#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d9y n SER 2 N 0.00 -2.23 -0.10 1.61 2.88 -1.26 -4.98 113.62 109.55 2d9y n SER 2 Ca 0.00 -0.08 -0.24 0.00 -1.33 0.00 0.00 58.87 57.22 2d9y n SER 2 Cb 0.00 -1.03 -0.12 0.00 -0.75 0.00 0.00 64.21 62.31 2d9y n SER 2 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2d9y n SER 3 N -2.17 1.96 -1.71 -3.46 7.64 -1.26 -5.10 113.62 109.53 2d9y n SER 3 Ca 0.02 0.28 -0.01 0.00 1.01 0.00 0.00 58.87 60.16 2d9y n SER 3 Cb 0.60 -0.83 -0.01 0.00 -1.01 0.00 0.00 64.21 62.97 2d9y n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2d9y n GLY 4 N 1.61 -3.91 3.46 0.23 0.00 -1.26 -4.96 105.19 100.37 2d9y n GLY 4 Ca -0.41 0.06 -0.35 0.00 0.00 0.00 0.00 46.02 45.32 2d9y n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2d9y n SER 5 N 0.67 -1.37 -3.49 1.61 3.41 -1.26 -5.03 113.62 108.16 2d9y n SER 5 Ca -0.08 0.51 -0.14 0.00 -0.26 0.00 0.00 58.87 58.90 2d9y n SER 5 Cb 0.13 -1.23 -0.04 0.00 -0.26 0.00 0.00 64.21 62.81 2d9y n SER 5 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2d9y s SER 6 N -1.66 -0.54 1.39 4.04 1.04 -1.26 -5.08 113.70 111.63 2d9y s SER 6 Ca 0.63 0.19 0.00 0.00 0.48 0.00 0.00 55.95 57.25 2d9y s SER 6 Cb -0.30 0.55 0.00 0.00 0.10 0.00 0.00 66.02 66.37 2d9y s SER 6 CO 0.61 -0.82 0.00 0.61 0.98 0.00 0.00 173.24 174.62 2d9y n GLY 7 N 0.12 1.42 3.44 7.32 0.00 -1.26 -4.61 105.19 111.61 2d9y n GLY 7 Ca -0.18 0.13 -0.08 0.00 0.00 0.00 0.00 46.02 45.89 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 -4.00 -0.70 0.20 1.61 3.84 -1.26 -5.17 114.94 109.47 2d9y s ASN 8 Ca 0.00 1.19 0.01 0.00 0.21 0.00 0.00 52.86 54.27 2d9y s ASN 8 Cb 0.00 1.19 -0.04 0.00 -0.55 0.00 0.00 41.25 41.85 2d9y s ASN 8 CO 0.00 -0.22 0.37 0.00 -2.79 0.00 0.00 177.10 174.47 2d9y s ALA 9 N 1.75 3.86 1.07 1.71 0.00 -1.26 -5.10 121.76 123.79 2d9y s ALA 9 Ca -0.09 -0.92 -0.15 0.00 0.00 0.00 0.00 51.96 50.81 2d9y s ALA 9 Cb -0.08 -1.93 0.23 0.00 0.00 0.00 0.00 23.12 21.34 2d9y s ALA 9 CO -0.16 0.41 1.10 -1.25 0.00 0.00 0.00 175.76 175.86 2d9y s PRO 10 N -3.43 -0.18 0.28 0.00 0.04 -1.26 -4.99 135.00 125.47 2d9y s PRO 10 Ca 0.37 0.31 -0.27 0.00 0.04 0.00 0.00 61.00 61.45 2d9y s PRO 10 Cb -0.11 -1.68 -0.09 0.00 0.04 0.00 0.00 34.50 32.65 2d9y s PRO 10 CO 0.29 -3.09 0.93 0.54 0.04 0.00 0.00 177.00 175.71 2d9y s VAL 11 N -2.98 4.17 -0.21 -0.36 0.11 -1.26 -4.65 120.40 115.22 2d9y s VAL 11 Ca 0.67 1.91 -0.16 0.00 -2.93 0.00 0.00 61.98 61.47 2d9y s VAL 11 Cb -0.16 -4.13 -0.18 0.00 -1.53 0.00 0.00 36.38 30.38 2d9y s VAL 11 CO 0.57 0.29 0.07 0.41 -3.33 0.00 0.00 175.10 173.12 2d9y n THR 12 N 0.94 1.57 -3.60 5.04 -1.04 -1.19 -5.04 114.28 110.96 2d9y n THR 12 Ca 0.00 -0.25 -0.12 0.00 -2.04 0.00 0.00 64.05 61.65 2d9y n THR 12 Cb 0.49 -1.92 -0.05 0.00 -1.82 0.00 0.00 70.33 67.04 2d9y n THR 12 CO 0.00 0.00 0.00 -0.75 -0.64 0.00 0.00 175.07 173.68 2d9y s LYS 13 N -2.44 1.06 -0.28 -2.82 2.20 -1.23 -5.01 119.74 111.22 2d9y s LYS 13 Ca -0.31 -0.55 -0.18 0.00 -0.36 0.00 0.00 55.97 54.57 2d9y s LYS 13 Cb 0.08 0.47 0.10 0.00 -1.51 0.00 0.00 37.83 36.97 2d9y s LYS 13 CO 0.60 -0.41 0.79 0.00 -0.36 0.00 0.00 175.35 175.96 2d9y s ALA 14 N -3.37 -1.95 -0.05 3.13 0.00 -1.26 -0.08 121.76 118.17 2d9y s ALA 14 Ca 0.00 2.26 -0.31 0.00 0.00 0.00 0.00 51.96 53.91 2d9y s ALA 14 Cb 0.01 -1.44 0.11 0.00 0.00 0.00 0.00 23.12 21.80 2d9y s ALA 14 CO -0.09 -0.35 1.08 0.20 0.00 0.00 0.00 175.76 176.59 2d9y s GLY 15 N 1.22 -0.36 -0.44 0.00 0.00 -0.21 -5.01 107.32 102.52 2d9y s GLY 15 Ca -0.07 1.05 -0.29 0.00 0.00 0.00 0.00 44.72 45.41 2d9y s GLY 15 CO -0.14 0.32 1.39 -0.98 0.00 0.00 0.00 173.10 173.69 2d9y s TRP 16 N -2.78 2.42 -0.03 1.90 0.52 -1.26 -1.95 118.94 117.77 2d9y s TRP 16 Ca 0.09 0.66 0.07 0.00 0.02 0.00 0.00 56.10 56.94 2d9y s TRP 16 Cb -0.00 -4.34 -0.02 0.00 -1.15 0.00 0.00 33.47 27.96 2d9y s TRP 16 CO -0.05 -1.91 -0.24 -0.51 0.02 0.00 0.00 176.95 174.26 2d9y s LEU 17 N 5.42 2.19 -0.25 2.99 1.43 -0.81 -4.40 118.68 125.25 2d9y s LEU 17 Ca 0.59 -0.42 -0.20 0.00 -1.03 0.00 0.00 54.13 53.07 2d9y s LEU 17 Cb -0.13 -1.38 -0.02 0.00 0.03 0.00 0.00 46.19 44.69 2d9y s LEU 17 CO 0.32 0.32 0.62 -0.36 0.23 0.00 0.00 176.35 177.48 2d9y s PHE 18 N -0.64 3.29 -0.18 0.29 0.40 -1.16 -2.07 117.98 117.91 2d9y s PHE 18 Ca 0.10 0.81 -0.11 0.00 -0.60 0.00 0.00 56.93 57.13 2d9y s PHE 18 Cb -0.10 -2.82 -0.05 0.00 0.51 0.00 0.00 43.02 40.56 2d9y s PHE 18 CO -0.01 -0.31 0.20 0.21 0.70 0.00 0.00 175.22 176.01 2d9y s LYS 19 N 2.42 4.20 0.26 0.44 2.20 -0.72 -2.02 119.74 126.53 2d9y s LYS 19 Ca 0.26 -0.09 -0.30 0.00 -0.36 0.00 0.00 55.97 55.48 2d9y s LYS 19 Cb -0.16 -3.42 -0.09 0.00 -1.51 0.00 0.00 37.83 32.65 2d9y s LYS 19 CO 0.09 0.28 1.25 -1.14 -0.36 0.00 0.00 175.35 175.47 2d9y s GLN 20 N 0.38 4.44 1.07 4.03 0.74 -1.16 -1.85 119.66 127.31 2d9y s GLN 20 Ca 0.11 2.04 -0.14 0.00 0.05 0.00 0.00 55.36 57.42 2d9y s GLN 20 Cb -0.12 -3.16 0.22 0.00 1.10 0.00 0.00 33.01 31.06 2d9y s GLN 20 CO 0.00 -0.12 1.09 0.00 -0.55 0.00 0.00 175.29 175.72 2d9y s ALA 21 N -0.58 0.68 0.88 1.58 0.00 -0.36 -4.89 121.76 119.07 2d9y s ALA 21 Ca 0.51 -0.49 -0.11 0.00 0.00 0.00 0.00 51.96 51.88 2d9y s ALA 21 Cb -0.36 -3.07 0.17 0.00 0.00 0.00 0.00 23.12 19.86 2d9y s ALA 21 CO 0.43 -3.14 1.21 -1.12 0.00 0.00 0.00 175.76 173.14 2d9y s SER 22 N -3.46 3.57 0.85 0.00 0.01 -1.26 -4.87 113.70 108.54 2d9y s SER 22 Ca 0.67 0.07 -0.16 0.00 1.31 0.00 0.00 55.95 57.83 2d9y s SER 22 Cb -0.17 -0.24 -0.14 0.00 0.21 0.00 0.00 66.02 65.68 2d9y s SER 22 CO 0.58 -2.42 -0.62 -0.24 0.41 0.00 0.00 173.24 170.95 2d9y n SER 23 N -3.44 -5.26 0.00 2.44 2.88 -1.26 -4.03 113.62 104.94 2d9y n SER 23 Ca 0.15 0.28 0.00 0.00 -1.33 0.00 0.00 58.87 57.97 2d9y n SER 23 Cb 0.60 -0.75 0.00 0.00 -0.75 0.00 0.00 64.21 63.31 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 3.12 0.95 3.65 0.46 0.00 -1.26 -4.94 105.19 107.17 2d9y n GLY 24 Ca 0.00 -0.75 -0.37 0.00 0.00 0.00 0.00 46.02 44.90 2d9y n GLY 24 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2d9y s VAL 25 N 0.00 5.29 -0.94 1.61 -7.23 -1.26 -5.03 120.40 112.85 2d9y s VAL 25 Ca 0.00 0.35 -0.21 0.00 -1.81 0.00 0.00 61.98 60.31 2d9y s VAL 25 Cb 0.00 -3.58 0.09 0.00 0.56 0.00 0.00 36.38 33.45 2d9y s VAL 25 CO 0.00 0.29 1.25 -0.54 -0.31 0.00 0.00 175.10 175.79 2d9y s LYS 26 N 1.33 3.54 0.05 4.82 3.01 -1.26 -4.63 119.74 126.59 2d9y s LYS 26 Ca 0.11 -1.37 -0.00 0.00 -1.01 0.00 0.00 55.97 53.69 2d9y s LYS 26 Cb -0.14 -5.01 -0.03 0.00 -1.01 0.00 0.00 37.83 31.63 2d9y s LYS 26 CO 0.07 -1.97 -0.03 1.14 0.51 0.00 0.00 175.35 175.07 2d9y s GLN 27 N 3.84 0.55 -0.19 1.68 -2.07 -1.26 -5.03 119.66 117.18 2d9y s GLN 27 Ca 0.37 -1.07 -0.03 0.00 -1.82 0.00 0.00 55.36 52.81 2d9y s GLN 27 Cb -0.04 0.14 -0.02 0.00 -1.09 0.00 0.00 33.01 32.00 2d9y s GLN 27 CO -0.07 -0.08 -0.05 -1.58 -1.32 0.00 0.00 175.29 172.19 2d9y s TRP 28 N -3.23 2.97 -0.22 9.60 0.52 -1.26 -1.22 118.94 126.09 2d9y s TRP 28 Ca 0.01 -0.64 -0.06 0.00 0.02 0.00 0.00 56.10 55.43 2d9y s TRP 28 Cb 0.03 -2.03 -0.03 0.00 -1.15 0.00 0.00 33.47 30.29 2d9y s TRP 28 CO -0.07 -0.32 0.04 -0.80 0.02 0.00 0.00 176.95 175.82 2d9y s ASN 29 N 0.96 5.04 0.09 2.95 0.01 -0.77 -4.91 114.94 118.31 2d9y s ASN 29 Ca -0.00 -0.19 -0.31 0.00 -0.71 0.00 0.00 52.86 51.65 2d9y s ASN 29 Cb -0.15 -1.89 -0.07 0.00 0.41 0.00 0.00 41.25 39.56 2d9y s ASN 29 CO 0.01 0.02 1.36 -0.75 -1.51 0.00 0.00 177.10 176.23 2d9y s LYS 30 N 1.28 4.33 0.02 -0.60 2.20 -1.26 -1.75 119.74 123.96 2d9y s LYS 30 Ca 0.04 2.01 -0.09 0.00 -0.36 0.00 0.00 55.97 57.58 2d9y s LYS 30 Cb -0.15 -3.32 0.00 0.00 -1.51 0.00 0.00 37.83 32.86 2d9y s LYS 30 CO 0.02 -0.43 0.18 0.50 -0.36 0.00 0.00 175.35 175.26 2d9y s ARG 31 N 1.30 0.59 -0.34 4.03 6.06 -0.88 -4.96 118.95 124.75 2d9y s ARG 31 Ca 0.64 -0.49 -0.29 0.00 -2.50 0.00 0.00 55.73 53.08 2d9y s ARG 31 Cb -0.35 0.25 0.02 0.00 0.06 0.00 0.00 34.95 34.92 2d9y s ARG 31 CO 0.30 -0.16 1.14 -0.46 -2.50 0.00 0.00 175.30 173.62 2d9y s TRP 32 N -1.93 2.99 -0.11 5.12 -0.00 -0.98 -1.93 118.94 122.10 2d9y s TRP 32 Ca -0.10 1.05 -0.03 0.00 -0.00 0.00 0.00 56.10 57.02 2d9y s TRP 32 Cb -0.04 -3.85 -0.03 0.00 -0.00 0.00 0.00 33.47 29.54 2d9y s TRP 32 CO -0.01 -1.07 -0.00 -0.06 -0.00 0.00 0.00 176.95 175.81 2d9y s PHE 33 N 3.94 3.14 -0.16 5.86 0.40 -0.82 -0.73 117.98 129.60 2d9y s PHE 33 Ca 0.48 0.08 -0.03 0.00 -0.60 0.00 0.00 56.93 56.86 2d9y s PHE 33 Cb -0.13 -1.85 0.05 0.00 0.51 0.00 0.00 43.02 41.60 2d9y s PHE 33 CO 0.20 0.33 0.03 0.08 0.70 0.00 0.00 175.22 176.55 2d9y s VAL 34 N -0.48 0.44 0.47 -0.44 1.01 0.10 -1.05 120.40 120.46 2d9y s VAL 34 Ca 0.08 -0.37 -0.21 0.00 0.00 0.00 0.00 61.98 61.48 2d9y s VAL 34 Cb -0.12 -0.88 -0.08 0.00 0.00 0.00 0.00 36.38 35.29 2d9y s VAL 34 CO 0.02 -0.11 1.07 -0.22 0.00 0.00 0.00 175.10 175.86 2d9y s LEU 35 N 1.91 3.91 0.34 3.92 2.96 0.88 -1.55 118.68 131.05 2d9y s LEU 35 Ca 0.01 2.03 0.03 0.00 -0.22 0.00 0.00 54.13 55.97 2d9y s LEU 35 Cb -0.16 -4.45 -0.04 0.00 0.50 0.00 0.00 46.19 42.04 2d9y s LEU 35 CO -0.07 -0.79 0.12 0.54 -1.32 0.00 0.00 176.35 174.82 2d9y s VAL 36 N -1.84 0.67 0.00 1.68 0.11 0.20 -3.17 120.40 118.05 2d9y s VAL 36 Ca 0.66 -2.00 0.00 0.00 -2.93 0.00 0.00 61.98 57.71 2d9y s VAL 36 Cb -0.20 -2.54 0.00 0.00 -1.53 0.00 0.00 36.38 32.11 2d9y s VAL 36 CO 0.24 0.00 0.34 -0.67 -3.33 0.00 0.00 175.10 171.68 2d9y n ASP 37 N -0.94 0.00 -2.71 3.54 2.03 -1.26 -2.86 116.55 114.35 2d9y n ASP 37 Ca -0.02 0.34 -0.17 0.00 0.52 0.00 0.00 54.79 55.46 2d9y n ASP 37 Cb 0.65 -0.14 0.01 0.00 -0.72 0.00 0.00 41.12 40.92 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 -1.88 1.96 -3.64 -0.67 1.74 -1.26 -4.75 116.66 108.16 2d9y n ARG 38 Ca 0.00 -3.77 0.02 0.00 -0.77 0.00 0.00 57.85 53.32 2d9y n ARG 38 Cb 0.00 -1.68 -0.00 0.00 -1.02 0.00 0.00 32.46 29.75 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 -3.04 1.30 0.10 0.00 2.96 -0.95 0.58 118.68 119.64 2d9y s LEU 40 Ca 0.15 -0.10 0.10 0.00 -0.22 0.00 0.00 54.13 54.06 2d9y s LEU 40 Cb 0.05 -0.39 -0.04 0.00 0.50 0.00 0.00 46.19 46.31 2d9y s LEU 40 CO -0.04 -0.06 -0.25 -0.36 -1.32 0.00 0.00 176.35 174.32 2d9y s PHE 41 N 0.93 2.17 0.06 5.38 0.40 -0.59 -0.26 117.98 126.07 2d9y s PHE 41 Ca -0.11 -0.39 0.06 0.00 -0.60 0.00 0.00 56.93 55.88 2d9y s PHE 41 Cb -0.14 -1.21 -0.03 0.00 0.51 0.00 0.00 43.02 42.16 2d9y s PHE 41 CO -0.00 0.26 -0.15 1.52 0.70 0.00 0.00 175.22 177.54 2d9y s TYR 42 N -1.02 1.33 0.12 0.36 -0.85 -1.22 0.02 117.35 116.10 2d9y s TYR 42 Ca 0.12 -0.41 0.04 0.00 -0.52 0.00 0.00 57.07 56.29 2d9y s TYR 42 Cb -0.10 -0.76 -0.04 0.00 0.38 0.00 0.00 41.96 41.44 2d9y s TYR 42 CO 0.05 0.07 -0.09 0.71 -1.52 0.00 0.00 175.55 174.77 2d9y s TYR 43 N -1.08 1.12 0.27 -3.49 1.51 0.09 -3.30 117.35 112.47 2d9y s TYR 43 Ca 0.01 -0.77 -0.03 0.00 -1.01 0.00 0.00 57.07 55.27 2d9y s TYR 43 Cb -0.09 -0.60 0.57 0.00 -0.11 0.00 0.00 41.96 41.74 2d9y s TYR 43 CO 0.02 0.01 1.63 0.87 -1.11 0.00 0.00 175.55 176.97 2d9y h LYS 44 N 3.01 0.12 -3.69 -0.62 1.79 -1.87 -2.60 116.57 112.70 2d9y h LYS 44 Ca -0.36 -0.01 -0.08 0.00 -2.18 0.00 0.00 60.65 58.02 2d9y h LYS 44 Cb 1.18 -0.03 -0.09 0.00 -1.58 0.00 0.00 32.23 31.72 2d9y h LYS 44 CO 0.61 0.08 -0.12 0.16 -1.08 0.00 0.00 179.45 179.10 2d9y s ASP 45 N -5.13 0.01 0.42 0.86 -4.77 -1.26 -4.33 116.67 102.48 2d9y s ASP 45 Ca -0.13 -1.00 0.25 0.00 -3.30 0.00 0.00 52.55 48.37 2d9y s ASP 45 Cb 0.25 0.60 1.29 0.00 -1.09 0.00 0.00 42.92 43.96 2d9y s ASP 45 CO 0.76 -1.17 1.69 1.05 0.70 0.00 0.00 175.17 178.21 2d9y h GLU 46 N 2.24 0.21 -1.29 2.11 4.11 -1.93 0.23 114.58 120.25 2d9y h GLU 46 Ca -0.27 -0.01 0.42 0.00 0.07 0.00 0.00 59.36 59.57 2d9y h GLU 46 Cb 1.25 -0.05 -0.13 0.00 0.50 0.00 0.00 28.75 30.32 2d9y h GLU 46 CO 0.36 0.14 0.83 0.87 0.07 0.00 0.00 179.01 181.28 2d9y h LYS 47 N 0.22 0.10 -5.72 1.06 1.57 -1.96 -3.44 116.57 108.40 2d9y h LYS 47 Ca 0.71 -0.01 -0.42 0.00 -1.87 0.00 0.00 60.65 59.07 2d9y h LYS 47 Cb 2.09 -0.02 0.09 0.00 0.08 0.00 0.00 32.23 34.46 2d9y h LYS 47 CO -0.35 0.07 -0.68 0.39 -0.57 0.00 0.00 179.45 178.31 2d9y n GLU 48 N -4.70 -6.92 -0.15 3.15 1.02 0.79 -4.88 120.64 108.95 2d9y n GLU 48 Ca 0.36 0.79 -0.02 0.00 -0.02 0.00 0.00 57.16 58.26 2d9y n GLU 48 Cb 1.38 -5.78 0.06 0.00 -0.02 0.00 0.00 31.44 27.09 2d9y n GLU 48 CO 0.00 0.00 0.00 1.05 1.18 0.00 0.00 177.13 179.36 2d9y h GLU 49 N -2.34 0.21 -3.50 3.49 4.11 -1.86 -3.45 114.58 111.24 2d9y h GLU 49 Ca -0.56 -0.01 -0.06 0.00 0.07 0.00 0.00 59.36 58.80 2d9y h GLU 49 Cb 1.37 -0.05 -0.13 0.00 0.50 0.00 0.00 28.75 30.44 2d9y h GLU 49 CO 0.58 0.14 -0.13 -1.12 0.07 0.00 0.00 179.01 178.55 2d9y s SER 50 N -5.30 -0.15 -0.15 3.06 0.01 -1.26 -5.15 113.70 104.75 2d9y s SER 50 Ca -0.13 -0.44 -0.16 0.00 1.31 0.00 0.00 55.95 56.53 2d9y s SER 50 Cb 0.15 0.46 -0.04 0.00 0.21 0.00 0.00 66.02 66.80 2d9y s SER 50 CO 0.72 -0.86 0.40 -0.63 0.41 0.00 0.00 173.24 173.28 2d9y s ILE 51 N -3.83 5.23 -0.18 1.44 1.01 -1.26 -4.47 121.20 119.14 2d9y s ILE 51 Ca 0.05 0.75 -0.20 0.00 0.00 0.00 0.00 60.65 61.26 2d9y s ILE 51 Cb 0.02 -3.73 -0.21 0.00 0.01 0.00 0.00 42.46 38.55 2d9y s ILE 51 CO -0.10 0.33 0.30 -0.07 0.00 0.00 0.00 174.94 175.40 2d9y h LEU 52 N 6.95 0.09 -7.00 2.97 3.38 -1.96 -3.50 115.31 116.24 2d9y h LEU 52 Ca -0.40 -0.63 -0.05 0.00 0.09 0.00 0.00 57.88 56.90 2d9y h LEU 52 Cb 1.17 -0.03 -0.18 0.00 0.09 0.00 0.00 40.66 41.71 2d9y h LEU 52 CO 0.75 1.52 0.21 -0.83 0.09 0.00 0.00 178.44 180.17 2d9y s GLY 53 N -4.91 -0.57 0.08 0.83 0.00 -1.26 -5.11 107.32 96.38 2d9y s GLY 53 Ca -0.27 1.26 0.05 0.00 0.00 0.00 0.00 44.72 45.76 2d9y s GLY 53 CO 0.64 0.87 -0.04 -0.45 0.00 0.00 0.00 173.10 174.12 2d9y s SER 54 N -1.37 4.79 -0.21 1.64 0.15 -1.26 -3.40 113.70 114.03 2d9y s SER 54 Ca -0.09 -0.23 0.00 0.00 0.70 0.00 0.00 55.95 56.33 2d9y s SER 54 Cb -0.00 -1.08 0.02 0.00 -1.71 0.00 0.00 66.02 63.25 2d9y s SER 54 CO 0.07 0.20 -0.14 -0.63 1.20 0.00 0.00 173.24 173.93 2d9y s ILE 55 N -1.23 2.39 0.19 6.45 1.01 0.65 -5.01 121.20 125.65 2d9y s ILE 55 Ca 0.23 -1.00 -0.30 0.00 0.00 0.00 0.00 60.65 59.58 2d9y s ILE 55 Cb -0.11 -2.12 -0.09 0.00 0.01 0.00 0.00 42.46 40.15 2d9y s ILE 55 CO 0.15 0.38 1.31 -2.16 0.00 0.00 0.00 174.94 174.62 2d9y s PRO 56 N 1.29 4.39 -0.06 2.79 0.04 -1.26 -2.23 135.00 139.96 2d9y s PRO 56 Ca 0.02 2.05 0.06 0.00 0.04 0.00 0.00 61.00 63.16 2d9y s PRO 56 Cb -0.15 -3.20 -0.08 0.00 0.04 0.00 0.00 34.50 31.11 2d9y s PRO 56 CO -0.09 -0.25 0.03 1.28 0.04 0.00 0.00 177.00 178.00 2d9y n LEU 57 N 2.69 0.00 -3.78 -3.56 4.77 -1.26 -4.93 117.00 110.93 2d9y n LEU 57 Ca 0.06 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.62 2d9y n LEU 57 Cb 0.43 0.15 -0.12 0.00 -2.33 0.00 0.00 43.42 41.55 2d9y n LEU 57 CO 0.58 0.15 1.74 -0.11 -1.33 0.00 0.00 177.39 178.42 2d9y n LEU 58 N -2.21 0.41 -1.80 2.23 7.94 -1.26 0.20 117.00 122.51 2d9y n LEU 58 Ca -0.10 0.33 -0.04 0.00 -1.11 0.00 0.00 56.01 55.09 2d9y n LEU 58 Cb 0.68 -0.78 0.02 0.00 0.53 0.00 0.00 43.42 43.87 2d9y n LEU 58 CO 0.13 -0.64 0.02 -0.24 -1.11 0.00 0.00 177.39 175.56 2d9y n SER 59 N 7.97 -2.60 -4.30 1.96 2.88 -0.13 -5.04 113.62 114.36 2d9y n SER 59 Ca 0.53 -0.18 -0.28 0.00 -1.33 0.00 0.00 58.87 57.62 2d9y n SER 59 Cb 0.00 -1.74 -0.14 0.00 -0.75 0.00 0.00 64.21 61.58 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 -3.10 2.06 -0.68 0.66 0.40 0.13 -4.37 117.98 113.08 2d9y s PHE 60 Ca 0.06 -0.39 -0.18 0.00 -0.60 0.00 0.00 56.93 55.82 2d9y s PHE 60 Cb -0.01 -1.22 0.13 0.00 0.51 0.00 0.00 43.02 42.43 2d9y s PHE 60 CO 0.19 0.12 0.75 0.50 0.70 0.00 0.00 175.22 177.49 2d9y s ARG 61 N -1.27 3.23 -0.22 0.44 3.52 -0.57 -4.68 118.95 119.40 2d9y s ARG 61 Ca 0.10 -1.66 -0.11 0.00 -0.13 0.00 0.00 55.73 53.92 2d9y s ARG 61 Cb -0.09 -4.40 -0.05 0.00 -1.56 0.00 0.00 34.95 28.85 2d9y s ARG 61 CO 0.02 -1.50 0.20 0.08 -0.81 0.00 0.00 175.30 173.29 2d9y s VAL 62 N 2.05 5.35 -0.21 7.11 1.01 -1.26 -2.97 120.40 131.47 2d9y s VAL 62 Ca 0.15 0.29 -0.33 0.00 0.00 0.00 0.00 61.98 62.10 2d9y s VAL 62 Cb -0.19 -3.54 0.15 0.00 0.00 0.00 0.00 36.38 32.80 2d9y s VAL 62 CO 0.01 0.36 1.22 0.00 0.00 0.00 0.00 175.10 176.69 2d9y s ALA 63 N 0.85 -2.07 0.17 5.51 0.00 -1.02 -4.88 121.76 120.33 2d9y s ALA 63 Ca 0.10 1.69 -0.31 0.00 0.00 0.00 0.00 51.96 53.44 2d9y s ALA 63 Cb -0.13 -0.63 -0.17 0.00 0.00 0.00 0.00 23.12 22.19 2d9y s ALA 63 CO 0.03 -0.44 0.83 0.00 0.00 0.00 0.00 175.76 176.18 2d9y n ALA 64 N 0.22 -2.18 -0.55 0.00 0.00 -1.26 -1.45 120.51 115.28 2d9y n ALA 64 Ca -0.01 0.47 -0.10 0.00 0.00 0.00 0.00 53.44 53.79 2d9y n ALA 64 Cb 0.58 -1.79 0.17 0.00 0.00 0.00 0.00 19.45 18.42 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 0.61 0.00 -4.20 0.00 0.24 -0.67 -4.62 118.33 109.68 2d9y n VAL 65 Ca 0.16 0.00 -0.12 0.00 -2.04 0.00 0.00 64.34 62.34 2d9y n VAL 65 Cb 0.23 -0.58 -0.10 0.00 -1.47 0.00 0.00 33.84 31.92 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 -4.20 0.94 0.00 7.34 -0.21 -1.26 -4.97 119.66 117.30 2d9y s GLN 66 Ca 0.39 -1.40 0.14 0.00 0.02 0.00 0.00 55.36 54.51 2d9y s GLN 66 Cb -0.07 -0.30 0.87 0.00 1.00 0.00 0.00 33.01 34.50 2d9y s GLN 66 CO 0.33 -0.02 1.28 -0.35 -2.12 0.00 0.00 175.29 174.41 2d9y n PRO 67 N -0.12 0.49 0.00 2.91 -0.04 -1.26 -2.00 135.00 134.98 2d9y n PRO 67 Ca -0.10 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.46 2d9y n PRO 67 Cb 0.61 -1.46 -0.14 0.00 -0.04 0.00 0.00 33.50 32.47 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 -0.96 0.22 -0.81 3.54 7.64 -1.26 -4.13 113.62 117.85 2d9y n SER 68 Ca 0.11 -0.10 0.04 0.00 1.01 0.00 0.00 58.87 59.93 2d9y n SER 68 Cb 0.05 1.70 0.15 0.00 -1.01 0.00 0.00 64.21 65.10 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 -2.19 2.28 -3.74 6.43 8.00 -0.85 -4.88 116.55 121.59 2d9y n ASP 69 Ca -0.02 -2.18 -0.29 0.00 0.71 0.00 0.00 54.79 53.01 2d9y n ASP 69 Cb 0.53 -0.38 0.01 0.00 -0.02 0.00 0.00 41.12 41.27 2d9y n ASP 69 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 2d9y n ASN 70 N 0.34 -4.49 -4.39 -2.24 5.15 -1.26 -4.89 115.26 103.48 2d9y n ASN 70 Ca 0.11 -0.67 -0.45 0.00 -0.60 0.00 0.00 54.58 52.97 2d9y n ASN 70 Cb 0.44 -3.63 -0.01 0.00 -0.53 0.00 0.00 39.78 36.05 2d9y n ASN 70 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 2d9y s ILE 71 N -3.19 5.36 -0.15 -1.44 -1.09 -1.26 -4.88 121.20 114.56 2d9y s ILE 71 Ca 0.58 -2.53 -0.00 0.00 -2.23 0.00 0.00 60.65 56.47 2d9y s ILE 71 Cb -0.30 -4.68 0.10 0.00 -1.58 0.00 0.00 42.46 36.00 2d9y s ILE 71 CO 0.72 -1.32 2.00 -1.20 -1.23 0.00 0.00 174.94 173.91 2d9y n SER 72 N 4.67 5.84 -3.95 3.58 7.64 -1.26 -4.78 113.62 125.36 2d9y n SER 72 Ca 0.24 -2.71 -0.27 0.00 1.01 0.00 0.00 58.87 57.15 2d9y n SER 72 Cb 0.45 -1.09 -0.17 0.00 -1.01 0.00 0.00 64.21 62.39 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 -0.84 1.66 0.59 1.43 0.52 -1.26 -5.13 118.95 115.92 2d9y s ARG 73 Ca 0.14 -0.33 -0.18 0.00 -0.52 0.00 0.00 55.73 54.85 2d9y s ARG 73 Cb 0.11 -1.61 -0.04 0.00 0.52 0.00 0.00 34.95 33.93 2d9y s ARG 73 CO -0.00 -0.20 1.13 0.15 0.02 0.00 0.00 175.30 176.40 2d9y s LYS 74 N 1.45 3.13 -1.27 3.54 -0.14 -1.26 -3.58 119.74 121.60 2d9y s LYS 74 Ca 0.01 1.58 -0.04 0.00 -1.36 0.00 0.00 55.97 56.16 2d9y s LYS 74 Cb -0.13 -1.98 0.01 0.00 -1.68 0.00 0.00 37.83 34.05 2d9y s LYS 74 CO -0.06 -1.02 1.06 0.72 -0.76 0.00 0.00 175.35 175.28 2d9y n HIS 75 N -1.68 -2.45 -4.84 3.18 8.25 -1.26 -4.59 115.22 111.83 2d9y n HIS 75 Ca 0.12 0.96 -0.29 0.00 -0.26 0.00 0.00 57.72 58.25 2d9y n HIS 75 Cb 0.51 -5.01 -0.15 0.00 1.12 0.00 0.00 29.99 26.46 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 -3.36 1.96 0.13 1.59 2.01 -1.23 0.43 115.64 117.17 2d9y s THR 76 Ca 0.24 -1.30 0.04 0.00 0.31 0.00 0.00 61.69 60.98 2d9y s THR 76 Cb -0.11 -1.68 -0.04 0.00 0.01 0.00 0.00 72.50 70.68 2d9y s THR 76 CO 0.74 0.33 -0.09 0.72 -0.69 0.00 0.00 174.62 175.62 2d9y s PHE 77 N -0.78 1.17 0.08 4.92 -0.71 0.29 -1.68 117.98 121.28 2d9y s PHE 77 Ca 0.10 -0.79 0.08 0.00 -1.04 0.00 0.00 56.93 55.29 2d9y s PHE 77 Cb -0.10 -0.61 -0.04 0.00 -1.21 0.00 0.00 43.02 41.07 2d9y s PHE 77 CO 0.02 0.03 -0.20 -1.59 -1.34 0.00 0.00 175.22 172.13 2d9y s LYS 78 N -3.72 1.85 -0.25 1.99 -2.85 -0.53 -1.61 119.74 114.62 2d9y s LYS 78 Ca 0.15 -1.12 -0.02 0.00 -1.00 0.00 0.00 55.97 53.99 2d9y s LYS 78 Cb 0.03 -2.10 0.08 0.00 -2.06 0.00 0.00 37.83 33.78 2d9y s LYS 78 CO -0.01 0.50 0.06 0.00 0.10 0.00 0.00 175.35 176.01 2d9y s ALA 79 N -1.01 1.24 -0.05 0.59 0.00 0.39 -2.42 121.76 120.49 2d9y s ALA 79 Ca 0.15 -1.14 -0.02 0.00 0.00 0.00 0.00 51.96 50.95 2d9y s ALA 79 Cb -0.10 -1.38 0.03 0.00 0.00 0.00 0.00 23.12 21.67 2d9y s ALA 79 CO 0.07 -1.40 0.11 -1.83 0.00 0.00 0.00 175.76 172.71 2d9y s GLU 80 N 1.76 0.07 0.00 0.00 -1.05 -1.16 -0.34 118.70 117.98 2d9y s GLU 80 Ca 0.04 0.29 0.00 0.00 -0.15 0.00 0.00 54.97 55.14 2d9y s GLU 80 Cb -0.17 -0.14 0.00 0.00 -0.44 0.00 0.00 34.13 33.38 2d9y s GLU 80 CO -0.17 -0.13 0.22 1.58 0.95 0.00 0.00 175.26 177.71 2d9y n HIS 81 N 3.94 0.00 -3.15 4.83 -0.00 -1.26 -1.51 115.22 118.07 2d9y n HIS 81 Ca -0.24 0.00 0.05 0.00 -0.00 0.00 0.00 57.72 57.54 2d9y n HIS 81 Cb 0.53 -0.35 -0.01 0.00 -0.00 0.00 0.00 29.99 30.16 2d9y n HIS 81 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2d9y s ALA 82 N -3.14 -3.75 -1.49 1.57 0.00 -1.26 -4.60 121.76 109.10 2d9y s ALA 82 Ca 0.00 1.38 -0.03 0.00 0.00 0.00 0.00 51.96 53.31 2d9y s ALA 82 Cb 0.00 -2.67 0.01 0.00 0.00 0.00 0.00 23.12 20.47 2d9y s ALA 82 CO 0.00 -1.76 0.28 0.41 0.00 0.00 0.00 175.76 174.69 2d9y n GLY 83 N 5.31 -0.51 0.63 0.00 0.00 -1.26 -4.86 105.19 104.50 2d9y n GLY 83 Ca 0.00 0.06 0.00 0.00 0.00 0.00 0.00 46.02 46.08 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 -4.04 0.00 -3.62 1.61 0.31 -1.26 -5.13 118.33 106.19 2d9y n VAL 84 Ca -0.15 0.08 -0.11 0.00 -0.01 0.00 0.00 64.34 64.15 2d9y n VAL 84 Cb 0.63 -0.99 -0.07 0.00 -0.91 0.00 0.00 33.84 32.50 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 -0.78 0.63 -0.38 5.55 3.52 -1.26 -5.08 118.95 121.15 2d9y s ARG 85 Ca 0.00 0.64 -0.06 0.00 -0.13 0.00 0.00 55.73 56.19 2d9y s ARG 85 Cb 0.00 0.30 0.07 0.00 -1.56 0.00 0.00 34.95 33.77 2d9y s ARG 85 CO 0.00 -0.10 0.17 0.99 -0.81 0.00 0.00 175.30 175.55 2d9y s THR 86 N 0.07 3.70 -0.15 4.11 2.01 -1.26 -4.02 115.64 120.10 2d9y s THR 86 Ca 0.01 -1.49 -0.25 0.00 0.31 0.00 0.00 61.69 60.27 2d9y s THR 86 Cb -0.04 -3.26 -0.02 0.00 0.01 0.00 0.00 72.50 69.19 2d9y s THR 86 CO -0.03 -0.41 0.82 -0.31 -0.69 0.00 0.00 174.62 174.01 2d9y s TYR 87 N 1.32 3.44 -0.18 4.92 1.51 0.54 -4.81 117.35 124.10 2d9y s TYR 87 Ca 0.02 1.27 -0.07 0.00 -1.01 0.00 0.00 57.07 57.27 2d9y s TYR 87 Cb -0.22 -2.99 -0.04 0.00 -0.11 0.00 0.00 41.96 38.60 2d9y s TYR 87 CO 0.00 -0.20 0.06 -0.06 -1.11 0.00 0.00 175.55 174.25 2d9y s PHE 88 N 1.97 3.26 -0.02 2.71 0.08 -1.26 -0.47 117.98 124.25 2d9y s PHE 88 Ca 0.38 0.09 0.01 0.00 0.12 0.00 0.00 56.93 57.54 2d9y s PHE 88 Cb -0.17 -2.07 0.01 0.00 -0.57 0.00 0.00 43.02 40.22 2d9y s PHE 88 CO 0.13 0.18 -0.04 -0.06 -0.10 0.00 0.00 175.22 175.33 2d9y s PHE 89 N 0.32 0.57 -0.28 0.36 0.08 -0.64 -3.00 117.98 115.40 2d9y s PHE 89 Ca 0.04 -0.12 0.00 0.00 0.12 0.00 0.00 56.93 56.97 2d9y s PHE 89 Cb -0.12 -0.47 0.05 0.00 -0.57 0.00 0.00 43.02 41.91 2d9y s PHE 89 CO 0.00 -0.10 -0.05 0.45 -0.10 0.00 0.00 175.22 175.42 2d9y s SER 90 N 0.46 4.63 0.21 1.36 0.15 -0.86 -0.55 113.70 119.10 2d9y s SER 90 Ca -0.05 -1.28 -0.30 0.00 0.70 0.00 0.00 55.95 55.02 2d9y s SER 90 Cb -0.09 -1.64 -0.08 0.00 -1.71 0.00 0.00 66.02 62.50 2d9y s SER 90 CO -0.00 -0.22 1.14 0.00 1.20 0.00 0.00 173.24 175.36 2d9y s ALA 91 N 1.20 3.40 0.27 5.45 0.00 0.17 -2.98 121.76 129.27 2d9y s ALA 91 Ca -0.06 0.89 -0.00 0.00 0.00 0.00 0.00 51.96 52.78 2d9y s ALA 91 Cb -0.19 -3.37 0.53 0.00 0.00 0.00 0.00 23.12 20.08 2d9y s ALA 91 CO -0.03 -0.26 1.80 0.93 0.00 0.00 0.00 175.76 178.20 2d9y h GLU 92 N 4.82 0.78 -6.24 0.00 5.08 -1.86 -3.43 114.58 113.73 2d9y h GLU 92 Ca -0.45 -0.05 -0.59 0.00 -1.00 0.00 0.00 59.36 57.27 2d9y h GLU 92 Cb 1.21 -0.18 -0.16 0.00 0.50 0.00 0.00 28.75 30.12 2d9y h GLU 92 CO 0.72 0.52 -0.78 -1.12 -1.00 0.00 0.00 179.01 177.34 2d9y s SER 93 N -5.56 3.27 0.49 1.42 0.01 -1.26 -5.03 113.70 107.05 2d9y s SER 93 Ca -0.12 -0.94 0.32 0.00 1.31 0.00 0.00 55.95 56.52 2d9y s SER 93 Cb 0.22 -0.24 1.33 0.00 0.21 0.00 0.00 66.02 67.53 2d9y s SER 93 CO 0.79 0.03 1.94 1.55 0.41 0.00 0.00 173.24 177.97 2d9y h PRO 94 N 2.81 0.00 -0.16 12.44 0.13 -1.94 -2.78 132.00 142.50 2d9y h PRO 94 Ca -0.42 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.52 2d9y h PRO 94 Cb 1.23 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.36 2d9y h PRO 94 CO 0.54 0.00 -0.66 1.05 -0.23 0.00 0.00 178.00 178.70 2d9y h GLU 95 N 0.00 0.60 0.02 0.86 4.11 -1.96 -3.31 114.58 114.91 2d9y h GLU 95 Ca 0.00 -0.44 -0.06 0.00 0.07 0.00 0.00 59.36 58.93 2d9y h GLU 95 Cb 0.46 0.08 0.01 0.00 0.50 0.00 0.00 28.75 29.79 2d9y h GLU 95 CO 0.00 1.06 -0.25 0.93 0.07 0.00 0.00 179.01 180.82 2d9y h GLU 96 N 0.44 0.13 -0.74 1.06 4.39 -1.92 -3.16 114.58 114.78 2d9y h GLU 96 Ca -0.02 -0.17 0.11 0.00 0.34 0.00 0.00 59.36 59.62 2d9y h GLU 96 Cb 1.24 0.06 -0.12 0.00 -0.10 0.00 0.00 28.75 29.83 2d9y h GLU 96 CO 0.13 0.99 -0.29 0.94 -1.16 0.00 0.00 179.01 179.61 2d9y n GLN 97 N -4.49 -0.17 -0.06 2.33 7.27 -1.07 0.80 117.38 121.99 2d9y n GLN 97 Ca -0.10 1.14 -0.12 0.00 0.07 0.00 0.00 57.00 57.99 2d9y n GLN 97 Cb 0.54 -1.69 -0.06 0.00 2.41 0.00 0.00 30.24 31.44 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 0.33 -0.73 3.69 5.08 -1.68 -2.46 114.58 118.81 2d9y h GLU 98 Ca 0.26 -0.11 0.16 0.00 -1.00 0.00 0.00 59.36 58.67 2d9y h GLU 98 Cb 0.44 -0.03 -0.12 0.00 0.50 0.00 0.00 28.75 29.55 2d9y h GLU 98 CO -0.74 0.55 0.08 0.00 -1.00 0.00 0.00 179.01 177.90 2d9y h ALA 99 N 0.77 0.84 0.63 3.43 0.00 0.43 -2.25 119.26 123.10 2d9y h ALA 99 Ca 0.05 0.21 -0.03 0.00 0.00 0.00 0.00 54.91 55.14 2d9y h ALA 99 Cb 0.41 0.33 0.01 0.00 0.00 0.00 0.00 17.79 18.54 2d9y h ALA 99 CO 0.01 -0.39 -0.30 -1.49 0.00 0.00 0.00 179.25 177.07 2d9y h TRP 100 N 0.16 -0.79 -1.39 0.00 4.06 -0.82 0.27 115.95 117.44 2d9y h TRP 100 Ca 0.41 -0.02 0.43 0.00 2.06 0.00 0.00 58.89 61.77 2d9y h TRP 100 Cb 0.71 0.26 -0.09 0.00 -1.00 0.00 0.00 29.16 29.04 2d9y h TRP 100 CO -0.35 -0.49 0.96 -0.89 -3.56 0.00 0.00 178.44 174.11 2d9y n ILE 101 N -4.95 -0.10 -0.08 1.49 5.41 -0.93 0.65 119.36 120.84 2d9y n ILE 101 Ca -0.11 1.35 -0.23 0.00 1.00 0.00 0.00 62.75 64.77 2d9y n ILE 101 Cb 0.33 -2.22 -0.12 0.00 -0.71 0.00 0.00 39.64 36.92 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 -3.94 0.62 0.11 0.38 6.02 -0.89 -1.94 117.38 117.74 2d9y n GLN 102 Ca 0.35 0.45 -0.12 0.00 -0.01 0.00 0.00 57.00 57.67 2d9y n GLN 102 Cb 1.49 -1.70 -0.05 0.00 1.02 0.00 0.00 30.24 30.99 2d9y n GLN 102 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2d9y h ALA 103 N -0.41 -0.37 0.05 -1.58 0.00 0.39 0.27 119.26 117.61 2d9y h ALA 103 Ca -0.42 -0.03 -0.24 0.00 0.00 0.00 0.00 54.91 54.21 2d9y h ALA 103 Cb 1.54 0.36 -0.02 0.00 0.00 0.00 0.00 17.79 19.67 2d9y h ALA 103 CO -0.16 -0.75 -1.18 0.00 0.00 0.00 0.00 179.25 177.15 2d9y h MET 104 N -0.41 0.10 -0.67 0.00 -0.00 -0.54 -3.29 114.93 110.13 2d9y h MET 104 Ca 0.03 -0.17 -0.07 0.00 -0.00 0.00 0.00 59.70 59.49 2d9y h MET 104 Cb 0.44 0.06 -0.03 0.00 -0.00 0.00 0.00 31.60 32.08 2d9y h MET 104 CO -0.13 1.03 0.15 0.78 -0.00 0.00 0.00 176.91 178.73 2d9y h GLY 105 N 2.52 1.15 0.94 -3.00 0.00 -1.21 -2.95 103.07 100.52 2d9y h GLY 105 Ca -0.09 -0.72 -0.02 0.00 0.00 0.00 0.00 47.33 46.50 2d9y h GLY 105 CO 0.15 0.67 0.15 1.05 0.00 0.00 0.00 176.54 178.56 2d9y h GLU 106 N 1.01 0.59 -0.51 4.80 4.11 -0.57 -2.50 114.58 121.51 2d9y h GLU 106 Ca 0.21 -0.11 0.10 0.00 0.07 0.00 0.00 59.36 59.63 2d9y h GLU 106 Cb 0.38 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.51 2d9y h GLU 106 CO 0.00 0.57 0.35 0.00 0.07 0.00 0.00 179.01 180.01 2d9y h ALA 107 N 0.99 2.16 -0.30 1.06 0.00 -1.59 -1.70 119.26 119.88 2d9y h ALA 107 Ca 0.13 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 2d9y h ALA 107 Cb 0.21 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2d9y h ALA 107 CO -0.01 -0.29 0.10 0.00 0.00 0.00 0.00 179.25 179.06 2d9y h ALA 108 N 1.74 0.40 -1.84 0.00 0.00 -1.28 -3.42 119.26 114.85 2d9y h ALA 108 Ca 0.24 -0.15 -0.53 0.00 0.00 0.00 0.00 54.91 54.47 2d9y h ALA 108 Cb 0.63 -0.12 0.24 0.00 0.00 0.00 0.00 17.79 18.54 2d9y h ALA 108 CO -0.05 0.02 -1.75 0.54 0.00 0.00 0.00 179.25 178.01 2d9y n ARG 109 N -4.70 -0.13 -4.21 0.00 1.74 -0.64 -0.96 116.66 107.75 2d9y n ARG 109 Ca -0.02 -0.03 -0.26 0.00 -0.77 0.00 0.00 57.85 56.77 2d9y n ARG 109 Cb 0.16 -1.18 -0.17 0.00 -1.02 0.00 0.00 32.46 30.25 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 -2.08 1.15 -0.06 1.55 1.01 -1.26 -4.65 120.40 116.06 2d9y s VAL 110 Ca 0.43 -0.42 -0.04 0.00 0.00 0.00 0.00 61.98 61.96 2d9y s VAL 110 Cb -0.13 -1.11 0.03 0.00 0.00 0.00 0.00 36.38 35.17 2d9y s VAL 110 CO 0.77 0.38 0.14 -1.58 0.00 0.00 0.00 175.10 174.80 2d9y s GLN 111 N 1.24 0.12 0.07 2.72 0.74 -1.26 -5.16 119.66 118.13 2d9y s GLN 111 Ca -0.03 0.28 0.01 0.00 0.05 0.00 0.00 55.36 55.66 2d9y s GLN 111 Cb -0.14 -0.05 -0.04 0.00 1.10 0.00 0.00 33.01 33.88 2d9y s GLN 111 CO -0.03 -0.09 -0.06 -1.12 -0.55 0.00 0.00 175.29 173.44 2d9y s SER 112 N 0.62 0.81 0.45 6.67 0.01 -1.26 -5.13 113.70 115.88 2d9y s SER 112 Ca -0.05 -0.85 -0.21 0.00 1.31 0.00 0.00 55.95 56.16 2d9y s SER 112 Cb -0.06 0.11 -0.13 0.00 0.21 0.00 0.00 66.02 66.15 2d9y s SER 112 CO -0.03 -0.43 0.32 0.61 0.41 0.00 0.00 173.24 174.13 2d9y n GLY 113 N 0.50 -2.08 3.61 3.44 0.00 -1.26 -4.95 105.19 104.46 2d9y n GLY 113 Ca -0.16 -0.04 -0.30 0.00 0.00 0.00 0.00 46.02 45.52 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 -1.42 -0.81 -0.29 1.61 0.04 -1.26 -5.02 135.00 127.84 2d9y s PRO 114 Ca 0.62 0.08 -0.13 0.00 0.04 0.00 0.00 61.00 61.61 2d9y s PRO 114 Cb -0.57 -1.63 0.11 0.00 0.04 0.00 0.00 34.50 32.44 2d9y s PRO 114 CO 0.60 -3.47 0.69 0.45 0.04 0.00 0.00 177.00 175.31 2d9y s SER 115 N -3.78 -1.02 -0.17 6.66 0.15 -1.26 -4.95 113.70 109.33 2d9y s SER 115 Ca 0.69 1.51 -0.03 0.00 0.70 0.00 0.00 55.95 58.83 2d9y s SER 115 Cb -0.12 1.82 0.05 0.00 -1.71 0.00 0.00 66.02 66.07 2d9y s SER 115 CO 0.56 -0.22 0.03 -0.94 1.20 0.00 0.00 173.24 173.87 2d9y s SER 116 N 2.24 2.62 0.00 5.45 1.04 -1.26 -5.31 113.70 118.48 2d9y s SER 116 Ca -0.08 -0.66 0.00 0.00 0.48 0.00 0.00 55.95 55.69 2d9y s SER 116 Cb -0.08 -0.56 0.00 0.00 0.10 0.00 0.00 66.02 65.48 2d9y s SER 116 CO -0.19 -0.28 0.00 0.61 0.98 0.00 0.00 173.24 174.36