#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 6.27 0.99 1.61 0.15 -1.26 -5.03 113.70 116.42 2d9y s SER 2 Ca 0.00 -0.66 -0.12 0.00 0.70 0.00 0.00 55.95 55.87 2d9y s SER 2 Cb 0.00 -2.40 0.13 0.00 -1.71 0.00 0.00 66.02 62.03 2d9y s SER 2 CO 0.00 -1.22 0.76 -1.20 1.20 0.00 0.00 173.24 172.77 2d9y n SER 3 N 7.27 -1.07 -0.74 5.45 7.64 -1.26 -4.59 113.62 126.32 2d9y n SER 3 Ca -0.02 0.25 0.00 0.00 1.01 0.00 0.00 58.87 60.12 2d9y n SER 3 Cb 0.46 -1.30 0.00 0.00 -1.01 0.00 0.00 64.21 62.36 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 0.98 -3.59 4.38 0.23 0.00 -1.26 -4.75 105.19 101.19 2d9y n GLY 4 Ca 0.08 -1.02 -0.38 0.00 0.00 0.00 0.00 46.02 44.70 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 -1.44 -1.71 -4.31 1.61 3.41 -1.26 -4.87 113.62 105.05 2d9y n SER 5 Ca 0.00 -1.17 -0.46 0.00 -0.26 0.00 0.00 58.87 56.98 2d9y n SER 5 Cb 0.10 -2.02 -0.05 0.00 -0.26 0.00 0.00 64.21 61.99 2d9y n SER 5 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2d9y s SER 6 N -3.51 6.19 1.02 4.04 0.15 -1.26 -5.06 113.70 115.27 2d9y s SER 6 Ca 0.63 -1.78 -0.13 0.00 0.70 0.00 0.00 55.95 55.36 2d9y s SER 6 Cb -0.36 -2.21 0.18 0.00 -1.71 0.00 0.00 66.02 61.92 2d9y s SER 6 CO 0.99 -0.87 1.01 0.61 1.20 0.00 0.00 173.24 176.18 2d9y n GLY 7 N 5.24 -1.59 4.04 9.45 0.00 -1.26 -4.25 105.19 116.82 2d9y n GLY 7 Ca -0.14 -1.67 -0.33 0.00 0.00 0.00 0.00 46.02 43.89 2d9y n GLY 7 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2d9y n ASN 8 N -3.77 -4.16 -4.01 1.61 2.85 -1.26 -4.86 115.26 101.66 2d9y n ASN 8 Ca 0.13 -0.87 -0.36 0.00 -0.11 0.00 0.00 54.58 53.36 2d9y n ASN 8 Cb 0.45 -3.44 0.04 0.00 1.24 0.00 0.00 39.78 38.07 2d9y n ASN 8 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2d9y n ALA 9 N -4.56 -5.40 -1.06 5.20 0.00 -1.26 -4.94 120.51 108.48 2d9y n ALA 9 Ca 0.05 -0.66 -0.30 0.00 0.00 0.00 0.00 53.44 52.52 2d9y n ALA 9 Cb 0.51 -1.16 0.26 0.00 0.00 0.00 0.00 19.45 19.06 2d9y n ALA 9 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2d9y s PRO 10 N -1.97 -1.64 -0.11 0.00 0.04 -1.26 -5.05 135.00 125.01 2d9y s PRO 10 Ca 0.41 -0.21 -0.01 0.00 0.04 0.00 0.00 61.00 61.22 2d9y s PRO 10 Cb -0.19 -1.56 -0.03 0.00 0.04 0.00 0.00 34.50 32.76 2d9y s PRO 10 CO 0.82 -3.96 -0.06 0.08 0.04 0.00 0.00 177.00 173.92 2d9y s VAL 11 N -3.02 3.71 -0.15 -0.36 1.01 -1.26 -4.72 120.40 115.61 2d9y s VAL 11 Ca 0.72 -0.45 -0.12 0.00 0.00 0.00 0.00 61.98 62.14 2d9y s VAL 11 Cb -0.07 -2.56 -0.24 0.00 0.00 0.00 0.00 36.38 33.51 2d9y s VAL 11 CO 0.56 0.55 0.31 0.41 0.00 0.00 0.00 175.10 176.93 2d9y n THR 12 N 2.85 1.71 -3.60 3.92 -1.04 -1.04 -5.00 114.28 112.07 2d9y n THR 12 Ca -0.18 -0.46 -0.16 0.00 -2.04 0.00 0.00 64.05 61.21 2d9y n THR 12 Cb 0.53 -1.83 -0.07 0.00 -1.82 0.00 0.00 70.33 67.13 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 -2.50 0.92 -0.24 -2.82 2.20 -1.22 -5.00 119.74 111.08 2d9y s LYS 13 Ca -0.25 0.16 -0.17 0.00 -0.36 0.00 0.00 55.97 55.35 2d9y s LYS 13 Cb 0.06 0.43 0.07 0.00 -1.51 0.00 0.00 37.83 36.88 2d9y s LYS 13 CO 0.71 -0.27 0.61 0.00 -0.36 0.00 0.00 175.35 176.04 2d9y s ALA 14 N -1.13 -1.59 -0.12 3.13 0.00 -1.26 0.12 121.76 120.91 2d9y s ALA 14 Ca -0.11 1.98 -0.33 0.00 0.00 0.00 0.00 51.96 53.50 2d9y s ALA 14 Cb -0.02 -1.17 0.13 0.00 0.00 0.00 0.00 23.12 22.06 2d9y s ALA 14 CO 0.08 -0.32 1.19 0.20 0.00 0.00 0.00 175.76 176.90 2d9y s GLY 15 N 1.04 -0.33 -0.46 0.00 0.00 -0.61 -5.02 107.32 101.94 2d9y s GLY 15 Ca -0.06 1.28 -0.28 0.00 0.00 0.00 0.00 44.72 45.66 2d9y s GLY 15 CO -0.10 0.40 1.50 -0.98 0.00 0.00 0.00 173.10 173.92 2d9y s TRP 16 N -2.51 2.22 -0.10 1.90 0.52 -1.26 -2.36 118.94 117.35 2d9y s TRP 16 Ca 0.10 0.62 0.04 0.00 0.02 0.00 0.00 56.10 56.88 2d9y s TRP 16 Cb 0.00 -4.29 0.00 0.00 -1.15 0.00 0.00 33.47 28.03 2d9y s TRP 16 CO -0.05 -2.15 -0.24 -0.51 0.02 0.00 0.00 176.95 174.03 2d9y s LEU 17 N 6.11 2.08 -0.30 2.99 1.43 -0.84 -4.56 118.68 125.58 2d9y s LEU 17 Ca 0.62 -0.56 -0.29 0.00 -1.03 0.00 0.00 54.13 52.87 2d9y s LEU 17 Cb -0.14 -1.40 0.01 0.00 0.03 0.00 0.00 46.19 44.69 2d9y s LEU 17 CO 0.30 0.15 1.14 -0.36 0.23 0.00 0.00 176.35 177.81 2d9y s PHE 18 N 0.38 3.02 0.09 0.29 0.40 -1.16 -2.49 117.98 118.50 2d9y s PHE 18 Ca -0.18 1.11 -0.21 0.00 -0.60 0.00 0.00 56.93 57.05 2d9y s PHE 18 Cb -0.18 -3.72 -0.07 0.00 0.51 0.00 0.00 43.02 39.57 2d9y s PHE 18 CO 0.08 -1.06 0.61 0.21 0.70 0.00 0.00 175.22 175.76 2d9y s LYS 19 N 3.75 4.28 -0.08 0.44 2.20 0.43 -2.28 119.74 128.47 2d9y s LYS 19 Ca 0.49 0.83 -0.28 0.00 -0.36 0.00 0.00 55.97 56.64 2d9y s LYS 19 Cb -0.14 -3.24 -0.02 0.00 -1.51 0.00 0.00 37.83 32.91 2d9y s LYS 19 CO 0.17 0.62 0.92 -1.14 -0.36 0.00 0.00 175.35 175.56 2d9y s GLN 20 N -1.11 4.44 -0.51 4.03 0.74 -1.20 -0.94 119.66 125.11 2d9y s GLN 20 Ca 0.30 1.24 -0.28 0.00 0.05 0.00 0.00 55.36 56.68 2d9y s GLN 20 Cb -0.20 -3.51 -0.00 0.00 1.10 0.00 0.00 33.01 30.39 2d9y s GLN 20 CO 0.20 -0.19 1.62 0.00 -0.55 0.00 0.00 175.29 176.38 2d9y s ALA 21 N 1.58 2.67 0.15 1.58 0.00 0.67 -4.85 121.76 123.55 2d9y s ALA 21 Ca 0.46 -0.40 -0.13 0.00 0.00 0.00 0.00 51.96 51.89 2d9y s ALA 21 Cb -0.19 -4.12 0.02 0.00 0.00 0.00 0.00 23.12 18.83 2d9y s ALA 21 CO 0.20 -3.07 1.62 1.03 0.00 0.00 0.00 175.76 175.53 2d9y h SER 22 N 12.51 0.81 -4.38 0.00 0.87 -1.87 -3.39 113.55 118.10 2d9y h SER 22 Ca -0.28 -0.28 -0.48 0.00 -1.23 0.00 0.00 61.79 59.52 2d9y h SER 22 Cb 1.13 -0.22 0.09 0.00 -0.44 0.00 0.00 62.40 62.96 2d9y h SER 22 CO 1.15 0.89 0.37 -0.55 -0.53 0.00 0.00 176.83 178.15 2d9y s SER 23 N -6.27 4.99 0.33 6.23 0.15 -1.26 -4.92 113.70 112.95 2d9y s SER 23 Ca -0.13 0.87 0.00 0.00 0.70 0.00 0.00 55.95 57.39 2d9y s SER 23 Cb 0.11 -1.54 0.00 0.00 -1.71 0.00 0.00 66.02 62.89 2d9y s SER 23 CO 0.81 -1.58 0.00 0.61 1.20 0.00 0.00 173.24 174.28 2d9y n GLY 24 N -3.09 0.29 3.18 9.45 0.00 -1.26 -4.67 105.19 109.09 2d9y n GLY 24 Ca 0.07 -0.66 -0.35 0.00 0.00 0.00 0.00 46.02 45.08 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 -0.25 0.00 -2.98 1.61 0.24 -1.26 -4.84 118.33 110.85 2d9y n VAL 25 Ca 0.00 -0.36 -0.44 0.00 -2.04 0.00 0.00 64.34 61.50 2d9y n VAL 25 Cb 0.00 -0.28 -0.02 0.00 -1.47 0.00 0.00 33.84 32.07 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 -2.73 3.72 0.42 7.34 3.01 -1.26 -4.80 119.74 125.44 2d9y s LYS 26 Ca 0.47 -2.04 0.03 0.00 -1.01 0.00 0.00 55.97 53.43 2d9y s LYS 26 Cb -0.19 -4.90 -0.02 0.00 -1.01 0.00 0.00 37.83 31.71 2d9y s LYS 26 CO 0.76 -1.71 0.11 1.14 0.51 0.00 0.00 175.35 176.15 2d9y s GLN 27 N 2.11 1.96 0.19 1.68 -2.07 -1.26 -4.99 119.66 117.29 2d9y s GLN 27 Ca 0.33 -2.20 0.11 0.00 -1.82 0.00 0.00 55.36 51.78 2d9y s GLN 27 Cb -0.05 -0.76 -0.04 0.00 -1.09 0.00 0.00 33.01 31.07 2d9y s GLN 27 CO -0.07 -0.45 -0.23 -1.58 -1.32 0.00 0.00 175.29 171.64 2d9y s TRP 28 N -3.16 2.33 -0.02 9.60 0.52 -1.26 -0.24 118.94 126.71 2d9y s TRP 28 Ca 0.22 -0.35 -0.01 0.00 0.02 0.00 0.00 56.10 55.98 2d9y s TRP 28 Cb 0.03 -1.16 0.02 0.00 -1.15 0.00 0.00 33.47 31.21 2d9y s TRP 28 CO 0.13 0.50 0.04 -0.80 0.02 0.00 0.00 176.95 176.84 2d9y s ASN 29 N -2.67 0.02 0.06 2.95 0.01 -0.11 -4.92 114.94 110.27 2d9y s ASN 29 Ca 0.21 0.07 -0.31 0.00 -0.71 0.00 0.00 52.86 52.12 2d9y s ASN 29 Cb -0.08 -0.01 -0.07 0.00 0.41 0.00 0.00 41.25 41.51 2d9y s ASN 29 CO 0.10 -0.09 1.39 -0.75 -1.51 0.00 0.00 177.10 176.24 2d9y s LYS 30 N 0.74 4.31 -0.08 -0.60 2.20 -1.26 -0.43 119.74 124.62 2d9y s LYS 30 Ca -0.06 2.01 -0.10 0.00 -0.36 0.00 0.00 55.97 57.46 2d9y s LYS 30 Cb -0.09 -3.42 0.02 0.00 -1.51 0.00 0.00 37.83 32.84 2d9y s LYS 30 CO -0.02 -0.50 0.27 0.50 -0.36 0.00 0.00 175.35 175.24 2d9y s ARG 31 N 1.75 0.40 -0.15 4.03 6.06 -1.04 -4.92 118.95 125.09 2d9y s ARG 31 Ca 0.64 0.20 -0.29 0.00 -2.50 0.00 0.00 55.73 53.78 2d9y s ARG 31 Cb -0.34 0.19 -0.01 0.00 0.06 0.00 0.00 34.95 34.84 2d9y s ARG 31 CO 0.29 -0.07 1.19 -0.46 -2.50 0.00 0.00 175.30 173.74 2d9y s TRP 32 N -0.27 3.07 -0.06 5.12 -0.00 -0.98 -1.99 118.94 123.83 2d9y s TRP 32 Ca -0.04 1.18 0.03 0.00 -0.00 0.00 0.00 56.10 57.27 2d9y s TRP 32 Cb -0.03 -3.42 -0.03 0.00 -0.00 0.00 0.00 33.47 29.99 2d9y s TRP 32 CO 0.01 -1.29 -0.14 -0.06 -0.00 0.00 0.00 176.95 175.48 2d9y s PHE 33 N 3.02 2.72 -0.24 5.86 0.08 -0.99 -0.78 117.98 127.65 2d9y s PHE 33 Ca 0.53 -0.18 -0.02 0.00 0.12 0.00 0.00 56.93 57.37 2d9y s PHE 33 Cb -0.21 -1.65 0.08 0.00 -0.57 0.00 0.00 43.02 40.67 2d9y s PHE 33 CO 0.15 0.17 0.06 0.08 -0.10 0.00 0.00 175.22 175.58 2d9y s VAL 34 N -0.66 0.57 0.08 -0.44 1.01 0.85 -1.57 120.40 120.24 2d9y s VAL 34 Ca 0.10 -0.83 -0.31 0.00 0.00 0.00 0.00 61.98 60.94 2d9y s VAL 34 Cb -0.11 -1.22 -0.08 0.00 0.00 0.00 0.00 36.38 34.97 2d9y s VAL 34 CO 0.01 -0.40 1.59 -0.22 0.00 0.00 0.00 175.10 176.08 2d9y s LEU 35 N 1.81 4.36 0.51 3.92 2.96 0.32 -1.90 118.68 130.65 2d9y s LEU 35 Ca 0.03 2.44 0.01 0.00 -0.22 0.00 0.00 54.13 56.39 2d9y s LEU 35 Cb -0.17 -3.57 -0.01 0.00 0.50 0.00 0.00 46.19 42.94 2d9y s LEU 35 CO -0.16 -0.84 0.01 0.54 -1.32 0.00 0.00 176.35 174.58 2d9y s VAL 36 N 2.27 1.03 -0.26 1.68 0.11 0.16 -2.51 120.40 122.87 2d9y s VAL 36 Ca 0.71 -2.00 -0.36 0.00 -2.93 0.00 0.00 61.98 57.40 2d9y s VAL 36 Cb -0.39 -2.09 -0.12 0.00 -1.53 0.00 0.00 36.38 32.24 2d9y s VAL 36 CO 0.31 0.00 2.01 0.47 -3.33 0.00 0.00 175.10 174.56 2d9y n ASP 37 N -1.31 2.56 -4.31 3.54 9.92 -1.26 -1.43 116.55 124.27 2d9y n ASP 37 Ca -0.19 0.70 -0.39 0.00 -0.53 0.00 0.00 54.79 54.38 2d9y n ASP 37 Cb 0.67 -1.27 -0.07 0.00 -0.64 0.00 0.00 41.12 39.81 2d9y n ASP 37 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 2d9y n ARG 38 N 7.19 -0.89 -3.80 -1.24 1.74 -1.26 -4.82 116.66 113.58 2d9y n ARG 38 Ca 0.33 0.13 -0.04 0.00 -0.77 0.00 0.00 57.85 57.50 2d9y n ARG 38 Cb 0.23 -4.56 -0.00 0.00 -1.02 0.00 0.00 32.46 27.11 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 -3.10 -0.36 0.15 0.00 2.96 -0.60 0.37 118.68 118.08 2d9y s LEU 40 Ca 0.16 0.92 0.07 0.00 -0.22 0.00 0.00 54.13 55.05 2d9y s LEU 40 Cb -0.02 1.31 -0.04 0.00 0.50 0.00 0.00 46.19 47.94 2d9y s LEU 40 CO 0.04 -0.21 -0.02 -0.36 -1.32 0.00 0.00 176.35 174.48 2d9y s PHE 41 N 2.03 2.85 -0.01 5.38 0.08 -0.80 -0.09 117.98 127.43 2d9y s PHE 41 Ca -0.05 -0.12 0.01 0.00 0.12 0.00 0.00 56.93 56.89 2d9y s PHE 41 Cb -0.10 -1.42 0.00 0.00 -0.57 0.00 0.00 43.02 40.93 2d9y s PHE 41 CO -0.12 0.50 -0.04 1.52 -0.10 0.00 0.00 175.22 176.97 2d9y s TYR 42 N -1.57 0.40 0.26 0.36 -0.85 -1.19 -0.11 117.35 114.65 2d9y s TYR 42 Ca 0.26 -0.07 0.11 0.00 -0.52 0.00 0.00 57.07 56.85 2d9y s TYR 42 Cb -0.10 -0.30 -0.05 0.00 0.38 0.00 0.00 41.96 41.89 2d9y s TYR 42 CO 0.18 -0.04 -0.19 0.71 -1.52 0.00 0.00 175.55 174.69 2d9y s TYR 43 N 0.12 2.20 0.23 -3.49 1.51 0.04 -3.30 117.35 114.66 2d9y s TYR 43 Ca -0.01 -0.37 -0.09 0.00 -1.01 0.00 0.00 57.07 55.59 2d9y s TYR 43 Cb -0.04 -0.97 0.37 0.00 -0.11 0.00 0.00 41.96 41.21 2d9y s TYR 43 CO -0.00 0.64 1.64 -0.22 -1.11 0.00 0.00 175.55 176.50 2d9y h LYS 44 N 2.40 0.10 -4.17 -0.62 1.63 -1.87 -2.58 116.57 111.45 2d9y h LYS 44 Ca -0.40 -0.01 -0.27 0.00 -0.85 0.00 0.00 60.65 59.12 2d9y h LYS 44 Cb 1.25 -0.02 -0.09 0.00 -0.60 0.00 0.00 32.23 32.77 2d9y h LYS 44 CO 0.59 0.06 -0.22 -0.51 -3.45 0.00 0.00 179.45 175.92 2d9y s ASP 45 N -5.21 0.88 0.28 4.20 1.11 -1.26 -4.29 116.67 112.37 2d9y s ASP 45 Ca -0.14 -1.47 0.02 0.00 0.18 0.00 0.00 52.55 51.15 2d9y s ASP 45 Cb 0.21 0.64 0.65 0.00 1.07 0.00 0.00 42.92 45.49 2d9y s ASP 45 CO 0.75 -1.25 1.75 1.05 1.18 0.00 0.00 175.17 178.64 2d9y h GLU 46 N 2.14 0.58 -1.58 8.23 4.11 -1.95 0.65 114.58 126.77 2d9y h GLU 46 Ca -0.28 -0.03 0.47 0.00 0.07 0.00 0.00 59.36 59.59 2d9y h GLU 46 Cb 1.24 -0.13 -0.09 0.00 0.50 0.00 0.00 28.75 30.27 2d9y h GLU 46 CO 0.39 0.38 1.10 0.87 0.07 0.00 0.00 179.01 181.82 2d9y h LYS 47 N 0.60 0.04 -5.89 1.06 1.57 -1.97 -3.44 116.57 108.54 2d9y h LYS 47 Ca 0.52 -0.00 -0.39 0.00 -1.87 0.00 0.00 60.65 58.91 2d9y h LYS 47 Cb 0.84 -0.01 0.11 0.00 0.08 0.00 0.00 32.23 33.26 2d9y h LYS 47 CO -0.41 0.02 -0.73 0.39 -0.57 0.00 0.00 179.45 178.15 2d9y n GLU 48 N -4.26 -7.00 0.01 3.15 1.02 0.22 -4.91 120.64 108.87 2d9y n GLU 48 Ca 0.38 0.78 -0.15 0.00 -0.02 0.00 0.00 57.16 58.16 2d9y n GLU 48 Cb 1.64 -5.76 -0.09 0.00 -0.02 0.00 0.00 31.44 27.21 2d9y n GLU 48 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 2d9y h GLU 49 N -2.33 -0.55 -2.98 3.49 5.08 -1.86 -3.44 114.58 111.98 2d9y h GLU 49 Ca -0.58 0.04 -0.12 0.00 -1.00 0.00 0.00 59.36 57.69 2d9y h GLU 49 Cb 1.36 0.13 -0.21 0.00 0.50 0.00 0.00 28.75 30.52 2d9y h GLU 49 CO 0.56 -0.37 -0.28 0.45 -1.00 0.00 0.00 179.01 178.37 2d9y s SER 50 N -4.68 -0.25 0.05 1.42 0.15 -1.26 -5.14 113.70 104.00 2d9y s SER 50 Ca -0.15 0.27 -0.31 0.00 0.70 0.00 0.00 55.95 56.47 2d9y s SER 50 Cb 0.07 0.43 -0.06 0.00 -1.71 0.00 0.00 66.02 64.75 2d9y s SER 50 CO 0.57 -0.36 1.28 -0.63 1.20 0.00 0.00 173.24 175.31 2d9y s ILE 51 N -0.89 3.81 -0.23 6.45 1.01 -1.26 -4.41 121.20 125.68 2d9y s ILE 51 Ca -0.10 1.27 -0.15 0.00 0.00 0.00 0.00 60.65 61.67 2d9y s ILE 51 Cb -0.04 -3.81 -0.17 0.00 0.01 0.00 0.00 42.46 38.44 2d9y s ILE 51 CO 0.03 0.07 -0.01 0.18 0.00 0.00 0.00 174.94 175.21 2d9y n LEU 52 N 4.32 2.07 -3.71 2.97 4.77 -1.21 -5.02 117.00 121.20 2d9y n LEU 52 Ca 0.11 0.32 -0.14 0.00 -0.03 0.00 0.00 56.01 56.27 2d9y n LEU 52 Cb 0.45 -0.93 -0.09 0.00 -2.33 0.00 0.00 43.42 40.52 2d9y n LEU 52 CO 0.57 0.50 0.13 -0.83 -1.33 0.00 0.00 177.39 176.43 2d9y s GLY 53 N -5.30 -0.32 0.09 -0.72 0.00 -1.26 -5.10 107.32 94.71 2d9y s GLY 53 Ca -0.32 1.06 0.06 0.00 0.00 0.00 0.00 44.72 45.51 2d9y s GLY 53 CO 0.58 0.86 -0.05 -0.45 0.00 0.00 0.00 173.10 174.04 2d9y s SER 54 N -0.26 4.73 -0.27 1.64 0.15 -1.26 -3.18 113.70 115.25 2d9y s SER 54 Ca -0.04 -0.26 0.03 0.00 0.70 0.00 0.00 55.95 56.37 2d9y s SER 54 Cb -0.03 -1.04 0.07 0.00 -1.71 0.00 0.00 66.02 63.31 2d9y s SER 54 CO 0.02 0.18 -0.07 -0.63 1.20 0.00 0.00 173.24 173.94 2d9y s ILE 55 N -1.25 2.11 -0.61 6.45 1.01 0.88 -5.01 121.20 124.77 2d9y s ILE 55 Ca 0.23 -1.72 -0.26 0.00 0.00 0.00 0.00 60.65 58.90 2d9y s ILE 55 Cb -0.11 -2.29 -0.02 0.00 0.01 0.00 0.00 42.46 40.04 2d9y s ILE 55 CO 0.16 -0.14 1.86 -2.16 0.00 0.00 0.00 174.94 174.66 2d9y s PRO 56 N 1.10 2.62 -0.29 2.79 0.04 -1.26 -1.56 135.00 138.44 2d9y s PRO 56 Ca -0.05 0.60 -0.06 0.00 0.04 0.00 0.00 61.00 61.53 2d9y s PRO 56 Cb -0.20 -4.40 -0.17 0.00 0.04 0.00 0.00 34.50 29.78 2d9y s PRO 56 CO -0.06 -2.74 3.35 1.28 0.04 0.00 0.00 177.00 178.87 2d9y n LEU 57 N 12.78 5.92 -4.43 -3.56 4.77 -1.24 -4.86 117.00 126.39 2d9y n LEU 57 Ca 0.21 -3.53 -0.39 0.00 -0.03 0.00 0.00 56.01 52.26 2d9y n LEU 57 Cb 0.52 -1.39 -0.11 0.00 -2.33 0.00 0.00 43.42 40.10 2d9y n LEU 57 CO 0.71 1.75 -0.18 -0.22 -1.33 0.00 0.00 177.39 178.12 2d9y s LEU 58 N -0.50 4.31 -1.27 2.23 2.96 -1.26 -3.53 118.68 121.61 2d9y s LEU 58 Ca 0.65 -0.63 -0.08 0.00 -0.22 0.00 0.00 54.13 53.86 2d9y s LEU 58 Cb 0.32 -2.02 0.01 0.00 0.50 0.00 0.00 46.19 44.99 2d9y s LEU 58 CO -0.06 -0.25 1.03 -1.20 -1.32 0.00 0.00 176.35 174.56 2d9y n SER 59 N 5.00 -6.03 -4.95 3.68 7.64 -0.62 -4.99 113.62 113.36 2d9y n SER 59 Ca -0.13 -0.47 -0.25 0.00 1.01 0.00 0.00 58.87 59.02 2d9y n SER 59 Cb 0.48 -4.67 -0.03 0.00 -1.01 0.00 0.00 64.21 58.98 2d9y n SER 59 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 2d9y s PHE 60 N -3.28 3.48 -0.52 1.43 0.40 -1.22 -4.62 117.98 113.66 2d9y s PHE 60 Ca 0.51 0.14 -0.08 0.00 -0.60 0.00 0.00 56.93 56.90 2d9y s PHE 60 Cb -0.23 -1.69 0.13 0.00 0.51 0.00 0.00 43.02 41.75 2d9y s PHE 60 CO 0.63 0.47 0.38 0.50 0.70 0.00 0.00 175.22 177.90 2d9y s ARG 61 N -3.40 2.53 -0.13 0.44 3.52 -1.02 -4.33 118.95 116.56 2d9y s ARG 61 Ca 0.35 -1.95 -0.12 0.00 -0.13 0.00 0.00 55.73 53.88 2d9y s ARG 61 Cb -0.11 -3.90 -0.05 0.00 -1.56 0.00 0.00 34.95 29.34 2d9y s ARG 61 CO 0.29 -1.19 0.26 0.08 -0.81 0.00 0.00 175.30 173.93 2d9y s VAL 62 N 1.02 5.31 -0.09 7.11 1.01 -1.26 -3.13 120.40 130.37 2d9y s VAL 62 Ca 0.09 0.48 -0.32 0.00 0.00 0.00 0.00 61.98 62.23 2d9y s VAL 62 Cb -0.24 -3.58 0.13 0.00 0.00 0.00 0.00 36.38 32.69 2d9y s VAL 62 CO -0.02 0.47 1.24 0.00 0.00 0.00 0.00 175.10 176.79 2d9y s ALA 63 N -0.07 -2.14 0.42 5.51 0.00 -1.03 -4.94 121.76 119.50 2d9y s ALA 63 Ca 0.16 1.10 -0.25 0.00 0.00 0.00 0.00 51.96 52.97 2d9y s ALA 63 Cb -0.13 0.15 -0.10 0.00 0.00 0.00 0.00 23.12 23.04 2d9y s ALA 63 CO 0.05 -0.84 1.24 0.00 0.00 0.00 0.00 175.76 176.21 2d9y n ALA 64 N -0.30 1.18 -1.05 0.00 0.00 -1.26 -0.87 120.51 118.20 2d9y n ALA 64 Ca -0.04 0.26 -0.10 0.00 0.00 0.00 0.00 53.44 53.56 2d9y n ALA 64 Cb 0.61 -2.25 0.12 0.00 0.00 0.00 0.00 19.45 17.93 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 -0.23 0.00 -4.23 0.00 0.24 -0.70 -4.64 118.33 108.77 2d9y n VAL 65 Ca 0.07 -0.25 -0.13 0.00 -2.04 0.00 0.00 64.34 61.99 2d9y n VAL 65 Cb 0.39 -1.13 -0.10 0.00 -1.47 0.00 0.00 33.84 31.53 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 -4.25 1.02 0.00 7.34 -0.21 -1.26 -5.01 119.66 117.29 2d9y s GLN 66 Ca 0.36 -1.45 0.11 0.00 0.02 0.00 0.00 55.36 54.39 2d9y s GLN 66 Cb -0.03 -0.41 0.65 0.00 1.00 0.00 0.00 33.01 34.21 2d9y s GLN 66 CO 0.27 -0.01 1.09 -0.35 -2.12 0.00 0.00 175.29 174.16 2d9y n PRO 67 N -0.18 0.49 -0.00 2.91 -0.04 -1.26 -1.90 135.00 135.02 2d9y n PRO 67 Ca -0.10 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.44 2d9y n PRO 67 Cb 0.61 -1.35 -0.11 0.00 -0.04 0.00 0.00 33.50 32.61 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 -0.85 1.03 -1.23 3.54 7.64 -1.26 -4.40 113.62 118.10 2d9y n SER 68 Ca 0.08 -0.35 -0.05 0.00 1.01 0.00 0.00 58.87 59.56 2d9y n SER 68 Cb 0.04 1.45 0.04 0.00 -1.01 0.00 0.00 64.21 64.73 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 -1.79 3.06 -3.10 6.43 9.92 -0.80 -4.82 116.55 125.45 2d9y n ASP 69 Ca -0.01 -2.34 -0.17 0.00 -0.53 0.00 0.00 54.79 51.74 2d9y n ASP 69 Cb 0.36 -0.57 -0.03 0.00 -0.64 0.00 0.00 41.12 40.23 2d9y n ASP 69 CO 0.00 0.00 0.00 -3.20 0.13 0.00 0.00 177.20 174.13 2d9y n ASN 70 N 0.13 -1.18 -0.06 -2.24 2.85 -1.26 -4.76 115.26 108.74 2d9y n ASN 70 Ca 0.13 -0.29 -0.05 0.00 -0.11 0.00 0.00 54.58 54.26 2d9y n ASN 70 Cb 0.73 -1.09 -0.04 0.00 1.24 0.00 0.00 39.78 40.62 2d9y n ASN 70 CO 0.00 0.00 0.00 0.40 -2.11 0.00 0.00 177.26 175.55 2d9y h ILE 71 N -0.35 0.48 -6.38 -1.44 1.08 -1.88 -3.48 117.51 105.54 2d9y h ILE 71 Ca -0.24 -1.39 -0.48 0.00 -0.39 0.00 0.00 64.86 62.36 2d9y h ILE 71 Cb 1.00 0.93 -0.03 0.00 -3.07 0.00 0.00 36.82 35.65 2d9y h ILE 71 CO 0.37 0.16 -0.85 -1.20 -0.69 0.00 0.00 178.15 175.94 2d9y n SER 72 N -4.70 -1.32 -3.69 1.72 7.64 -1.26 -4.97 113.62 107.04 2d9y n SER 72 Ca -0.05 -0.93 -0.13 0.00 1.01 0.00 0.00 58.87 58.77 2d9y n SER 72 Cb 0.19 -3.41 -0.13 0.00 -1.01 0.00 0.00 64.21 59.85 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 -6.43 0.17 0.76 1.43 0.52 -1.26 -5.15 118.95 108.98 2d9y s ARG 73 Ca 0.14 0.64 -0.11 0.00 -0.52 0.00 0.00 55.73 55.88 2d9y s ARG 73 Cb -0.08 -0.09 0.05 0.00 0.52 0.00 0.00 34.95 35.36 2d9y s ARG 73 CO 0.86 -0.23 1.10 0.15 0.02 0.00 0.00 175.30 177.20 2d9y s LYS 74 N 1.86 2.30 -1.42 3.54 -0.14 -1.26 -3.67 119.74 120.95 2d9y s LYS 74 Ca -0.04 1.24 -0.05 0.00 -1.36 0.00 0.00 55.97 55.77 2d9y s LYS 74 Cb -0.11 -1.90 0.03 0.00 -1.68 0.00 0.00 37.83 34.17 2d9y s LYS 74 CO -0.08 -1.62 0.68 0.72 -0.76 0.00 0.00 175.35 174.29 2d9y n HIS 75 N -3.33 -1.90 -4.96 3.18 8.25 -1.26 -4.58 115.22 110.62 2d9y n HIS 75 Ca 0.10 0.82 -0.26 0.00 -0.26 0.00 0.00 57.72 58.11 2d9y n HIS 75 Cb 0.53 -3.98 -0.16 0.00 1.12 0.00 0.00 29.99 27.50 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 -3.65 1.55 0.07 1.59 2.01 -1.24 -0.14 115.64 115.83 2d9y s THR 76 Ca 0.21 -0.84 0.03 0.00 0.31 0.00 0.00 61.69 61.40 2d9y s THR 76 Cb -0.11 -1.29 -0.03 0.00 0.01 0.00 0.00 72.50 71.09 2d9y s THR 76 CO 0.85 0.44 -0.10 0.72 -0.69 0.00 0.00 174.62 175.84 2d9y s PHE 77 N -0.45 0.92 0.11 4.92 -0.71 -0.76 -1.73 117.98 120.28 2d9y s PHE 77 Ca 0.07 -0.57 0.06 0.00 -1.04 0.00 0.00 56.93 55.45 2d9y s PHE 77 Cb -0.08 -0.52 -0.04 0.00 -1.21 0.00 0.00 43.02 41.17 2d9y s PHE 77 CO -0.01 -0.04 -0.03 -1.59 -1.34 0.00 0.00 175.22 172.22 2d9y s LYS 78 N -2.13 2.38 -0.26 1.99 -2.85 -0.05 -1.64 119.74 117.18 2d9y s LYS 78 Ca -0.02 -0.95 -0.02 0.00 -1.00 0.00 0.00 55.97 53.97 2d9y s LYS 78 Cb -0.07 -2.43 0.08 0.00 -2.06 0.00 0.00 37.83 33.36 2d9y s LYS 78 CO 0.00 0.51 0.08 0.00 0.10 0.00 0.00 175.35 176.04 2d9y s ALA 79 N -1.37 1.20 -0.02 0.59 0.00 0.10 -2.48 121.76 119.79 2d9y s ALA 79 Ca 0.25 -1.22 -0.00 0.00 0.00 0.00 0.00 51.96 50.99 2d9y s ALA 79 Cb -0.11 -1.42 0.03 0.00 0.00 0.00 0.00 23.12 21.62 2d9y s ALA 79 CO 0.17 -1.47 0.03 -1.83 0.00 0.00 0.00 175.76 172.65 2d9y s GLU 80 N 1.78 0.01 0.00 0.00 -1.05 -1.18 -0.35 118.70 117.90 2d9y s GLU 80 Ca 0.05 0.18 0.00 0.00 -0.15 0.00 0.00 54.97 55.06 2d9y s GLU 80 Cb -0.17 -0.30 0.00 0.00 -0.44 0.00 0.00 34.13 33.22 2d9y s GLU 80 CO -0.20 -0.17 0.53 1.58 0.95 0.00 0.00 175.26 177.94 2d9y n HIS 81 N 4.25 0.00 0.12 4.83 -0.00 -1.26 -2.43 115.22 120.73 2d9y n HIS 81 Ca -0.26 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.46 2d9y n HIS 81 Cb 0.50 -0.25 0.00 0.00 -0.00 0.00 0.00 29.99 30.24 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 -1.25 3.00 -2.05 1.57 0.00 -1.26 -4.53 120.51 115.98 2d9y n ALA 82 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.41 2d9y n ALA 82 Cb 0.00 0.07 -0.03 0.00 0.00 0.00 0.00 19.45 19.49 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 2.00 0.74 0.01 0.00 0.00 -1.26 -5.00 105.19 101.67 2d9y n GLY 83 Ca 0.00 -0.08 -0.00 0.00 0.00 0.00 0.00 46.02 45.93 2d9y n GLY 83 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2d9y h VAL 84 N 5.37 0.00 -2.29 1.61 2.07 -1.97 -3.50 116.25 117.55 2d9y h VAL 84 Ca -0.27 -0.10 -0.07 0.00 0.82 0.00 0.00 66.70 67.07 2d9y h VAL 84 Cb 1.30 0.00 -0.20 0.00 -1.52 0.00 0.00 31.29 30.87 2d9y h VAL 84 CO -0.12 0.00 0.03 -0.60 0.02 0.00 0.00 177.57 176.91 2d9y s ARG 85 N -1.10 0.85 -0.42 1.57 3.52 -1.26 -5.10 118.95 117.01 2d9y s ARG 85 Ca -0.01 0.41 -0.07 0.00 -0.13 0.00 0.00 55.73 55.93 2d9y s ARG 85 Cb 0.00 0.40 0.09 0.00 -1.56 0.00 0.00 34.95 33.89 2d9y s ARG 85 CO 0.01 -0.21 0.25 0.99 -0.81 0.00 0.00 175.30 175.53 2d9y s THR 86 N -0.62 3.90 -0.26 4.11 2.01 -1.26 -4.22 115.64 119.29 2d9y s THR 86 Ca -0.07 -1.66 -0.26 0.00 0.31 0.00 0.00 61.69 60.01 2d9y s THR 86 Cb -0.03 -3.49 0.00 0.00 0.01 0.00 0.00 72.50 69.00 2d9y s THR 86 CO 0.05 -0.59 0.90 -0.31 -0.69 0.00 0.00 174.62 173.98 2d9y s TYR 87 N 1.33 3.27 -0.07 4.92 1.51 0.52 -4.78 117.35 124.05 2d9y s TYR 87 Ca 0.04 1.14 -0.04 0.00 -1.01 0.00 0.00 57.07 57.21 2d9y s TYR 87 Cb -0.24 -3.22 -0.04 0.00 -0.11 0.00 0.00 41.96 38.36 2d9y s TYR 87 CO -0.00 -0.50 0.09 -0.06 -1.11 0.00 0.00 175.55 173.97 2d9y s PHE 88 N 3.05 3.40 -0.03 2.71 0.08 -1.26 0.01 117.98 125.94 2d9y s PHE 88 Ca 0.38 0.35 -0.01 0.00 0.12 0.00 0.00 56.93 57.76 2d9y s PHE 88 Cb -0.15 -1.84 0.03 0.00 -0.57 0.00 0.00 43.02 40.50 2d9y s PHE 88 CO 0.09 0.61 0.05 -0.06 -0.10 0.00 0.00 175.22 175.82 2d9y s PHE 89 N -1.06 0.03 -0.33 0.36 0.08 -0.65 -3.26 117.98 113.16 2d9y s PHE 89 Ca 0.18 0.21 -0.08 0.00 0.12 0.00 0.00 56.93 57.35 2d9y s PHE 89 Cb -0.12 -0.34 0.02 0.00 -0.57 0.00 0.00 43.02 42.01 2d9y s PHE 89 CO 0.07 -0.14 0.13 0.45 -0.10 0.00 0.00 175.22 175.63 2d9y s SER 90 N 1.58 5.40 0.04 1.36 0.15 -0.97 -1.83 113.70 119.42 2d9y s SER 90 Ca -0.03 -0.82 -0.26 0.00 0.70 0.00 0.00 55.95 55.53 2d9y s SER 90 Cb -0.13 -1.94 -0.05 0.00 -1.71 0.00 0.00 66.02 62.20 2d9y s SER 90 CO -0.03 -0.27 0.83 0.00 1.20 0.00 0.00 173.24 174.97 2d9y s ALA 91 N 1.52 3.31 0.25 5.45 0.00 0.81 -3.00 121.76 130.09 2d9y s ALA 91 Ca 0.02 0.36 -0.05 0.00 0.00 0.00 0.00 51.96 52.29 2d9y s ALA 91 Cb -0.18 -3.09 0.47 0.00 0.00 0.00 0.00 23.12 20.31 2d9y s ALA 91 CO 0.04 -0.01 1.68 0.93 0.00 0.00 0.00 175.76 178.40 2d9y h GLU 92 N 5.94 0.26 -6.18 0.00 5.08 -1.86 -3.42 114.58 114.39 2d9y h GLU 92 Ca -0.43 -0.02 -0.57 0.00 -1.00 0.00 0.00 59.36 57.35 2d9y h GLU 92 Cb 1.21 -0.06 -0.10 0.00 0.50 0.00 0.00 28.75 30.30 2d9y h GLU 92 CO 0.72 0.17 -0.66 -1.12 -1.00 0.00 0.00 179.01 177.12 2d9y s SER 93 N -5.24 4.33 0.33 1.42 0.01 -1.26 -5.02 113.70 108.27 2d9y s SER 93 Ca -0.13 -0.76 0.12 0.00 1.31 0.00 0.00 55.95 56.50 2d9y s SER 93 Cb 0.21 -0.70 0.56 0.00 0.21 0.00 0.00 66.02 66.30 2d9y s SER 93 CO 0.76 -0.02 1.73 1.55 0.41 0.00 0.00 173.24 177.66 2d9y h PRO 94 N 1.94 0.00 -0.79 12.44 0.13 -1.93 -3.05 132.00 140.74 2d9y h PRO 94 Ca -0.43 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.66 2d9y h PRO 94 Cb 1.25 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.35 2d9y h PRO 94 CO 0.61 0.48 0.36 1.05 -0.23 0.00 0.00 178.00 180.26 2d9y h GLU 95 N 0.00 1.15 -0.12 0.86 4.11 -1.96 -2.95 114.58 115.67 2d9y h GLU 95 Ca -0.00 -0.18 -0.04 0.00 0.07 0.00 0.00 59.36 59.21 2d9y h GLU 95 Cb 0.86 -0.20 -0.00 0.00 0.50 0.00 0.00 28.75 29.91 2d9y h GLU 95 CO 0.06 0.90 -0.07 0.93 0.07 0.00 0.00 179.01 180.91 2d9y h GLU 96 N 1.13 0.26 -0.27 1.06 5.08 -1.92 -2.62 114.58 117.29 2d9y h GLU 96 Ca 0.27 -0.12 0.03 0.00 -1.00 0.00 0.00 59.36 58.54 2d9y h GLU 96 Cb 0.15 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.35 2d9y h GLU 96 CO -0.03 0.61 -0.33 0.37 -1.00 0.00 0.00 179.01 178.64 2d9y h GLN 97 N -0.10 -0.20 -0.40 2.33 4.15 -1.43 0.17 115.11 119.62 2d9y h GLN 97 Ca 0.03 0.01 0.07 0.00 0.77 0.00 0.00 58.65 59.53 2d9y h GLN 97 Cb 0.54 0.05 -0.06 0.00 0.21 0.00 0.00 27.48 28.21 2d9y h GLN 97 CO 0.02 -0.13 -0.00 0.93 -1.93 0.00 0.00 178.83 177.71 2d9y h GLU 98 N -0.21 0.10 -0.55 1.69 4.39 -1.61 -1.22 114.58 117.17 2d9y h GLU 98 Ca 0.05 -0.01 0.11 0.00 0.34 0.00 0.00 59.36 59.85 2d9y h GLU 98 Cb 0.33 -0.02 -0.10 0.00 -0.10 0.00 0.00 28.75 28.86 2d9y h GLU 98 CO -0.37 0.07 -0.08 0.00 -1.16 0.00 0.00 179.01 177.47 2d9y h ALA 99 N 1.35 0.44 0.78 3.43 0.00 -0.89 -2.48 119.26 121.88 2d9y h ALA 99 Ca 0.20 0.19 -0.04 0.00 0.00 0.00 0.00 54.91 55.26 2d9y h ALA 99 Cb 0.28 0.36 0.01 0.00 0.00 0.00 0.00 17.79 18.44 2d9y h ALA 99 CO -0.33 -0.42 -0.37 -1.49 0.00 0.00 0.00 179.25 176.64 2d9y h TRP 100 N 0.05 -0.97 -1.09 0.00 4.06 0.03 0.23 115.95 118.26 2d9y h TRP 100 Ca 0.27 -0.02 0.40 0.00 2.06 0.00 0.00 58.89 61.60 2d9y h TRP 100 Cb 0.42 0.32 -0.13 0.00 -1.00 0.00 0.00 29.16 28.77 2d9y h TRP 100 CO -0.41 -0.59 0.67 -0.89 -3.56 0.00 0.00 178.44 173.67 2d9y n ILE 101 N -5.51 -0.26 -0.07 1.49 5.41 -0.53 -1.03 119.36 118.86 2d9y n ILE 101 Ca -0.14 1.62 -0.06 0.00 1.00 0.00 0.00 62.75 65.18 2d9y n ILE 101 Cb 0.42 -2.65 -0.03 0.00 -0.71 0.00 0.00 39.64 36.68 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 -0.26 0.38 4.20 -1.17 -2.33 115.11 115.93 2d9y h GLN 102 Ca 0.75 0.00 0.02 0.00 0.06 0.00 0.00 58.65 59.49 2d9y h GLN 102 Cb 2.30 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 30.04 2d9y h GLN 102 CO -0.49 0.14 -0.15 0.00 -0.67 0.00 0.00 178.83 177.66 2d9y n ALA 103 N -3.35 -0.17 0.14 3.87 0.00 0.77 -0.16 120.51 121.61 2d9y n ALA 103 Ca -0.08 0.22 -0.01 0.00 0.00 0.00 0.00 53.44 53.57 2d9y n ALA 103 Cb 0.25 0.32 0.18 0.00 0.00 0.00 0.00 19.45 20.19 2d9y n ALA 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2d9y h MET 104 N 0.00 0.00 -0.03 0.00 -0.00 -1.40 -3.27 114.93 110.24 2d9y h MET 104 Ca 0.04 0.00 0.03 0.00 -0.00 0.00 0.00 59.70 59.77 2d9y h MET 104 Cb 0.11 0.00 -0.04 0.00 -0.00 0.00 0.00 31.60 31.67 2d9y h MET 104 CO -0.25 0.61 -0.20 0.78 -0.00 0.00 0.00 176.91 177.85 2d9y h GLY 105 N 1.89 -0.26 0.57 -3.00 0.00 -0.38 -1.33 103.07 100.57 2d9y h GLY 105 Ca -0.01 0.24 0.09 0.00 0.00 0.00 0.00 47.33 47.65 2d9y h GLY 105 CO 0.08 -0.18 0.47 1.05 0.00 0.00 0.00 176.54 177.96 2d9y h GLU 106 N -0.31 0.78 0.00 4.80 4.11 -0.60 0.11 114.58 123.48 2d9y h GLU 106 Ca 0.07 -0.05 -0.02 0.00 0.07 0.00 0.00 59.36 59.43 2d9y h GLU 106 Cb 0.40 -0.18 -0.00 0.00 0.50 0.00 0.00 28.75 29.47 2d9y h GLU 106 CO -0.21 0.52 -0.09 0.00 0.07 0.00 0.00 179.01 179.30 2d9y h ALA 107 N 1.44 1.27 0.17 1.06 0.00 -1.48 -2.80 119.26 118.92 2d9y h ALA 107 Ca 0.38 -0.08 -0.30 0.00 0.00 0.00 0.00 54.91 54.92 2d9y h ALA 107 Cb 0.31 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.10 2d9y h ALA 107 CO -0.23 0.11 -1.42 0.00 0.00 0.00 0.00 179.25 177.71 2d9y h ALA 108 N 1.91 0.05 -2.47 0.00 0.00 0.26 -3.43 119.26 115.58 2d9y h ALA 108 Ca -0.00 -0.99 -0.55 0.00 0.00 0.00 0.00 54.91 53.37 2d9y h ALA 108 Cb 0.29 0.34 0.19 0.00 0.00 0.00 0.00 17.79 18.61 2d9y h ALA 108 CO 0.01 0.78 -0.22 2.89 0.00 0.00 0.00 179.25 182.71 2d9y n ARG 109 N -3.82 0.20 -4.03 0.00 1.85 -0.17 -1.59 116.66 109.10 2d9y n ARG 109 Ca -0.21 0.12 -0.12 0.00 -1.00 0.00 0.00 57.85 56.64 2d9y n ARG 109 Cb 0.98 -2.01 -0.12 0.00 -1.05 0.00 0.00 32.46 30.26 2d9y n ARG 109 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 2d9y s VAL 110 N -2.02 0.31 -1.18 8.89 0.11 -1.26 -4.75 120.40 120.49 2d9y s VAL 110 Ca 0.67 -0.74 -0.16 0.00 -2.93 0.00 0.00 61.98 58.82 2d9y s VAL 110 Cb -0.31 -0.38 0.13 0.00 -1.53 0.00 0.00 36.38 34.30 2d9y s VAL 110 CO 0.57 -0.28 1.47 -1.10 -3.33 0.00 0.00 175.10 172.43 2d9y s GLN 111 N -1.09 3.98 -0.05 1.54 -0.21 -1.26 -4.64 119.66 117.93 2d9y s GLN 111 Ca -0.09 -2.26 -0.08 0.00 0.02 0.00 0.00 55.36 52.95 2d9y s GLN 111 Cb -0.07 -5.17 -0.03 0.00 1.00 0.00 0.00 33.01 28.73 2d9y s GLN 111 CO -0.00 -1.91 -0.17 0.45 -2.12 0.00 0.00 175.29 171.54 2d9y n SER 112 N 6.60 1.44 0.00 5.90 2.88 -1.26 -5.16 113.62 124.02 2d9y n SER 112 Ca 0.38 0.22 0.00 0.00 -1.33 0.00 0.00 58.87 58.14 2d9y n SER 112 Cb 0.45 -0.52 0.00 0.00 -0.75 0.00 0.00 64.21 63.39 2d9y n SER 112 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2d9y n GLY 113 N 2.46 -0.31 3.68 0.46 0.00 -1.26 -5.11 105.19 105.11 2d9y n GLY 113 Ca -0.10 -0.79 -0.42 0.00 0.00 0.00 0.00 46.02 44.71 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 -2.00 4.24 0.06 1.61 0.04 -1.26 -5.01 135.00 132.69 2d9y s PRO 114 Ca 0.00 2.02 -0.18 0.00 0.04 0.00 0.00 61.00 62.88 2d9y s PRO 114 Cb 0.00 -3.69 -0.06 0.00 0.04 0.00 0.00 34.50 30.78 2d9y s PRO 114 CO 0.00 -0.67 0.53 -1.12 0.04 0.00 0.00 177.00 175.78 2d9y s SER 115 N 2.28 7.00 -1.26 6.66 0.01 -1.26 -4.11 113.70 123.02 2d9y s SER 115 Ca 0.66 1.19 -0.07 0.00 1.31 0.00 0.00 55.95 59.04 2d9y s SER 115 Cb -0.32 -2.33 0.01 0.00 0.21 0.00 0.00 66.02 63.59 2d9y s SER 115 CO 0.26 0.28 1.09 -1.20 0.41 0.00 0.00 173.24 174.08 2d9y n SER 116 N 1.70 -5.26 -0.80 2.44 7.64 -1.26 -5.31 113.62 112.78 2d9y n SER 116 Ca -0.11 -0.53 0.13 0.00 1.01 0.00 0.00 58.87 59.37 2d9y n SER 116 Cb 0.51 -4.83 0.24 0.00 -1.01 0.00 0.00 64.21 59.12 2d9y n SER 116 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64