#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g0l s ALA 2 N 0.00 3.11 0.73 0.00 0.00 -1.26 -5.10 121.76 119.24 2g0l s ALA 2 Ca 0.00 -1.85 -0.09 0.00 0.00 0.00 0.00 51.96 50.03 2g0l s ALA 2 Cb 0.00 -2.37 0.06 0.00 0.00 0.00 0.00 23.12 20.81 2g0l s ALA 2 CO 0.00 -1.41 1.06 -1.25 0.00 0.00 0.00 175.76 174.16 2g0l s PRO 3 N 1.41 2.26 -0.21 0.00 0.04 -1.26 -4.98 135.00 132.26 2g0l s PRO 3 Ca -0.00 -0.04 0.01 0.00 0.04 0.00 0.00 61.00 61.01 2g0l s PRO 3 Cb -0.20 -2.10 0.04 0.00 0.04 0.00 0.00 34.50 32.28 2g0l s PRO 3 CO 0.03 -1.28 -0.14 0.99 0.04 0.00 0.00 177.00 176.64 2g0l s THR 4 N -3.34 1.93 -1.08 1.26 2.01 0.20 -5.02 115.64 111.60 2g0l s THR 4 Ca 0.60 -1.15 -0.07 0.00 0.31 0.00 0.00 61.69 61.39 2g0l s THR 4 Cb -0.11 -1.91 0.28 0.00 0.01 0.00 0.00 72.50 70.77 2g0l s THR 4 CO 0.47 0.25 1.20 0.00 -0.69 0.00 0.00 174.62 175.85 2g0l n ALA 5 N 4.59 4.49 -1.63 7.40 0.00 -1.26 -0.53 120.51 133.57 2g0l n ALA 5 Ca -0.17 -4.71 -0.42 0.00 0.00 0.00 0.00 53.44 48.15 2g0l n ALA 5 Cb 0.47 -2.34 -0.01 0.00 0.00 0.00 0.00 19.45 17.57 2g0l n ALA 5 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2g0l n THR 6 N 2.21 3.38 -3.76 0.00 -2.24 -0.84 -4.93 114.28 108.10 2g0l n THR 6 Ca 0.25 -2.83 -0.32 0.00 -2.27 0.00 0.00 64.05 58.87 2g0l n THR 6 Cb 0.37 -2.58 -0.05 0.00 -2.10 0.00 0.00 70.33 65.97 2g0l n THR 6 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 2g0l s VAL 7 N 3.26 5.25 -0.29 2.28 -7.23 -1.26 -3.07 120.40 119.35 2g0l s VAL 7 Ca 0.50 -0.07 0.02 0.00 -1.81 0.00 0.00 61.98 60.61 2g0l s VAL 7 Cb 0.14 -3.62 0.06 0.00 0.56 0.00 0.00 36.38 33.53 2g0l s VAL 7 CO -0.07 0.12 -0.05 -0.89 -0.31 0.00 0.00 175.10 173.90 2g0l s THR 8 N -1.56 2.46 0.75 5.32 2.01 -0.07 -5.00 115.64 119.55 2g0l s THR 8 Ca 0.37 -1.66 -0.11 0.00 0.31 0.00 0.00 61.69 60.61 2g0l s THR 8 Cb -0.13 -2.49 0.04 0.00 0.01 0.00 0.00 72.50 69.94 2g0l s THR 8 CO 0.24 -0.14 1.08 -2.16 -0.69 0.00 0.00 174.62 172.95 2g0l s PRO 9 N 1.12 2.47 -0.34 4.92 0.04 -1.26 -3.74 135.00 138.20 2g0l s PRO 9 Ca -0.05 0.92 0.06 0.00 0.04 0.00 0.00 61.00 61.97 2g0l s PRO 9 Cb -0.20 -1.94 0.46 0.00 0.04 0.00 0.00 34.50 32.86 2g0l s PRO 9 CO -0.04 -1.42 1.28 0.43 0.04 0.00 0.00 177.00 177.29 2g0l n SER 10 N -3.34 5.23 -4.62 6.66 7.64 -1.26 -4.99 113.62 118.94 2g0l n SER 10 Ca 0.08 -3.75 -0.43 0.00 1.01 0.00 0.00 58.87 55.78 2g0l n SER 10 Cb 0.54 -0.42 -0.03 0.00 -1.01 0.00 0.00 64.21 63.30 2g0l n SER 10 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2g0l s SER 11 N -3.39 6.27 0.00 6.43 0.01 -1.26 -2.02 113.70 119.74 2g0l s SER 11 Ca 0.52 1.48 0.00 0.00 1.31 0.00 0.00 55.95 59.26 2g0l s SER 11 Cb 0.42 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 64.12 2g0l s SER 11 CO 0.02 -1.37 0.00 0.61 0.41 0.00 0.00 173.24 172.91 2g0l n GLY 12 N 4.86 0.72 3.98 3.44 0.00 1.00 -4.93 105.19 114.26 2g0l n GLY 12 Ca 0.19 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.02 2g0l n GLY 12 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2g0l s LEU 13 N 0.00 4.11 0.00 0.99 1.43 -0.86 -3.92 118.68 120.44 2g0l s LEU 13 Ca 0.00 -0.08 -0.04 0.00 -1.03 0.00 0.00 54.13 52.98 2g0l s LEU 13 Cb 0.00 -2.79 0.12 0.00 0.03 0.00 0.00 46.19 43.54 2g0l s LEU 13 CO 0.00 -0.28 0.74 -1.20 0.23 0.00 0.00 176.35 175.85 2g0l n SER 14 N -1.54 0.58 -4.80 2.29 7.64 -1.26 -3.00 113.62 113.53 2g0l n SER 14 Ca -0.04 -1.59 -0.33 0.00 1.01 0.00 0.00 58.87 57.92 2g0l n SER 14 Cb 0.58 -0.52 0.01 0.00 -1.01 0.00 0.00 64.21 63.27 2g0l n SER 14 CO 0.00 0.00 0.00 1.51 -3.01 0.00 0.00 175.04 173.54 2g0l s ASP 15 N -3.89 5.72 0.00 6.43 -4.77 -1.26 -3.58 116.67 115.31 2g0l s ASP 15 Ca 0.46 1.84 0.00 0.00 -3.30 0.00 0.00 52.55 51.55 2g0l s ASP 15 Cb -0.02 -2.54 0.00 0.00 -1.09 0.00 0.00 42.92 39.27 2g0l s ASP 15 CO 0.31 -1.21 0.00 0.61 0.70 0.00 0.00 175.17 175.58 2g0l n GLY 16 N -0.91 0.77 3.75 2.12 0.00 -0.01 -5.04 105.19 105.87 2g0l n GLY 16 Ca 0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.70 2g0l n GLY 16 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2g0l s THR 17 N -2.40 3.10 -0.60 2.61 2.01 -1.24 -4.74 115.64 114.39 2g0l s THR 17 Ca 0.00 1.01 -0.24 0.00 0.31 0.00 0.00 61.69 62.77 2g0l s THR 17 Cb 0.00 -3.64 0.05 0.00 0.01 0.00 0.00 72.50 68.91 2g0l s THR 17 CO 0.00 0.20 0.99 -0.69 -0.69 0.00 0.00 174.62 174.43 2g0l s VAL 18 N -0.58 4.28 0.02 3.82 1.01 -1.26 -3.27 120.40 124.42 2g0l s VAL 18 Ca 0.51 0.12 -0.30 0.00 0.00 0.00 0.00 61.98 62.31 2g0l s VAL 18 Cb -0.37 -4.63 -0.05 0.00 0.00 0.00 0.00 36.38 31.33 2g0l s VAL 18 CO 0.44 -1.31 1.21 -0.69 0.00 0.00 0.00 175.10 174.76 2g0l s VAL 19 N 4.21 4.08 -0.27 2.92 1.01 -0.67 -4.84 120.40 126.85 2g0l s VAL 19 Ca 0.29 1.47 -0.16 0.00 0.00 0.00 0.00 61.98 63.58 2g0l s VAL 19 Cb -0.13 -3.94 -0.03 0.00 0.00 0.00 0.00 36.38 32.27 2g0l s VAL 19 CO 0.16 0.07 0.44 -0.75 0.00 0.00 0.00 175.10 175.02 2g0l s LYS 20 N 1.52 4.02 -0.29 2.72 2.20 -1.25 -2.10 119.74 126.56 2g0l s LYS 20 Ca 0.58 0.15 0.03 0.00 -0.36 0.00 0.00 55.97 56.37 2g0l s LYS 20 Cb -0.28 -3.66 0.08 0.00 -1.51 0.00 0.00 37.83 32.45 2g0l s LYS 20 CO 0.27 -0.33 -0.03 0.08 -0.36 0.00 0.00 175.35 174.98 2g0l s VAL 21 N 2.19 2.04 -0.18 4.02 1.01 -0.64 -0.89 120.40 127.94 2g0l s VAL 21 Ca 0.18 -1.83 0.00 0.00 0.00 0.00 0.00 61.98 60.33 2g0l s VAL 21 Cb -0.16 -2.32 0.04 0.00 0.00 0.00 0.00 36.38 33.94 2g0l s VAL 21 CO 0.10 -0.29 -0.08 0.00 0.00 0.00 0.00 175.10 174.82 2g0l s ALA 22 N 1.10 1.74 -0.03 5.51 0.00 -1.17 -0.33 121.76 128.58 2g0l s ALA 22 Ca -0.00 -0.99 0.01 0.00 0.00 0.00 0.00 51.96 50.97 2g0l s ALA 22 Cb -0.19 -1.18 -0.03 0.00 0.00 0.00 0.00 23.12 21.71 2g0l s ALA 22 CO -0.07 -0.75 0.00 0.20 0.00 0.00 0.00 175.76 175.13 2g0l s GLY 23 N 1.52 1.87 0.02 0.00 0.00 0.21 -1.98 107.32 108.95 2g0l s GLY 23 Ca 0.00 -0.91 0.05 0.00 0.00 0.00 0.00 44.72 43.87 2g0l s GLY 23 CO -0.08 -0.74 -0.16 0.00 0.00 0.00 0.00 173.10 172.12 2g0l s ALA 24 N -1.02 1.30 0.00 3.20 0.00 0.31 -1.16 121.76 124.40 2g0l s ALA 24 Ca 0.18 -0.79 0.00 0.00 0.00 0.00 0.00 51.96 51.34 2g0l s ALA 24 Cb -0.11 -0.26 0.00 0.00 0.00 0.00 0.00 23.12 22.74 2g0l s ALA 24 CO 0.08 0.29 0.00 0.41 0.00 0.00 0.00 175.76 176.53 2g0l n GLY 25 N 2.21 0.85 2.24 0.00 0.00 -0.45 -0.63 105.19 109.41 2g0l n GLY 25 Ca -0.16 -0.61 -0.12 0.00 0.00 0.00 0.00 46.02 45.13 2g0l n GLY 25 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2g0l n LEU 26 N -0.13 0.00 -4.50 0.99 4.77 0.48 -4.73 117.00 113.89 2g0l n LEU 26 Ca 0.00 -1.35 -0.43 0.00 -0.03 0.00 0.00 56.01 54.19 2g0l n LEU 26 Cb 0.37 -0.29 -0.06 0.00 -2.33 0.00 0.00 43.42 41.11 2g0l n LEU 26 CO 0.00 -0.68 0.41 -1.58 -1.33 0.00 0.00 177.39 174.21 2g0l s GLN 27 N -3.67 3.24 0.17 3.23 2.00 -1.26 -4.68 119.66 118.69 2g0l s GLN 27 Ca 0.36 -0.51 -0.32 0.00 -2.00 0.00 0.00 55.36 52.89 2g0l s GLN 27 Cb -0.03 -4.01 -0.11 0.00 0.80 0.00 0.00 33.01 29.66 2g0l s GLN 27 CO 0.23 -1.13 1.78 0.00 -0.50 0.00 0.00 175.29 175.67 2g0l s ALA 28 N 2.91 3.86 0.00 1.58 0.00 -1.26 -2.41 121.76 126.44 2g0l s ALA 28 Ca 0.21 1.53 0.00 0.00 0.00 0.00 0.00 51.96 53.71 2g0l s ALA 28 Cb -0.15 -3.73 0.00 0.00 0.00 0.00 0.00 23.12 19.24 2g0l s ALA 28 CO 0.17 -1.07 0.00 0.41 0.00 0.00 0.00 175.76 175.27 2g0l n GLY 29 N 4.10 0.64 3.67 0.00 0.00 -1.05 -5.03 105.19 107.54 2g0l n GLY 29 Ca 0.17 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.91 2g0l n GLY 29 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2g0l s THR 30 N -2.00 3.83 -0.15 2.61 -4.23 -1.01 -4.92 115.64 109.77 2g0l s THR 30 Ca 0.00 -1.27 -0.07 0.00 -1.18 0.00 0.00 61.69 59.17 2g0l s THR 30 Cb 0.00 -2.89 -0.04 0.00 1.34 0.00 0.00 72.50 70.91 2g0l s THR 30 CO 0.00 -0.03 0.09 0.00 -0.54 0.00 0.00 174.62 174.14 2g0l s ALA 31 N -1.57 3.60 -0.19 3.99 0.00 -1.26 -0.60 121.76 125.72 2g0l s ALA 31 Ca 0.27 -0.71 -0.05 0.00 0.00 0.00 0.00 51.96 51.47 2g0l s ALA 31 Cb -0.10 -1.90 -0.02 0.00 0.00 0.00 0.00 23.12 21.09 2g0l s ALA 31 CO 0.18 0.40 -0.01 0.71 0.00 0.00 0.00 175.76 177.05 2g0l s TYR 32 N -0.34 3.04 -0.29 0.00 1.51 0.39 -1.76 117.35 119.89 2g0l s TYR 32 Ca 0.10 -0.42 -0.23 0.00 -1.01 0.00 0.00 57.07 55.51 2g0l s TYR 32 Cb -0.12 -2.05 -0.00 0.00 -0.11 0.00 0.00 41.96 39.68 2g0l s TYR 32 CO 0.01 -0.19 0.76 0.34 -1.11 0.00 0.00 175.55 175.37 2g0l s ASP 33 N 0.84 6.66 -0.11 2.29 2.15 0.18 -1.96 116.67 126.72 2g0l s ASP 33 Ca 0.00 0.69 0.01 0.00 0.43 0.00 0.00 52.55 53.69 2g0l s ASP 33 Cb -0.14 -2.40 0.02 0.00 -0.30 0.00 0.00 42.92 40.10 2g0l s ASP 33 CO 0.02 -0.56 -0.14 -0.69 -0.17 0.00 0.00 175.17 173.62 2g0l s VAL 34 N 2.86 1.45 0.26 1.11 1.01 -1.26 -1.59 120.40 124.24 2g0l s VAL 34 Ca 0.31 -0.60 -0.13 0.00 0.00 0.00 0.00 61.98 61.56 2g0l s VAL 34 Cb -0.14 -1.34 0.00 0.00 0.00 0.00 0.00 36.38 34.89 2g0l s VAL 34 CO 0.11 0.43 0.51 -0.83 0.00 0.00 0.00 175.10 175.33 2g0l s GLY 35 N 1.10 0.53 -1.40 4.51 0.00 -0.65 -3.29 107.32 108.11 2g0l s GLY 35 Ca -0.04 -0.86 -0.08 0.00 0.00 0.00 0.00 44.72 43.73 2g0l s GLY 35 CO -0.03 -0.59 2.87 0.61 0.00 0.00 0.00 173.10 175.96 2g0l n GLN 36 N -0.40 3.78 -1.82 2.90 10.64 -1.26 -0.43 117.38 130.79 2g0l n GLN 36 Ca -0.02 -2.43 -0.33 0.00 -1.83 0.00 0.00 57.00 52.39 2g0l n GLN 36 Cb 0.62 -2.68 -0.04 0.00 -0.86 0.00 0.00 30.24 27.27 2g0l n GLN 36 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2g0l s ALA 38 N 11.07 4.60 -0.00 0.00 0.00 -0.76 -4.46 121.76 132.20 2g0l s ALA 38 Ca 0.81 -1.87 -0.30 0.00 0.00 0.00 0.00 51.96 50.60 2g0l s ALA 38 Cb -0.13 -1.56 -0.07 0.00 0.00 0.00 0.00 23.12 21.35 2g0l s ALA 38 CO 0.18 -0.55 1.68 -1.58 0.00 0.00 0.00 175.76 175.49 2g0l s TRP 39 N -2.50 2.05 -0.08 0.00 0.52 -1.26 -0.34 118.94 117.33 2g0l s TRP 39 Ca 0.58 0.17 0.09 0.00 0.02 0.00 0.00 56.10 56.96 2g0l s TRP 39 Cb -0.08 -3.96 -0.13 0.00 -1.15 0.00 0.00 33.47 28.14 2g0l s TRP 39 CO 0.36 -4.03 0.08 1.55 0.02 0.00 0.00 176.95 174.93 2g0l n VAL 40 N 5.23 0.52 -4.05 4.03 3.14 0.80 -4.87 118.33 123.14 2g0l n VAL 40 Ca 0.17 -0.38 -0.09 0.00 -2.96 0.00 0.00 64.34 61.07 2g0l n VAL 40 Cb 0.42 -0.50 -0.03 0.00 -1.06 0.00 0.00 33.84 32.66 2g0l n VAL 40 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 2g0l n ASP 41 N -2.25 -0.47 -4.56 6.55 -0.08 -0.03 -5.00 116.55 110.71 2g0l n ASP 41 Ca -0.13 -2.08 -0.26 0.00 -1.51 0.00 0.00 54.79 50.81 2g0l n ASP 41 Cb 0.70 1.00 -0.06 0.00 2.34 0.00 0.00 41.12 45.10 2g0l n ASP 41 CO 0.00 0.00 0.00 0.42 0.12 0.00 0.00 177.20 177.74 2g0l s THR 42 N -2.68 3.43 0.00 5.18 -4.23 -1.26 -2.30 115.64 113.78 2g0l s THR 42 Ca 0.19 -0.46 0.00 0.00 -1.18 0.00 0.00 61.69 60.24 2g0l s THR 42 Cb 0.01 -4.06 0.00 0.00 1.34 0.00 0.00 72.50 69.79 2g0l s THR 42 CO 0.13 -0.86 0.00 0.61 -0.54 0.00 0.00 174.62 173.96 2g0l n GLY 43 N 6.59 0.70 3.49 3.99 0.00 -1.26 -5.05 105.19 113.66 2g0l n GLY 43 Ca 0.42 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.10 2g0l n GLY 43 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2g0l s VAL 44 N -2.67 3.63 0.40 1.61 1.01 -0.97 -5.05 120.40 118.34 2g0l s VAL 44 Ca 0.00 -0.47 0.08 0.00 0.00 0.00 0.00 61.98 61.59 2g0l s VAL 44 Cb 0.00 -2.54 -0.02 0.00 0.00 0.00 0.00 36.38 33.81 2g0l s VAL 44 CO 0.00 0.53 0.35 -0.76 0.00 0.00 0.00 175.10 175.22 2g0l s LEU 45 N 0.04 3.43 -0.15 3.92 1.02 -1.26 -0.14 118.68 125.54 2g0l s LEU 45 Ca -0.01 -0.69 -0.11 0.00 0.02 0.00 0.00 54.13 53.34 2g0l s LEU 45 Cb -0.14 -2.08 0.05 0.00 0.02 0.00 0.00 46.19 44.04 2g0l s LEU 45 CO 0.03 -0.58 0.38 0.00 0.02 0.00 0.00 176.35 176.21 2g0l s ALA 46 N -2.44 -0.96 0.50 4.21 0.00 0.53 -4.68 121.76 118.92 2g0l s ALA 46 Ca 0.46 1.28 0.00 0.00 0.00 0.00 0.00 51.96 53.70 2g0l s ALA 46 Cb -0.04 -0.76 0.01 0.00 0.00 0.00 0.00 23.12 22.33 2g0l s ALA 46 CO 0.27 -0.22 0.73 0.00 0.00 0.00 0.00 175.76 176.54 2g0l s ASN 48 N -4.30 6.59 0.00 0.00 4.22 -1.26 -0.61 114.94 119.58 2g0l s ASN 48 Ca 0.52 0.69 0.27 0.00 -2.14 0.00 0.00 52.86 52.21 2g0l s ASN 48 Cb -0.10 -2.26 0.90 0.00 1.28 0.00 0.00 41.25 41.07 2g0l s ASN 48 CO 0.39 -0.00 1.65 -0.81 -2.04 0.00 0.00 177.10 176.29 2g0l n PRO 49 N 3.84 0.94 -0.06 3.55 -0.04 -1.26 -4.11 135.00 137.86 2g0l n PRO 49 Ca -0.08 -0.52 -0.04 0.00 -0.04 0.00 0.00 63.50 62.82 2g0l n PRO 49 Cb 0.51 -1.49 -0.01 0.00 -0.04 0.00 0.00 33.50 32.47 2g0l n PRO 49 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2g0l n ALA 50 N -0.58 0.43 -2.94 0.55 0.00 -1.26 -4.65 120.51 112.06 2g0l n ALA 50 Ca 0.14 -0.43 -0.39 0.00 0.00 0.00 0.00 53.44 52.76 2g0l n ALA 50 Cb 0.33 0.01 -0.00 0.00 0.00 0.00 0.00 19.45 19.80 2g0l n ALA 50 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2g0l n ASP 51 N -4.13 6.20 -4.61 0.00 8.00 -1.26 -5.00 116.55 115.75 2g0l n ASP 51 Ca -0.07 -3.53 -0.23 0.00 0.71 0.00 0.00 54.79 51.66 2g0l n ASP 51 Cb 0.25 -1.09 -0.08 0.00 -0.02 0.00 0.00 41.12 40.18 2g0l n ASP 51 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 2g0l s PHE 52 N -3.31 2.58 -0.27 1.24 -0.71 -1.26 -4.23 117.98 112.03 2g0l s PHE 52 Ca 0.36 -0.30 -0.02 0.00 -1.04 0.00 0.00 56.93 55.94 2g0l s PHE 52 Cb 0.13 -1.24 0.13 0.00 -1.21 0.00 0.00 43.02 40.83 2g0l s PHE 52 CO -0.00 0.60 0.28 -1.12 -1.34 0.00 0.00 175.22 173.64 2g0l s SER 53 N -3.66 1.49 -0.08 1.98 0.01 -1.21 -5.05 113.70 107.19 2g0l s SER 53 Ca 0.32 -0.54 -0.26 0.00 1.31 0.00 0.00 55.95 56.78 2g0l s SER 53 Cb -0.05 0.53 -0.03 0.00 0.21 0.00 0.00 66.02 66.68 2g0l s SER 53 CO 0.19 -0.37 0.82 -0.44 0.41 0.00 0.00 173.24 173.86 2g0l s SER 54 N 2.37 7.09 -0.09 2.44 0.01 -1.26 -4.12 113.70 120.14 2g0l s SER 54 Ca 0.09 1.32 0.02 0.00 1.31 0.00 0.00 55.95 58.69 2g0l s SER 54 Cb -0.14 -2.47 -0.02 0.00 0.21 0.00 0.00 66.02 63.59 2g0l s SER 54 CO -0.27 -0.25 -0.13 0.54 0.41 0.00 0.00 173.24 173.54 2g0l s VAL 55 N 1.29 3.11 -0.04 3.43 0.11 -0.83 -4.91 120.40 122.55 2g0l s VAL 55 Ca 0.42 -0.68 -0.15 0.00 -2.93 0.00 0.00 61.98 58.64 2g0l s VAL 55 Cb -0.18 -2.26 -0.05 0.00 -1.53 0.00 0.00 36.38 32.36 2g0l s VAL 55 CO 0.19 0.56 0.40 0.28 -3.33 0.00 0.00 175.10 173.20 2g0l s THR 56 N -0.25 5.10 0.02 5.04 -1.32 -1.26 -0.46 115.64 122.51 2g0l s THR 56 Ca 0.02 0.81 -0.30 0.00 -1.21 0.00 0.00 61.69 61.00 2g0l s THR 56 Cb -0.13 -3.71 -0.07 0.00 -1.51 0.00 0.00 72.50 67.07 2g0l s THR 56 CO 0.03 0.52 1.70 0.00 -2.21 0.00 0.00 174.62 174.65 2g0l s ALA 57 N -0.61 3.64 1.20 11.08 0.00 0.23 -4.72 121.76 132.58 2g0l s ALA 57 Ca 0.23 1.12 -0.20 0.00 0.00 0.00 0.00 51.96 53.12 2g0l s ALA 57 Cb -0.16 -3.73 0.29 0.00 0.00 0.00 0.00 23.12 19.52 2g0l s ALA 57 CO 0.12 -1.27 1.15 0.16 0.00 0.00 0.00 175.76 175.92 2g0l s ASP 58 N 3.03 0.98 0.00 0.00 1.47 0.63 -2.52 116.67 120.26 2g0l s ASP 58 Ca 0.76 0.46 0.10 0.00 1.18 0.00 0.00 52.55 55.05 2g0l s ASP 58 Cb -0.38 -0.58 0.47 0.00 -0.34 0.00 0.00 42.92 42.09 2g0l s ASP 58 CO 0.33 -4.07 1.26 0.00 0.68 0.00 0.00 175.17 173.37 2g0l n ALA 59 N -4.70 1.55 1.11 2.11 0.00 -1.26 -0.89 120.51 118.43 2g0l n ALA 59 Ca 0.15 -0.04 0.12 0.00 0.00 0.00 0.00 53.44 53.67 2g0l n ALA 59 Cb 0.60 -1.16 0.16 0.00 0.00 0.00 0.00 19.45 19.05 2g0l n ALA 59 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2g0l n ASN 60 N -1.39 1.63 -0.14 0.00 3.02 -1.26 -4.94 115.26 112.18 2g0l n ASN 60 Ca 0.04 -1.27 -0.01 0.00 -0.03 0.00 0.00 54.58 53.30 2g0l n ASN 60 Cb 0.10 0.32 -0.00 0.00 -0.61 0.00 0.00 39.78 39.59 2g0l n ASN 60 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2g0l n GLY 61 N 1.38 0.35 3.36 7.41 0.00 -0.06 -4.69 105.19 112.94 2g0l n GLY 61 Ca 0.11 -0.84 -0.19 0.00 0.00 0.00 0.00 46.02 45.10 2g0l n GLY 61 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2g0l s SER 62 N -2.96 2.58 -0.23 1.61 1.04 -1.26 -0.38 113.70 114.10 2g0l s SER 62 Ca 0.00 -1.06 -0.07 0.00 0.48 0.00 0.00 55.95 55.30 2g0l s SER 62 Cb -0.00 -0.14 0.11 0.00 0.10 0.00 0.00 66.02 66.09 2g0l s SER 62 CO 0.00 -0.22 0.49 0.00 0.98 0.00 0.00 173.24 174.49 2g0l s ALA 63 N -3.00 -1.44 -0.12 5.32 0.00 -0.31 -0.26 121.76 121.95 2g0l s ALA 63 Ca 0.24 1.69 0.02 0.00 0.00 0.00 0.00 51.96 53.91 2g0l s ALA 63 Cb 0.00 -1.52 -0.01 0.00 0.00 0.00 0.00 23.12 21.60 2g0l s ALA 63 CO 0.08 -0.88 -0.19 -1.12 0.00 0.00 0.00 175.76 173.65 2g0l s SER 64 N 2.70 3.50 0.10 0.00 0.01 -1.26 -0.62 113.70 118.13 2g0l s SER 64 Ca -0.00 -0.46 -0.00 0.00 1.31 0.00 0.00 55.95 56.79 2g0l s SER 64 Cb -0.12 -1.50 -0.04 0.00 0.21 0.00 0.00 66.02 64.56 2g0l s SER 64 CO -0.15 0.15 -0.00 0.28 0.41 0.00 0.00 173.24 173.92 2g0l s THR 65 N 0.42 0.32 -0.10 1.44 -1.32 0.55 -4.92 115.64 112.03 2g0l s THR 65 Ca -0.14 -1.89 0.02 0.00 -1.21 0.00 0.00 61.69 58.48 2g0l s THR 65 Cb -0.17 -1.79 0.01 0.00 -1.51 0.00 0.00 72.50 69.04 2g0l s THR 65 CO 0.06 -0.74 -0.17 -0.44 -2.21 0.00 0.00 174.62 171.12 2g0l s SER 66 N -3.01 2.49 -0.09 8.08 0.01 -1.26 -1.62 113.70 118.29 2g0l s SER 66 Ca 0.15 -0.44 0.03 0.00 1.31 0.00 0.00 55.95 57.00 2g0l s SER 66 Cb 0.07 -1.13 -0.01 0.00 0.21 0.00 0.00 66.02 65.16 2g0l s SER 66 CO -0.04 0.06 -0.19 -0.76 0.41 0.00 0.00 173.24 172.72 2g0l s LEU 67 N 0.75 2.39 -0.65 2.44 2.01 -0.89 -4.65 118.68 120.07 2g0l s LEU 67 Ca -0.11 -0.41 -0.21 0.00 0.01 0.00 0.00 54.13 53.40 2g0l s LEU 67 Cb -0.16 -1.49 0.08 0.00 0.01 0.00 0.00 46.19 44.64 2g0l s LEU 67 CO 0.02 0.22 0.89 -0.89 1.01 0.00 0.00 176.35 177.60 2g0l s THR 68 N 0.02 4.48 -0.09 5.49 2.01 -1.26 -1.66 115.64 124.63 2g0l s THR 68 Ca -0.07 -0.59 -0.30 0.00 0.31 0.00 0.00 61.69 61.05 2g0l s THR 68 Cb -0.15 -4.63 -0.03 0.00 0.01 0.00 0.00 72.50 67.70 2g0l s THR 68 CO 0.05 -1.36 1.35 0.54 -0.69 0.00 0.00 174.62 174.50 2g0l s VAL 69 N 3.61 4.03 0.22 3.82 0.11 -1.20 -4.90 120.40 126.08 2g0l s VAL 69 Ca 0.19 1.31 0.06 0.00 -2.93 0.00 0.00 61.98 60.61 2g0l s VAL 69 Cb -0.19 -3.85 -0.04 0.00 -1.53 0.00 0.00 36.38 30.78 2g0l s VAL 69 CO 0.08 -0.07 0.22 -0.13 -3.33 0.00 0.00 175.10 171.88 2g0l s ARG 70 N 3.08 3.06 0.39 1.54 1.81 -1.26 -0.83 118.95 126.74 2g0l s ARG 70 Ca 0.60 -0.91 0.21 0.00 -1.72 0.00 0.00 55.73 53.91 2g0l s ARG 70 Cb -0.26 -2.68 0.40 0.00 -0.45 0.00 0.00 34.95 31.96 2g0l s ARG 70 CO 0.21 0.44 1.61 -0.09 -0.68 0.00 0.00 175.30 176.79 2g0l h ARG 71 N 1.73 0.00 -2.99 3.54 9.65 -1.95 -3.45 114.38 120.91 2g0l h ARG 71 Ca -0.49 0.00 -0.16 0.00 -1.10 0.00 0.00 59.98 58.23 2g0l h ARG 71 Cb 1.22 0.00 -0.26 0.00 -1.39 0.00 0.00 29.97 29.54 2g0l h ARG 71 CO 0.62 0.21 -0.39 -1.12 2.80 0.00 0.00 179.97 182.10 2g0l s SER 72 N -6.26 -0.31 0.22 -3.80 0.01 -1.26 0.40 113.70 102.69 2g0l s SER 72 Ca 0.05 0.60 -0.17 0.00 1.31 0.00 0.00 55.95 57.73 2g0l s SER 72 Cb 0.07 0.58 0.02 0.00 0.21 0.00 0.00 66.02 66.90 2g0l s SER 72 CO 0.68 -0.12 0.55 0.72 0.41 0.00 0.00 173.24 175.48 2g0l s PHE 73 N 0.46 -0.06 -0.01 2.43 -0.71 -0.48 -5.02 117.98 114.59 2g0l s PHE 73 Ca -0.03 -0.30 -0.29 0.00 -1.04 0.00 0.00 56.93 55.27 2g0l s PHE 73 Cb -0.04 0.42 -0.03 0.00 -1.21 0.00 0.00 43.02 42.15 2g0l s PHE 73 CO -0.02 -0.98 0.95 -1.21 -1.34 0.00 0.00 175.22 172.61 2g0l s GLU 74 N -3.90 4.55 -0.19 1.99 8.01 -1.26 0.01 118.70 127.90 2g0l s GLU 74 Ca 0.11 1.36 -0.21 0.00 0.01 0.00 0.00 54.97 56.24 2g0l s GLU 74 Cb -0.02 -3.46 -0.02 0.00 -4.31 0.00 0.00 34.13 26.32 2g0l s GLU 74 CO 0.00 -0.04 0.64 0.20 0.01 0.00 0.00 175.26 176.08 2g0l s GLY 75 N 0.99 2.06 -0.03 -1.39 0.00 0.16 -4.00 107.32 105.12 2g0l s GLY 75 Ca 0.50 -0.24 0.06 0.00 0.00 0.00 0.00 44.72 45.04 2g0l s GLY 75 CO 0.27 1.33 -0.19 -1.36 0.00 0.00 0.00 173.10 173.14 2g0l s PHE 76 N 1.90 1.80 0.89 1.90 0.40 0.22 -0.92 117.98 124.18 2g0l s PHE 76 Ca 0.29 -0.41 -0.13 0.00 -0.60 0.00 0.00 56.93 56.08 2g0l s PHE 76 Cb -0.16 -1.18 0.13 0.00 0.51 0.00 0.00 43.02 42.32 2g0l s PHE 76 CO 0.11 -0.08 1.19 -0.51 0.70 0.00 0.00 175.22 176.62 2g0l s LEU 77 N -0.30 2.30 0.27 -0.37 1.43 0.56 -1.34 118.68 121.23 2g0l s LEU 77 Ca 0.04 0.73 0.07 0.00 -1.03 0.00 0.00 54.13 53.93 2g0l s LEU 77 Cb -0.09 -3.04 0.36 0.00 0.03 0.00 0.00 46.19 43.45 2g0l s LEU 77 CO 0.00 -2.38 1.63 0.15 0.23 0.00 0.00 176.35 175.98 2g0l h PHE 78 N -1.38 0.21 -0.11 0.29 3.04 -1.90 -2.87 116.94 114.21 2g0l h PHE 78 Ca -0.47 -0.07 -0.10 0.00 3.98 0.00 0.00 57.97 61.30 2g0l h PHE 78 Cb 1.31 -0.04 -0.01 0.00 2.56 0.00 0.00 35.95 39.77 2g0l h PHE 78 CO -0.10 0.67 -0.40 0.38 -2.02 0.00 0.00 178.31 176.84 2g0l h ASP 79 N 0.13 0.24 0.00 0.41 2.03 -1.95 -3.47 116.42 113.82 2g0l h ASP 79 Ca 0.00 -0.10 0.00 0.00 -0.73 0.00 0.00 57.03 56.20 2g0l h ASP 79 Cb 1.00 -0.07 0.00 0.00 -0.83 0.00 0.00 39.33 39.43 2g0l h ASP 79 CO 0.08 0.62 0.00 0.61 -1.03 0.00 0.00 179.24 179.52 2g0l n GLY 80 N -0.22 1.59 3.77 7.15 0.00 -1.08 -5.12 105.19 111.28 2g0l n GLY 80 Ca -0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.62 2g0l n GLY 80 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2g0l s THR 81 N -0.98 3.22 0.50 2.61 2.01 -1.26 -4.68 115.64 117.07 2g0l s THR 81 Ca 0.00 1.07 -0.09 0.00 0.31 0.00 0.00 61.69 62.98 2g0l s THR 81 Cb 0.00 -3.61 -0.05 0.00 0.01 0.00 0.00 72.50 68.85 2g0l s THR 81 CO 0.00 0.13 0.87 0.00 -0.69 0.00 0.00 174.62 174.93 2g0l s ARG 82 N -2.14 3.65 -0.01 4.92 1.70 -1.26 -0.33 118.95 125.48 2g0l s ARG 82 Ca 0.54 0.48 0.01 0.00 -0.47 0.00 0.00 55.73 56.30 2g0l s ARG 82 Cb -0.31 -2.28 0.02 0.00 -0.57 0.00 0.00 34.95 31.82 2g0l s ARG 82 CO 0.39 -0.27 0.76 1.87 -1.08 0.00 0.00 175.30 176.97 2g0l n TRP 83 N -2.11 0.00 0.00 5.89 -0.00 -0.09 -4.85 117.44 116.28 2g0l n TRP 83 Ca 0.03 -0.21 0.00 0.00 -0.00 0.00 0.00 57.50 57.32 2g0l n TRP 83 Cb 0.54 -0.03 0.00 0.00 -0.00 0.00 0.00 31.31 31.82 2g0l n TRP 83 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 2g0l n GLY 84 N -0.25 -0.34 3.63 5.87 0.00 -1.24 -4.92 105.19 107.93 2g0l n GLY 84 Ca 0.01 -2.21 -0.35 0.00 0.00 0.00 0.00 46.02 43.48 2g0l n GLY 84 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2g0l s THR 85 N 0.00 4.78 -0.17 2.61 2.01 -1.26 0.38 115.64 123.99 2g0l s THR 85 Ca 0.00 -0.03 -0.09 0.00 0.31 0.00 0.00 61.69 61.88 2g0l s THR 85 Cb 0.00 -3.16 -0.05 0.00 0.01 0.00 0.00 72.50 69.31 2g0l s THR 85 CO 0.00 0.46 0.13 -0.69 -0.69 0.00 0.00 174.62 173.82 2g0l s VAL 86 N 0.41 5.38 -0.09 3.82 1.01 0.10 -4.85 120.40 126.18 2g0l s VAL 86 Ca 0.03 0.17 0.02 0.00 0.00 0.00 0.00 61.98 62.21 2g0l s VAL 86 Cb -0.12 -3.41 -0.02 0.00 0.00 0.00 0.00 36.38 32.83 2g0l s VAL 86 CO 0.00 0.51 -0.16 -0.62 0.00 0.00 0.00 175.10 174.84 2g0l s ASP 87 N -0.16 3.84 -0.18 3.32 2.15 -1.26 -1.39 116.67 123.00 2g0l s ASP 87 Ca 0.10 -0.32 0.16 0.00 0.43 0.00 0.00 52.55 52.92 2g0l s ASP 87 Cb -0.11 -1.27 0.42 0.00 -0.30 0.00 0.00 42.92 41.66 2g0l s ASP 87 CO 0.00 0.23 1.30 0.00 -0.17 0.00 0.00 175.17 176.54 2g0l h THR 89 N 0.92 0.89 0.00 0.00 2.02 -1.90 -3.40 112.91 111.43 2g0l h THR 89 Ca 0.03 -2.25 0.00 0.00 0.77 0.00 0.00 66.41 64.96 2g0l h THR 89 Cb 1.26 2.38 0.00 0.00 -1.74 0.00 0.00 68.15 70.05 2g0l h THR 89 CO 0.14 0.50 -0.85 1.07 0.37 0.00 0.00 175.52 176.75 2g0l n THR 90 N -4.16 0.00 -4.14 3.16 5.66 -1.26 -5.01 114.28 108.52 2g0l n THR 90 Ca -0.31 -0.24 -0.25 0.00 -3.05 0.00 0.00 64.05 60.20 2g0l n THR 90 Cb 0.78 0.77 -0.07 0.00 -1.55 0.00 0.00 70.33 70.27 2g0l n THR 90 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2g0l s ALA 91 N -2.33 3.72 1.00 1.79 0.00 -1.25 -5.13 121.76 119.55 2g0l s ALA 91 Ca 0.02 -1.89 -0.13 0.00 0.00 0.00 0.00 51.96 49.96 2g0l s ALA 91 Cb 0.09 -0.39 0.19 0.00 0.00 0.00 0.00 23.12 23.00 2g0l s ALA 91 CO 0.49 -0.19 1.12 0.00 0.00 0.00 0.00 175.76 177.18 2g0l s ALA 92 N -2.64 1.18 0.04 0.00 0.00 -1.26 -4.43 121.76 114.65 2g0l s ALA 92 Ca 0.38 -0.52 -0.12 0.00 0.00 0.00 0.00 51.96 51.70 2g0l s ALA 92 Cb 0.03 -3.05 0.01 0.00 0.00 0.00 0.00 23.12 20.11 2g0l s ALA 92 CO 0.21 -2.76 0.26 0.00 0.00 0.00 0.00 175.76 173.47 2g0l s GLN 94 N -2.62 1.84 -0.09 0.00 0.00 -1.26 -1.52 119.66 116.00 2g0l s GLN 94 Ca -0.05 -1.15 0.04 0.00 -0.00 0.00 0.00 55.36 54.21 2g0l s GLN 94 Cb -0.01 0.58 -0.00 0.00 0.00 0.00 0.00 33.01 33.59 2g0l s GLN 94 CO -0.04 -0.83 -0.23 0.08 0.00 0.00 0.00 175.29 174.27 2g0l s VAL 95 N -3.60 1.93 0.09 3.63 1.01 -0.21 -3.41 120.40 119.83 2g0l s VAL 95 Ca 0.15 -0.95 0.08 0.00 0.00 0.00 0.00 61.98 61.25 2g0l s VAL 95 Cb -0.05 -1.67 -0.04 0.00 0.00 0.00 0.00 36.38 34.63 2g0l s VAL 95 CO 0.09 0.53 -0.17 -0.83 0.00 0.00 0.00 175.10 174.72 2g0l s GLY 96 N 0.29 1.67 -0.17 4.51 0.00 0.43 -1.72 107.32 112.34 2g0l s GLY 96 Ca -0.16 -1.29 -0.04 0.00 0.00 0.00 0.00 44.72 43.23 2g0l s GLY 96 CO 0.07 -1.25 0.25 0.48 0.00 0.00 0.00 173.10 172.66 2g0l s LEU 97 N -1.95 -0.24 0.15 0.66 2.34 -1.26 -1.63 118.68 116.75 2g0l s LEU 97 Ca 0.17 0.21 -0.03 0.00 0.06 0.00 0.00 54.13 54.54 2g0l s LEU 97 Cb -0.11 0.58 -0.03 0.00 -0.56 0.00 0.00 46.19 46.07 2g0l s LEU 97 CO 0.09 -0.28 0.13 -0.44 -1.06 0.00 0.00 176.35 174.79 2g0l s SER 98 N 2.38 0.22 1.21 1.48 0.01 -0.62 -4.29 113.70 114.08 2g0l s SER 98 Ca 0.05 -1.13 -0.19 0.00 1.31 0.00 0.00 55.95 55.99 2g0l s SER 98 Cb -0.14 0.35 0.28 0.00 0.21 0.00 0.00 66.02 66.72 2g0l s SER 98 CO -0.10 -0.79 1.06 -0.90 0.41 0.00 0.00 173.24 172.91 2g0l n ASP 99 N -0.14 -1.81 0.05 2.44 5.75 0.12 0.51 116.55 123.47 2g0l n ASP 99 Ca -0.05 -1.17 0.16 0.00 -0.01 0.00 0.00 54.79 53.72 2g0l n ASP 99 Cb 0.64 -0.95 0.65 0.00 -1.03 0.00 0.00 41.12 40.42 2g0l n ASP 99 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2g0l h ALA 100 N -2.61 2.31 0.00 2.12 0.00 -1.68 -2.82 119.26 116.58 2g0l h ALA 100 Ca -0.39 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.46 2g0l h ALA 100 Cb 1.18 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 2g0l h ALA 100 CO 0.26 -0.43 -0.30 0.00 0.00 0.00 0.00 179.25 178.78 2g0l h ALA 101 N 1.79 0.06 0.00 0.00 0.00 -1.90 -3.49 119.26 115.71 2g0l h ALA 101 Ca 0.20 -0.57 0.00 0.00 0.00 0.00 0.00 54.91 54.54 2g0l h ALA 101 Cb 0.71 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.69 2g0l h ALA 101 CO -0.01 0.18 0.00 0.41 0.00 0.00 0.00 179.25 179.83 2g0l n GLY 102 N 1.60 0.00 3.57 0.00 0.00 -1.06 -5.02 105.19 104.28 2g0l n GLY 102 Ca -0.13 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.64 2g0l n GLY 102 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2g0l s ASN 103 N 0.00 3.88 0.00 1.61 0.01 -1.26 -4.80 114.94 114.38 2g0l s ASN 103 Ca 0.00 -1.14 0.00 0.00 -0.71 0.00 0.00 52.86 51.01 2g0l s ASN 103 Cb 0.00 -0.41 0.00 0.00 0.41 0.00 0.00 41.25 41.25 2g0l s ASN 103 CO 0.00 -0.23 0.00 0.61 -1.51 0.00 0.00 177.10 175.97 2g0l n GLY 104 N -0.85 0.88 3.76 0.66 0.00 -1.26 0.15 105.19 108.52 2g0l n GLY 104 Ca -0.05 -1.83 -0.33 0.00 0.00 0.00 0.00 46.02 43.81 2g0l n GLY 104 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2g0l s PRO 105 N -2.00 2.69 0.47 1.61 0.02 -1.26 -4.99 135.00 131.54 2g0l s PRO 105 Ca 0.00 1.45 -0.23 0.00 0.02 0.00 0.00 61.00 62.24 2g0l s PRO 105 Cb 0.00 -1.93 -0.07 0.00 0.02 0.00 0.00 34.50 32.52 2g0l s PRO 105 CO 0.00 -1.35 1.24 -1.21 -0.33 0.00 0.00 177.00 175.35 2g0l s GLU 106 N -4.06 3.64 0.96 5.54 2.02 -1.26 -4.74 118.70 120.80 2g0l s GLU 106 Ca 0.68 1.96 -0.11 0.00 0.02 0.00 0.00 54.97 57.52 2g0l s GLU 106 Cb -0.22 -2.44 0.17 0.00 0.10 0.00 0.00 34.13 31.74 2g0l s GLU 106 CO 0.42 -0.70 1.09 0.20 0.02 0.00 0.00 175.26 176.28 2g0l s GLY 107 N -1.14 1.62 -0.16 -1.39 0.00 -1.26 -4.92 107.32 100.08 2g0l s GLY 107 Ca 0.64 0.11 0.01 0.00 0.00 0.00 0.00 44.72 45.48 2g0l s GLY 107 CO 0.41 0.62 -0.18 0.14 0.00 0.00 0.00 173.10 174.09 2g0l s VAL 108 N -2.74 1.87 0.29 1.40 1.01 -0.70 -5.00 120.40 116.52 2g0l s VAL 108 Ca 0.65 -0.83 -0.27 0.00 0.00 0.00 0.00 61.98 61.53 2g0l s VAL 108 Cb -0.21 -1.70 -0.09 0.00 0.00 0.00 0.00 36.38 34.38 2g0l s VAL 108 CO 0.59 0.51 0.92 0.00 0.00 0.00 0.00 175.10 177.12 2g0l s ALA 109 N 1.21 3.27 0.30 5.51 0.00 -1.26 -1.05 121.76 129.74 2g0l s ALA 109 Ca 0.01 0.52 0.03 0.00 0.00 0.00 0.00 51.96 52.52 2g0l s ALA 109 Cb -0.14 -3.16 -0.06 0.00 0.00 0.00 0.00 23.12 19.77 2g0l s ALA 109 CO -0.09 0.20 0.05 0.96 0.00 0.00 0.00 175.76 176.88 2g0l s ILE 110 N -1.47 1.05 -0.06 0.00 -4.36 -0.58 -4.90 121.20 110.88 2g0l s ILE 110 Ca 0.47 -2.01 -0.05 0.00 -0.26 0.00 0.00 60.65 58.79 2g0l s ILE 110 Cb -0.21 -2.68 0.02 0.00 1.25 0.00 0.00 42.46 40.84 2g0l s ILE 110 CO 0.26 -0.06 0.16 -0.44 0.24 0.00 0.00 174.94 175.10 2g0l s SER 111 N -3.42 -0.17 0.22 4.36 0.01 -1.26 -4.05 113.70 109.38 2g0l s SER 111 Ca 0.35 0.33 -0.04 0.00 1.31 0.00 0.00 55.95 57.90 2g0l s SER 111 Cb 0.08 0.32 -0.05 0.00 0.21 0.00 0.00 66.02 66.58 2g0l s SER 111 CO 0.14 -0.06 0.46 -0.36 0.41 0.00 0.00 173.24 173.82 2g0l s PHE 112 N 0.15 3.47 -2.00 2.43 0.08 -1.26 -0.00 117.98 120.85 2g0l s PHE 112 Ca -0.01 0.56 0.21 0.00 0.12 0.00 0.00 56.93 57.81 2g0l s PHE 112 Cb -0.02 -2.02 1.24 0.00 -0.57 0.00 0.00 43.02 41.65 2g0l s PHE 112 CO -0.00 0.32 1.62 0.27 -0.10 0.00 0.00 175.22 177.33