57.32 2d9y n ARG 38 Cb 0.32 -2.93 -0.00 0.00 -1.02 0.00 0.00 32.46 28.83 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 -3.09 1.18 0.08 0.00 2.96 -0.70 0.11 118.68 119.22 2d9y s LEU 40 Ca 0.16 0.29 0.06 0.00 -0.22 0.00 0.00 54.13 54.41 2d9y s LEU 40 Cb 0.01 0.82 -0.03 0.00 0.50 0.00 0.00 46.19 47.48 2d9y s LEU 40 CO 0.01 -0.17 -0.15 -0.36 -1.32 0.00 0.00 176.35 174.35 2d9y s PHE 41 N -0.32 1.33 0.04 5.38 0.08 -0.96 -0.97 117.98 122.55 2d9y s PHE 41 Ca -0.04 -0.46 0.04 0.00 0.12 0.00 0.00 56.93 56.59 2d9y s PHE 41 Cb -0.03 -0.74 -0.02 0.00 -0.57 0.00 0.00 43.02 41.66 2d9y s PHE 41 CO 0.01 0.09 -0.13 1.52 -0.10 0.00 0.00 175.22 176.61 2d9y s TYR 42 N -1.31 1.12 0.14 0.36 -0.85 -1.22 -0.49 117.35 115.10 2d9y s TYR 42 Ca 0.00 -0.35 0.05 0.00 -0.52 0.00 0.00 57.07 56.26 2d9y s TYR 42 Cb -0.10 -0.67 -0.04 0.00 0.38 0.00 0.00 41.96 41.54 2d9y s TYR 42 CO 0.03 0.02 -0.12 0.71 -1.52 0.00 0.00 175.55 174.67 2d9y s TYR 43 N -0.85 1.36 0.31 -3.49 1.51 -0.09 -3.29 117.35 112.81 2d9y s TYR 43 Ca 0.00 -0.66 0.07 0.00 -1.01 0.00 0.00 57.07 55.48 2d9y s TYR 43 Cb -0.08 -0.69 0.80 0.00 -0.11 0.00 0.00 41.96 41.88 2d9y s TYR 43 CO 0.01 0.14 1.76 -0.22 -1.11 0.00 0.00 175.55 176.13 2d9y h LYS 44 N 3.04 0.68 0.00 -0.62 1.63 -1.87 -2.69 116.57 116.74 2d9y h LYS 44 Ca -0.38 -0.04 -0.11 0.00 -0.85 0.00 0.00 60.65 59.27 2d9y h LYS 44 Cb 1.20 -0.15 -0.02 0.00 -0.60 0.00 0.00 32.23 32.66 2d9y h LYS 44 CO 0.58 0.45 0.06 -0.40 -3.45 0.00 0.00 179.45 176.69 2d9y n ASP 45 N -4.81 -1.36 -0.33 4.20 5.68 -1.26 -4.42 116.55 114.26 2d9y n ASP 45 Ca 0.25 -2.26 0.14 0.00 -0.50 0.00 0.00 54.79 52.42 2d9y n ASP 45 Cb 0.64 2.35 0.33 0.00 -1.14 0.00 0.00 41.12 43.30 2d9y n ASP 45 CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 2d9y h GLU 46 N 0.00 0.53 -1.63 0.11 -0.00 -1.95 -0.03 114.58 111.61 2d9y h GLU 46 Ca -0.22 -0.03 0.48 0.00 -0.00 0.00 0.00 59.36 59.59 2d9y h GLU 46 Cb 0.88 -0.12 -0.07 0.00 -0.00 0.00 0.00 28.75 29.44 2d9y h GLU 46 CO 0.29 0.35 1.17 1.63 -0.00 0.00 0.00 179.01 182.45 2d9y n LYS 47 N -4.92 -0.00 -3.39 1.06 5.02 -1.26 -4.66 118.16 110.00 2d9y n LYS 47 Ca 0.24 0.93 -0.19 0.00 -2.02 0.00 0.00 58.31 57.27 2d9y n LYS 47 Cb 0.65 -2.12 -0.05 0.00 -0.02 0.00 0.00 35.03 33.49 2d9y n LYS 47 CO 0.00 0.00 0.00 -0.85 -0.52 0.00 0.00 177.40 176.03 2d9y n GLU 48 N -3.71 -0.92 -0.06 1.97 0.28 -0.03 -4.78 120.64 113.39 2d9y n GLU 48 Ca 0.38 0.06 -0.09 0.00 -0.16 0.00 0.00 57.16 57.35 2d9y n GLU 48 Cb 1.68 -2.20 -0.08 0.00 1.43 0.00 0.00 31.44 32.27 2d9y n GLU 48 CO 0.00 0.00 0.00 0.93 -0.16 0.00 0.00 177.13 177.90 2d9y h GLU 49 N -0.52 0.00 -5.54 3.44 4.39 -1.85 -3.46 114.58 111.05 2d9y h GLU 49 Ca -0.35 0.00 -0.68 0.00 0.34 0.00 0.00 59.36 58.67 2d9y h GLU 49 Cb 0.77 0.00 -0.30 0.00 -0.10 0.00 0.00 28.75 29.12 2d9y h GLU 49 CO 0.43 0.61 -0.84 -1.54 -1.16 0.00 0.00 179.01 176.51 2d9y s SER 50 N -5.99 3.44 0.06 1.42 1.04 -1.26 -5.11 113.70 107.30 2d9y s SER 50 Ca -0.12 -0.45 -0.30 0.00 0.48 0.00 0.00 55.95 55.56 2d9y s SER 50 Cb -0.01 -1.32 -0.05 0.00 0.10 0.00 0.00 66.02 64.74 2d9y s SER 50 CO 0.42 0.19 0.96 -0.63 0.98 0.00 0.00 173.24 175.16 2d9y s ILE 51 N 0.17 4.67 -0.20 -1.02 1.01 -1.26 -4.61 121.20 119.95 2d9y s ILE 51 Ca -0.11 2.04 -0.15 0.00 0.00 0.00 0.00 60.65 62.43 2d9y s ILE 51 Cb -0.16 -4.31 -0.20 0.00 0.01 0.00 0.00 42.46 37.80 2d9y s ILE 51 CO 0.06 0.25 0.13 0.18 0.00 0.00 0.00 174.94 175.57 2d9y n LEU 52 N 3.25 2.14 -3.80 2.97 4.77 -1.21 -5.02 117.00 120.11 2d9y n LEU 52 Ca 0.04 0.32 -0.11 0.00 -0.03 0.00 0.00 56.01 56.22 2d9y n LEU 52 Cb 0.50 -0.98 -0.08 0.00 -2.33 0.00 0.00 43.42 40.53 2d9y n LEU 52 CO 0.51 0.51 -0.04 -0.83 -1.33 0.00 0.00 177.39 176.22 2d9y s GLY 53 N -5.25 -0.05 -0.06 -0.72 0.00 -1.26 -5.10 107.32 94.88 2d9y s GLY 53 Ca -0.29 -0.11 0.06 0.00 0.00 0.00 0.00 44.72 44.37 2d9y s GLY 53 CO 0.62 -0.31 -0.24 -1.35 0.00 0.00 0.00 173.10 171.83 2d9y s SER 54 N -2.00 2.90 -0.36 1.64 1.04 -1.26 -3.41 113.70 112.25 2d9y s SER 54 Ca -0.06 -0.49 -0.03 0.00 0.48 0.00 0.00 55.95 55.86 2d9y s SER 54 Cb -0.01 -0.84 0.08 0.00 0.10 0.00 0.00 66.02 65.34 2d9y s SER 54 CO -0.03 0.22 0.11 -0.63 0.98 0.00 0.00 173.24 173.89 2d9y s ILE 55 N -0.08 3.19 -0.56 -1.02 1.01 -0.15 -5.01 121.20 118.57 2d9y s ILE 55 Ca -0.05 -1.71 -0.27 0.00 0.00 0.00 0.00 60.65 58.63 2d9y s ILE 55 Cb -0.14 -3.01 -0.02 0.00 0.01 0.00 0.00 42.46 39.30 2d9y s ILE 55 CO 0.04 -0.41 1.84 -2.16 0.00 0.00 0.00 174.94 174.25 2d9y s PRO 56 N 1.20 2.76 -0.46 2.79 0.04 -1.26 -1.73 135.00 138.35 2d9y s PRO 56 Ca 0.02 0.74 -0.03 0.00 0.04 0.00 0.00 61.00 61.77 2d9y s PRO 56 Cb -0.21 -4.35 0.16 0.00 0.04 0.00 0.00 34.50 30.14 2d9y s PRO 56 CO -0.02 -2.57 2.43 1.28 0.04 0.00 0.00 177.00 178.15 2d9y n LEU 57 N 12.28 6.65 0.24 -3.56 4.77 -1.24 -4.60 117.00 131.53 2d9y n LEU 57 Ca 0.21 -3.90 -0.10 0.00 -0.03 0.00 0.00 56.01 52.19 2d9y n LEU 57 Cb 0.51 -1.15 -0.05 0.00 -2.33 0.00 0.00 43.42 40.41 2d9y n LEU 57 CO 0.71 1.55 0.29 0.25 -1.33 0.00 0.00 177.39 178.86 2d9y h LEU 58 N 3.27 -0.56 -4.70 2.23 5.85 -1.81 -2.91 115.31 116.68 2d9y h LEU 58 Ca 0.39 0.02 -0.40 0.00 0.84 0.00 0.00 57.88 58.73 2d9y h LEU 58 Cb 0.74 0.14 -0.41 0.00 0.37 0.00 0.00 40.66 41.50 2d9y h LEU 58 CO 0.94 -0.20 -0.98 -0.24 -0.34 0.00 0.00 178.44 177.61 2d9y n SER 59 N -4.88 3.05 -4.87 1.25 2.88 -1.25 -4.12 113.62 105.68 2d9y n SER 59 Ca -0.08 -2.90 -0.29 0.00 -1.33 0.00 0.00 58.87 54.27 2d9y n SER 59 Cb 0.26 -0.44 0.09 0.00 -0.75 0.00 0.00 64.21 63.37 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 -3.61 2.89 -0.40 0.66 0.40 -1.26 -4.80 117.98 111.86 2d9y s PHE 60 Ca 0.38 0.71 0.04 0.00 -0.60 0.00 0.00 56.93 57.45 2d9y s PHE 60 Cb 0.38 -3.51 0.11 0.00 0.51 0.00 0.00 43.02 40.51 2d9y s PHE 60 CO -0.02 -1.79 0.13 0.50 0.70 0.00 0.00 175.22 174.73 2d9y s ARG 61 N -5.57 1.59 -0.21 0.44 3.52 0.14 -4.69 118.95 114.17 2d9y s ARG 61 Ca 0.62 -2.08 -0.10 0.00 -0.13 0.00 0.00 55.73 54.04 2d9y s ARG 61 Cb -0.11 -3.14 -0.05 0.00 -1.56 0.00 0.00 34.95 30.09 2d9y s ARG 61 CO 0.49 -1.01 0.14 0.08 -0.81 0.00 0.00 175.30 174.19 2d9y s VAL 62 N 0.53 5.40 -0.27 7.11 1.01 -1.26 -2.72 120.40 130.21 2d9y s VAL 62 Ca 0.13 0.19 -0.26 0.00 0.00 0.00 0.00 61.98 62.04 2d9y s VAL 62 Cb -0.21 -3.48 0.16 0.00 0.00 0.00 0.00 36.38 32.85 2d9y s VAL 62 CO -0.06 0.42 1.24 0.00 0.00 0.00 0.00 175.10 176.70 2d9y s ALA 63 N 0.51 -2.09 0.03 5.51 0.00 -0.87 -4.85 121.76 119.99 2d9y s ALA 63 Ca 0.08 1.76 -0.29 0.00 0.00 0.00 0.00 51.96 53.51 2d9y s ALA 63 Cb -0.12 -1.50 -0.15 0.00 0.00 0.00 0.00 23.12 21.36 2d9y s ALA 63 CO -0.01 -0.19 0.73 0.00 0.00 0.00 0.00 175.76 176.30 2d9y n ALA 64 N 1.52 -2.82 -0.56 0.00 0.00 -1.26 -2.12 120.51 115.26 2d9y n ALA 64 Ca -0.10 0.43 -0.09 0.00 0.00 0.00 0.00 53.44 53.69 2d9y n ALA 64 Cb 0.57 -1.32 0.15 0.00 0.00 0.00 0.00 19.45 18.84 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 0.91 0.00 -4.28 0.00 0.24 -0.56 -4.69 118.33 109.96 2d9y n VAL 65 Ca 0.15 0.00 -0.15 0.00 -2.04 0.00 0.00 64.34 62.30 2d9y n VAL 65 Cb 0.09 -0.49 -0.10 0.00 -1.47 0.00 0.00 33.84 31.87 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 -3.56 1.14 0.00 7.34 -0.21 -1.26 -4.98 119.66 118.13 2d9y s GLN 66 Ca 0.33 -1.50 0.15 0.00 0.02 0.00 0.00 55.36 54.36 2d9y s GLN 66 Cb -0.06 -0.72 0.81 0.00 1.00 0.00 0.00 33.01 34.04 2d9y s GLN 66 CO 0.28 0.08 1.38 -0.35 -2.12 0.00 0.00 175.29 174.56 2d9y n PRO 67 N -0.25 0.31 -0.00 2.91 -0.04 -1.26 -1.87 135.00 134.79 2d9y n PRO 67 Ca -0.09 0.09 0.10 0.00 -0.04 0.00 0.00 63.50 63.56 2d9y n PRO 67 Cb 0.61 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.45 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 -1.18 0.94 -0.46 3.54 7.64 -1.26 -4.13 113.62 118.71 2d9y n SER 68 Ca 0.09 -0.94 0.11 0.00 1.01 0.00 0.00 58.87 59.13 2d9y n SER 68 Cb 0.09 1.04 0.42 0.00 -1.01 0.00 0.00 64.21 64.75 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 -1.52 1.38 -2.51 6.43 8.00 -0.78 -4.90 116.55 122.65 2d9y n ASP 69 Ca 0.04 -1.64 -0.21 0.00 0.71 0.00 0.00 54.79 53.68 2d9y n ASP 69 Cb 0.33 -0.08 -0.00 0.00 -0.02 0.00 0.00 41.12 41.35 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 0.13 -5.92 -4.40 -2.24 3.02 -1.26 -4.92 115.26 99.68 2d9y n ASN 70 Ca 0.16 -0.06 -0.45 0.00 -0.03 0.00 0.00 54.58 54.20 2d9y n ASN 70 Cb 0.29 -4.90 -0.01 0.00 -0.61 0.00 0.00 39.78 34.55 2d9y n ASN 70 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2d9y s ILE 71 N -3.06 5.36 -0.04 2.41 -1.09 -1.26 -4.89 121.20 118.64 2d9y s ILE 71 Ca 0.05 -2.57 -0.02 0.00 -2.23 0.00 0.00 60.65 55.88 2d9y s ILE 71 Cb -0.02 -4.70 -0.08 0.00 -1.58 0.00 0.00 42.46 36.08 2d9y s ILE 71 CO 0.06 -1.34 2.58 -0.24 -1.23 0.00 0.00 174.94 174.77 2d9y n SER 72 N 4.68 5.42 -3.91 3.58 2.88 -1.26 -4.74 113.62 120.27 2d9y n SER 72 Ca 0.25 -2.50 -0.29 0.00 -1.33 0.00 0.00 58.87 55.00 2d9y n SER 72 Cb 0.44 -1.23 -0.16 0.00 -0.75 0.00 0.00 64.21 62.51 2d9y n SER 72 CO 0.00 0.00 0.00 -0.13 -1.23 0.00 0.00 175.04 173.68 2d9y s ARG 73 N 0.16 1.52 0.68 -1.46 0.52 -1.26 -5.12 118.95 113.99 2d9y s ARG 73 Ca 0.27 -0.66 -0.17 0.00 -0.52 0.00 0.00 55.73 54.65 2d9y s ARG 73 Cb 0.14 -2.20 0.01 0.00 0.52 0.00 0.00 34.95 33.42 2d9y s ARG 73 CO -0.01 -0.48 1.23 0.15 0.02 0.00 0.00 175.30 176.21 2d9y s LYS 74 N 1.56 2.43 -1.34 3.54 -0.14 -1.26 -3.25 119.74 121.29 2d9y s LYS 74 Ca -0.01 1.85 -0.05 0.00 -1.36 0.00 0.00 55.97 56.40 2d9y s LYS 74 Cb -0.16 -1.86 0.02 0.00 -1.68 0.00 0.00 37.83 34.15 2d9y s LYS 74 CO -0.08 -1.63 0.98 0.72 -0.76 0.00 0.00 175.35 174.58 2d9y n HIS 75 N -2.26 -2.35 -5.19 3.18 8.25 -1.26 -4.51 115.22 111.08 2d9y n HIS 75 Ca 0.14 0.93 -0.30 0.00 -0.26 0.00 0.00 57.72 58.24 2d9y n HIS 75 Cb 0.50 -4.69 -0.16 0.00 1.12 0.00 0.00 29.99 26.76 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 -3.41 1.90 0.19 1.59 2.01 -1.20 -0.04 115.64 116.68 2d9y s THR 76 Ca 0.30 -1.04 0.06 0.00 0.31 0.00 0.00 61.69 61.32 2d9y s THR 76 Cb -0.14 -1.58 -0.05 0.00 0.01 0.00 0.00 72.50 70.74 2d9y s THR 76 CO 0.77 0.53 -0.11 0.72 -0.69 0.00 0.00 174.62 175.84 2d9y s PHE 77 N -0.57 1.57 0.07 4.92 -0.71 -0.28 -1.49 117.98 121.48 2d9y s PHE 77 Ca 0.09 -0.68 0.09 0.00 -1.04 0.00 0.00 56.93 55.40 2d9y s PHE 77 Cb -0.09 -0.78 -0.03 0.00 -1.21 0.00 0.00 43.02 40.90 2d9y s PHE 77 CO -0.01 0.23 -0.24 -1.59 -1.34 0.00 0.00 175.22 172.26 2d9y s LYS 78 N -3.70 1.74 -0.26 1.99 -2.85 -0.90 -1.28 119.74 114.47 2d9y s LYS 78 Ca 0.22 -1.16 -0.02 0.00 -1.00 0.00 0.00 55.97 54.01 2d9y s LYS 78 Cb 0.01 -2.01 0.09 0.00 -2.06 0.00 0.00 37.83 33.86 2d9y s LYS 78 CO 0.05 0.50 0.08 0.00 0.10 0.00 0.00 175.35 176.08 2d9y s ALA 79 N -0.92 1.20 0.11 0.59 0.00 -0.84 -2.06 121.76 119.83 2d9y s ALA 79 Ca 0.13 -1.22 0.08 0.00 0.00 0.00 0.00 51.96 50.95 2d9y s ALA 79 Cb -0.10 -1.42 -0.04 0.00 0.00 0.00 0.00 23.12 21.56 2d9y s ALA 79 CO 0.04 -1.48 -0.20 -1.83 0.00 0.00 0.00 175.76 172.29 2d9y s GLU 80 N 1.78 1.12 -0.12 0.00 -1.05 -1.10 -0.93 118.70 118.39 2d9y s GLU 80 Ca 0.06 -1.17 0.14 0.00 -0.15 0.00 0.00 54.97 53.85 2d9y s GLU 80 Cb -0.17 -1.34 0.63 0.00 -0.44 0.00 0.00 34.13 32.81 2d9y s GLU 80 CO -0.21 0.31 1.51 1.58 0.95 0.00 0.00 175.26 179.40 2d9y n HIS 81 N 1.02 1.39 -3.61 4.83 -0.00 -1.17 0.29 115.22 117.97 2d9y n HIS 81 Ca -0.19 -0.53 -0.21 0.00 -0.00 0.00 0.00 57.72 56.79 2d9y n HIS 81 Cb 0.54 -0.28 0.06 0.00 -0.00 0.00 0.00 29.99 30.31 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 0.83 -1.87 0.00 1.57 0.00 -1.26 -4.31 120.51 115.47 2d9y n ALA 82 Ca 0.22 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.63 2d9y n ALA 82 Cb 0.84 -2.77 0.00 0.00 0.00 0.00 0.00 19.45 17.53 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 -1.47 1.42 0.00 0.00 0.00 -1.26 -5.03 105.19 98.85 2d9y n GLY 83 Ca -0.23 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.73 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 -3.51 1.61 0.31 -1.26 -4.98 118.33 110.50 2d9y n VAL 84 Ca 0.00 1.37 -0.09 0.00 -0.01 0.00 0.00 64.34 65.61 2d9y n VAL 84 Cb 0.00 -2.37 -0.02 0.00 -0.91 0.00 0.00 33.84 30.54 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 -2.58 0.83 -0.35 5.55 3.52 -1.26 -5.01 118.95 119.66 2d9y s ARG 85 Ca 0.00 -0.25 -0.06 0.00 -0.13 0.00 0.00 55.73 55.29 2d9y s ARG 85 Cb 0.00 0.38 0.05 0.00 -1.56 0.00 0.00 34.95 33.82 2d9y s ARG 85 CO 0.00 -0.35 0.11 0.99 -0.81 0.00 0.00 175.30 175.24 2d9y s THR 86 N -2.92 3.72 0.58 4.11 2.01 -1.26 -3.06 115.64 118.82 2d9y s THR 86 Ca 0.04 -1.23 -0.01 0.00 0.31 0.00 0.00 61.69 60.80 2d9y s THR 86 Cb -0.01 -3.15 0.04 0.00 0.01 0.00 0.00 72.50 69.39 2d9y s THR 86 CO -0.08 -0.23 0.82 -0.31 -0.69 0.00 0.00 174.62 174.14 2d9y s TYR 87 N 1.38 2.89 -0.16 4.92 1.51 -0.11 -4.92 117.35 122.85 2d9y s TYR 87 Ca -0.01 0.10 -0.06 0.00 -1.01 0.00 0.00 57.07 56.09 2d9y s TYR 87 Cb -0.20 -2.84 0.08 0.00 -0.11 0.00 0.00 41.96 38.89 2d9y s TYR 87 CO 0.02 -0.97 0.33 -0.06 -1.11 0.00 0.00 175.55 173.75 2d9y s PHE 88 N -2.86 -0.58 -0.11 2.71 0.40 -1.26 -1.98 117.98 114.29 2d9y s PHE 88 Ca 0.58 1.20 0.03 0.00 -0.60 0.00 0.00 56.93 58.14 2d9y s PHE 88 Cb -0.10 0.10 0.00 0.00 0.51 0.00 0.00 43.02 43.53 2d9y s PHE 88 CO 0.40 -0.41 -0.22 -0.06 0.70 0.00 0.00 175.22 175.63 2d9y s PHE 89 N 2.50 2.47 -0.10 0.36 0.08 -0.40 -2.51 117.98 120.38 2d9y s PHE 89 Ca 0.00 -1.08 -0.02 0.00 0.12 0.00 0.00 56.93 55.95 2d9y s PHE 89 Cb -0.12 -1.67 -0.03 0.00 -0.57 0.00 0.00 43.02 40.63 2d9y s PHE 89 CO -0.10 -0.46 0.01 0.45 -0.10 0.00 0.00 175.22 175.01 2d9y s SER 90 N 0.52 5.25 -0.11 1.36 0.15 -0.56 -1.13 113.70 119.18 2d9y s SER 90 Ca -0.15 0.12 -0.01 0.00 0.70 0.00 0.00 55.95 56.61 2d9y s SER 90 Cb -0.17 -1.55 -0.03 0.00 -1.71 0.00 0.00 66.02 62.56 2d9y s SER 90 CO 0.05 0.35 -0.05 0.00 1.20 0.00 0.00 173.24 174.79 2d9y s ALA 91 N -0.68 3.03 0.17 5.45 0.00 0.94 -2.55 121.76 128.11 2d9y s ALA 91 Ca 0.11 -0.85 -0.14 0.00 0.00 0.00 0.00 51.96 51.08 2d9y s ALA 91 Cb -0.12 -1.39 0.07 0.00 0.00 0.00 0.00 23.12 21.68 2d9y s ALA 91 CO 0.02 0.43 1.84 0.93 0.00 0.00 0.00 175.76 178.98 2d9y h GLU 92 N 5.82 0.69 -6.30 0.00 5.08 -1.85 -3.43 114.58 114.59 2d9y h GLU 92 Ca -0.42 -0.04 -0.63 0.00 -1.00 0.00 0.00 59.36 57.27 2d9y h GLU 92 Cb 1.18 -0.16 -0.11 0.00 0.50 0.00 0.00 28.75 30.17 2d9y h GLU 92 CO 0.57 0.46 -0.64 -1.54 -1.00 0.00 0.00 179.01 176.85 2d9y s SER 93 N -5.67 5.12 0.53 1.42 1.04 -1.26 -5.01 113.70 109.87 2d9y s SER 93 Ca -0.13 -0.19 0.31 0.00 0.48 0.00 0.00 55.95 56.42 2d9y s SER 93 Cb 0.12 -1.24 1.30 0.00 0.10 0.00 0.00 66.02 66.31 2d9y s SER 93 CO 0.74 0.14 1.97 1.55 0.98 0.00 0.00 173.24 178.62 2d9y h PRO 94 N 3.11 0.00 -0.08 4.02 0.13 -1.93 -2.91 132.00 134.34 2d9y h PRO 94 Ca -0.47 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.46 2d9y h PRO 94 Cb 1.18 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.30 2d9y h PRO 94 CO 0.61 0.07 -0.75 1.05 -0.23 0.00 0.00 178.00 178.74 2d9y h GLU 95 N 0.00 0.46 -0.02 0.86 4.11 -1.97 -3.27 114.58 114.75 2d9y h GLU 95 Ca -0.00 -0.38 -0.02 0.00 0.07 0.00 0.00 59.36 59.03 2d9y h GLU 95 Cb 0.54 0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.87 2d9y h GLU 95 CO 0.01 1.02 -0.05 0.93 0.07 0.00 0.00 179.01 180.99 2d9y h GLU 96 N 0.31 0.07 -0.83 1.06 5.08 -1.92 -2.86 114.58 115.48 2d9y h GLU 96 Ca -0.04 -0.05 0.08 0.00 -1.00 0.00 0.00 59.36 58.36 2d9y h GLU 96 Cb 1.33 0.01 -0.10 0.00 0.50 0.00 0.00 28.75 30.49 2d9y h GLU 96 CO 0.13 0.63 -0.53 0.37 -1.00 0.00 0.00 179.01 178.61 2d9y h GLN 97 N -0.49 -0.05 0.01 2.33 4.15 -1.60 0.78 115.11 120.24 2d9y h GLN 97 Ca 0.00 0.00 0.02 0.00 0.77 0.00 0.00 58.65 59.44 2d9y h GLN 97 Cb 0.63 0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.31 2d9y h GLN 97 CO 0.01 -0.03 -0.12 0.93 -1.93 0.00 0.00 178.83 177.69 2d9y h GLU 98 N -0.05 -0.20 -0.74 1.69 5.08 -1.66 -1.66 114.58 117.04 2d9y h GLU 98 Ca 0.13 0.01 0.14 0.00 -1.00 0.00 0.00 59.36 58.65 2d9y h GLU 98 Cb 0.40 0.04 -0.14 0.00 0.50 0.00 0.00 28.75 29.55 2d9y h GLU 98 CO -0.81 -0.13 -0.25 0.00 -1.00 0.00 0.00 179.01 176.82 2d9y h ALA 99 N 0.75 0.33 0.90 3.43 0.00 -0.85 -1.89 119.26 121.94 2d9y h ALA 99 Ca 0.04 0.26 -0.04 0.00 0.00 0.00 0.00 54.91 55.17 2d9y h ALA 99 Cb 0.25 0.67 0.01 0.00 0.00 0.00 0.00 17.79 18.72 2d9y h ALA 99 CO -0.11 -0.50 -0.43 -1.49 0.00 0.00 0.00 179.25 176.72 2d9y h TRP 100 N -0.04 -1.12 -0.98 0.00 4.06 -0.60 0.24 115.95 117.50 2d9y h TRP 100 Ca 0.33 -0.03 0.37 0.00 2.06 0.00 0.00 58.89 61.63 2d9y h TRP 100 Cb 0.56 0.37 -0.14 0.00 -1.00 0.00 0.00 29.16 28.96 2d9y h TRP 100 CO -0.64 -0.70 0.58 -0.89 -3.56 0.00 0.00 178.44 173.23 2d9y n ILE 101 N -5.58 -0.29 -0.05 1.49 5.41 -0.65 0.43 119.36 120.11 2d9y n ILE 101 Ca -0.15 1.62 -0.20 0.00 1.00 0.00 0.00 62.75 65.02 2d9y n ILE 101 Cb 0.48 -2.65 -0.13 0.00 -0.71 0.00 0.00 39.64 36.63 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 0.10 0.54 0.38 4.20 -1.12 -1.60 115.11 117.61 2d9y h GLN 102 Ca 0.73 -0.17 -0.02 0.00 0.06 0.00 0.00 58.65 59.24 2d9y h GLN 102 Cb 2.11 0.07 -0.02 0.00 0.30 0.00 0.00 27.48 29.93 2d9y h GLN 102 CO -0.54 1.08 -0.50 0.00 -0.67 0.00 0.00 178.83 178.21 2d9y h ALA 103 N -0.18 -1.17 -0.05 3.87 0.00 0.35 0.22 119.26 122.30 2d9y h ALA 103 Ca -0.23 -0.20 -0.18 0.00 0.00 0.00 0.00 54.91 54.30 2d9y h ALA 103 Cb 1.41 0.71 -0.01 0.00 0.00 0.00 0.00 17.79 19.90 2d9y h ALA 103 CO -0.04 -1.19 -0.73 0.00 0.00 0.00 0.00 179.25 177.29 2d9y h MET 104 N -1.02 0.30 0.30 0.00 -0.00 -0.52 -3.28 114.93 110.70 2d9y h MET 104 Ca -0.07 -0.25 -0.01 0.00 -0.00 0.00 0.00 59.70 59.37 2d9y h MET 104 Cb 0.88 0.05 0.00 0.00 -0.00 0.00 0.00 31.60 32.53 2d9y h MET 104 CO -0.04 0.90 -0.14 0.78 -0.00 0.00 0.00 176.91 178.41 2d9y h GLY 105 N 1.48 -0.41 -0.13 -3.00 0.00 -1.13 -2.94 103.07 96.94 2d9y h GLY 105 Ca -0.03 0.15 0.16 0.00 0.00 0.00 0.00 47.33 47.61 2d9y h GLY 105 CO 0.12 -0.15 0.11 1.05 0.00 0.00 0.00 176.54 177.67 2d9y h GLU 106 N -0.43 0.20 -0.79 4.80 4.11 -0.64 0.36 114.58 122.18 2d9y h GLU 106 Ca -0.04 -0.01 0.18 0.00 0.07 0.00 0.00 59.36 59.56 2d9y h GLU 106 Cb 0.33 -0.04 -0.05 0.00 0.50 0.00 0.00 28.75 29.48 2d9y h GLU 106 CO 0.07 0.13 0.54 0.00 0.07 0.00 0.00 179.01 179.81 2d9y h ALA 107 N 1.62 2.27 -0.16 1.06 0.00 -1.57 0.25 119.26 122.73 2d9y h ALA 107 Ca 0.40 0.00 -0.19 0.00 0.00 0.00 0.00 54.91 55.12 2d9y h ALA 107 Cb 0.69 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.45 2d9y h ALA 107 CO -0.55 -0.50 -0.67 0.00 0.00 0.00 0.00 179.25 177.53 2d9y h ALA 108 N 1.63 0.51 -2.11 0.00 0.00 -0.09 -3.42 119.26 115.78 2d9y h ALA 108 Ca 0.40 -0.57 -0.52 0.00 0.00 0.00 0.00 54.91 54.22 2d9y h ALA 108 Cb 1.07 -0.05 0.22 0.00 0.00 0.00 0.00 17.79 19.02 2d9y h ALA 108 CO -0.11 0.71 -0.54 0.54 0.00 0.00 0.00 179.25 179.85 2d9y n ARG 109 N -3.92 -0.56 -4.57 0.00 1.74 0.08 -3.92 116.66 105.51 2d9y n ARG 109 Ca -0.05 -0.12 -0.24 0.00 -0.77 0.00 0.00 57.85 56.67 2d9y n ARG 109 Cb 0.68 -1.90 -0.16 0.00 -1.02 0.00 0.00 32.46 30.06 2d9y n ARG 109 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2d9y s VAL 110 N -2.40 1.09 0.12 1.55 1.01 -1.26 -4.93 120.40 115.58 2d9y s VAL 110 Ca 0.58 -0.47 -0.21 0.00 0.00 0.00 0.00 61.98 61.88 2d9y s VAL 110 Cb -0.20 -0.99 -0.13 0.00 0.00 0.00 0.00 36.38 35.06 2d9y s VAL 110 CO 0.66 0.34 0.43 0.00 0.00 0.00 0.00 175.10 176.54 2d9y n GLN 111 N 3.70 0.00 -4.09 2.72 0.00 -1.26 -0.19 117.38 118.26 2d9y n GLN 111 Ca -0.22 0.00 -0.30 0.00 0.00 0.00 0.00 57.00 56.48 2d9y n GLN 111 Cb 0.52 -0.77 -0.07 0.00 0.00 0.00 0.00 30.24 29.92 2d9y n GLN 111 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.06 177.49 2d9y n SER 112 N 1.39 0.06 -4.61 2.61 7.64 -1.26 -4.81 113.62 114.64 2d9y n SER 112 Ca 0.13 -1.13 -0.37 0.00 1.01 0.00 0.00 58.87 58.52 2d9y n SER 112 Cb 0.16 -1.39 0.07 0.00 -1.01 0.00 0.00 64.21 62.04 2d9y n SER 112 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2d9y n GLY 113 N -2.32 -0.39 0.00 0.23 0.00 0.73 -4.84 105.19 98.61 2d9y n GLY 113 Ca -0.25 -0.22 0.06 0.00 0.00 0.00 0.00 46.02 45.60 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 -1.34 0.49 -0.25 1.61 -0.04 -1.26 -4.06 135.00 130.15 2d9y n PRO 114 Ca 0.14 0.00 0.09 0.00 -0.04 0.00 0.00 63.50 63.69 2d9y n PRO 114 Cb 0.48 -1.36 0.18 0.00 -0.04 0.00 0.00 33.50 32.77 2d9y n PRO 114 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2d9y n SER 115 N -0.86 -0.14 -4.38 3.54 7.64 -1.26 -3.01 113.62 115.15 2d9y n SER 115 Ca 0.08 1.24 -0.45 0.00 1.01 0.00 0.00 58.87 60.76 2d9y n SER 115 Cb 0.04 -0.43 -0.04 0.00 -1.01 0.00 0.00 64.21 62.77 2d9y n SER 115 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2d9y s SER 116 N -5.06 6.29 0.00 6.43 0.01 -1.26 -5.31 113.70 114.80 2d9y s SER 116 Ca -0.10 -1.60 0.12 0.00 1.31 0.00 0.00 55.95 55.68 2d9y s SER 116 Cb 0.21 -2.31 0.71 0.00 0.21 0.00 0.00 66.02 64.84 2d9y s SER 116 CO 0.57 -1.08 1.15 0.61 0.41 0.00 0.00 173.24 174.90