#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 3.62 0.93 0.00 0.00 -1.26 -5.06 121.76 119.99 2g0l s ALA 2 Ca 0.00 -0.18 -0.15 0.00 0.00 0.00 0.00 51.96 51.63 2g0l s ALA 2 Cb 0.00 -3.20 0.18 0.00 0.00 0.00 0.00 23.12 20.10 2g0l s ALA 2 CO 0.00 -0.84 1.29 -1.25 0.00 0.00 0.00 175.76 174.97 2g0l s PRO 3 N 2.61 0.85 -0.38 0.00 0.04 -1.26 -4.97 135.00 131.89 2g0l s PRO 3 Ca 0.33 -0.36 0.01 0.00 0.04 0.00 0.00 61.00 61.01 2g0l s PRO 3 Cb -0.16 -1.88 0.13 0.00 0.04 0.00 0.00 34.50 32.64 2g0l s PRO 3 CO 0.08 -2.28 0.21 0.99 0.04 0.00 0.00 177.00 176.04 2g0l s THR 4 N -3.83 0.68 -0.78 1.26 2.01 0.12 -5.00 115.64 110.11 2g0l s THR 4 Ca 0.72 -1.95 -0.17 0.00 0.31 0.00 0.00 61.69 60.60 2g0l s THR 4 Cb -0.05 -1.49 0.15 0.00 0.01 0.00 0.00 72.50 71.11 2g0l s THR 4 CO 0.52 -0.91 0.87 0.00 -0.69 0.00 0.00 174.62 174.42 2g0l s ALA 5 N 0.91 3.59 -0.56 7.40 0.00 -1.26 -0.28 121.76 131.55 2g0l s ALA 5 Ca 0.17 -2.73 -0.16 0.00 0.00 0.00 0.00 51.96 49.23 2g0l s ALA 5 Cb -0.23 -3.71 0.13 0.00 0.00 0.00 0.00 23.12 19.31 2g0l s ALA 5 CO -0.04 -2.55 0.55 0.95 0.00 0.00 0.00 175.76 174.67 2g0l s THR 6 N 1.96 5.17 0.02 0.00 -4.23 -0.52 -5.01 115.64 113.03 2g0l s THR 6 Ca 0.21 -1.47 0.08 0.00 -1.18 0.00 0.00 61.69 59.33 2g0l s THR 6 Cb -0.13 -4.37 -0.03 0.00 1.34 0.00 0.00 72.50 69.31 2g0l s THR 6 CO -0.04 -0.92 -0.25 0.68 -0.54 0.00 0.00 174.62 173.56 2g0l s VAL 7 N 1.70 2.25 -0.65 2.29 -7.23 -1.26 -1.42 120.40 116.07 2g0l s VAL 7 Ca 0.05 -1.26 -0.04 0.00 -1.81 0.00 0.00 61.98 58.92 2g0l s VAL 7 Cb -0.28 -1.86 0.17 0.00 0.56 0.00 0.00 36.38 34.96 2g0l s VAL 7 CO 0.03 0.43 0.48 -0.89 -0.31 0.00 0.00 175.10 174.84 2g0l s THR 8 N -0.77 3.92 0.47 5.32 2.01 0.08 -5.02 115.64 121.66 2g0l s THR 8 Ca 0.12 -2.93 -0.23 0.00 0.31 0.00 0.00 61.69 58.95 2g0l s THR 8 Cb -0.10 -3.54 -0.07 0.00 0.01 0.00 0.00 72.50 68.80 2g0l s THR 8 CO 0.02 -0.90 1.20 -2.16 -0.69 0.00 0.00 174.62 172.09 2g0l s PRO 9 N -0.07 3.68 -0.49 4.92 0.04 -1.26 -3.48 135.00 138.32 2g0l s PRO 9 Ca 0.17 1.86 -0.06 0.00 0.04 0.00 0.00 61.00 63.01 2g0l s PRO 9 Cb -0.19 -2.40 -0.13 0.00 0.04 0.00 0.00 34.50 31.82 2g0l s PRO 9 CO -0.04 -0.64 3.21 -1.13 0.04 0.00 0.00 177.00 178.44 2g0l n SER 10 N -0.53 6.37 -4.63 6.66 3.41 -1.26 -4.92 113.62 118.71 2g0l n SER 10 Ca 0.08 -2.72 -0.43 0.00 -0.26 0.00 0.00 58.87 55.53 2g0l n SER 10 Cb 0.47 -1.39 -0.02 0.00 -0.26 0.00 0.00 64.21 63.01 2g0l n SER 10 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2g0l s SER 11 N 1.50 6.53 0.00 4.04 0.01 -1.26 -2.71 113.70 121.82 2g0l s SER 11 Ca 0.65 1.35 0.00 0.00 1.31 0.00 0.00 55.95 59.25 2g0l s SER 11 Cb 0.30 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.99 2g0l s SER 11 CO -0.07 -1.17 0.00 0.61 0.41 0.00 0.00 173.24 173.02 2g0l n GLY 12 N 4.50 0.77 3.98 3.44 0.00 -0.31 -5.00 105.19 112.56 2g0l n GLY 12 Ca 0.16 -0.02 -0.22 0.00 0.00 0.00 0.00 46.02 45.95 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 3.06 0.00 0.99 1.43 -1.10 -4.32 118.68 118.74 2g0l s LEU 13 Ca 0.00 -0.92 0.01 0.00 -1.03 0.00 0.00 54.13 52.18 2g0l s LEU 13 Cb 0.00 -1.63 0.08 0.00 0.03 0.00 0.00 46.19 44.67 2g0l s LEU 13 CO 0.00 -1.15 0.58 -1.20 0.23 0.00 0.00 176.35 174.81 2g0l n SER 14 N -1.99 0.85 -4.81 2.29 7.64 -1.26 -2.49 113.62 113.85 2g0l n SER 14 Ca 0.08 -1.70 -0.33 0.00 1.01 0.00 0.00 58.87 57.93 2g0l n SER 14 Cb 0.62 -0.37 -0.02 0.00 -1.01 0.00 0.00 64.21 63.43 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 -3.38 6.26 0.00 6.43 -4.77 -1.26 -3.62 116.67 116.33 2g0l s ASP 15 Ca 0.39 1.80 0.00 0.00 -3.30 0.00 0.00 52.55 51.44 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 0.26 -0.84 0.00 0.61 0.70 0.00 0.00 175.17 175.90 2g0l n GLY 16 N -0.78 0.65 3.76 2.12 0.00 0.14 -4.98 105.19 106.10 2g0l n GLY 16 Ca 0.08 -0.06 -0.39 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.00 3.98 -0.49 2.61 2.01 -1.23 -4.75 115.64 115.78 2g0l s THR 17 Ca 0.00 1.92 -0.22 0.00 0.31 0.00 0.00 61.69 63.70 2g0l s THR 17 Cb 0.00 -4.19 0.04 0.00 0.01 0.00 0.00 72.50 68.36 2g0l s THR 17 CO 0.00 0.40 0.76 -0.69 -0.69 0.00 0.00 174.62 174.40 2g0l s VAL 18 N -1.27 4.67 -0.20 3.82 1.01 -1.26 -1.64 120.40 125.54 2g0l s VAL 18 Ca 0.44 0.11 -0.25 0.00 0.00 0.00 0.00 61.98 62.28 2g0l s VAL 18 Cb -0.26 -4.35 -0.01 0.00 0.00 0.00 0.00 36.38 31.77 2g0l s VAL 18 CO 0.32 -0.81 0.84 -0.69 0.00 0.00 0.00 175.10 174.76 2g0l s VAL 19 N 3.20 4.85 -0.20 2.92 1.01 0.22 -4.82 120.40 127.59 2g0l s VAL 19 Ca 0.25 1.63 -0.19 0.00 0.00 0.00 0.00 61.98 63.67 2g0l s VAL 19 Cb -0.14 -4.14 -0.03 0.00 0.00 0.00 0.00 36.38 32.07 2g0l s VAL 19 CO 0.19 -0.02 0.55 -0.75 0.00 0.00 0.00 175.10 175.06 2g0l s LYS 20 N 2.46 4.20 -0.25 2.72 2.20 -1.23 -0.23 119.74 129.61 2g0l s LYS 20 Ca 0.37 0.47 0.03 0.00 -0.36 0.00 0.00 55.97 56.48 2g0l s LYS 20 Cb -0.16 -3.57 0.06 0.00 -1.51 0.00 0.00 37.83 32.65 2g0l s LYS 20 CO 0.10 -0.17 -0.11 0.08 -0.36 0.00 0.00 175.35 174.89 2g0l s VAL 21 N 1.70 2.12 -0.30 4.02 1.01 0.63 -0.74 120.40 128.84 2g0l s VAL 21 Ca 0.25 -1.57 0.02 0.00 0.00 0.00 0.00 61.98 60.68 2g0l s VAL 21 Cb -0.16 -2.22 0.08 0.00 0.00 0.00 0.00 36.38 34.08 2g0l s VAL 21 CO 0.10 0.00 0.01 0.00 0.00 0.00 0.00 175.10 175.21 2g0l s ALA 22 N 1.13 2.40 -0.23 5.51 0.00 -0.51 -0.11 121.76 129.94 2g0l s ALA 22 Ca -0.08 -1.99 -0.08 0.00 0.00 0.00 0.00 51.96 49.81 2g0l s ALA 22 Cb -0.19 -1.72 -0.04 0.00 0.00 0.00 0.00 23.12 21.16 2g0l s ALA 22 CO -0.06 -1.49 0.10 0.20 0.00 0.00 0.00 175.76 174.52 2g0l s GLY 23 N 1.17 1.87 0.15 0.00 0.00 0.57 -1.43 107.32 109.64 2g0l s GLY 23 Ca 0.04 -0.96 0.09 0.00 0.00 0.00 0.00 44.72 43.89 2g0l s GLY 23 CO -0.10 0.37 -0.14 0.00 0.00 0.00 0.00 173.10 173.23 2g0l s ALA 24 N 1.14 2.81 0.00 3.20 0.00 0.62 -0.36 121.76 129.16 2g0l s ALA 24 Ca 0.05 -1.41 0.00 0.00 0.00 0.00 0.00 51.96 50.60 2g0l s ALA 24 Cb -0.14 -0.69 0.00 0.00 0.00 0.00 0.00 23.12 22.29 2g0l s ALA 24 CO 0.04 0.54 0.00 0.41 0.00 0.00 0.00 175.76 176.75 2g0l n GLY 25 N 0.44 0.68 0.00 0.00 0.00 -0.84 -0.70 105.19 104.76 2g0l n GLY 25 Ca -0.13 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.14 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 -0.19 0.00 -4.42 0.99 4.77 0.12 -4.70 117.00 113.57 2g0l n LEU 26 Ca 0.00 0.00 -0.38 0.00 -0.03 0.00 0.00 56.01 55.60 2g0l n LEU 26 Cb 0.46 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.43 2g0l n LEU 26 CO 0.00 -0.02 -0.24 -1.58 -1.33 0.00 0.00 177.39 174.22 2g0l s GLN 27 N 2.80 3.37 0.11 3.23 2.00 -1.26 -4.69 119.66 125.22 2g0l s GLN 27 Ca 0.00 -0.68 -0.31 0.00 -2.00 0.00 0.00 55.36 52.37 2g0l s GLN 27 Cb 0.00 -3.45 -0.09 0.00 0.80 0.00 0.00 33.01 30.27 2g0l s GLN 27 CO 0.00 -0.36 1.72 0.00 -0.50 0.00 0.00 175.29 176.15 2g0l s ALA 28 N 1.59 3.74 0.00 1.58 0.00 -1.26 -1.89 121.76 125.52 2g0l s ALA 28 Ca 0.05 1.34 0.00 0.00 0.00 0.00 0.00 51.96 53.35 2g0l s ALA 28 Cb -0.16 -3.72 0.00 0.00 0.00 0.00 0.00 23.12 19.24 2g0l s ALA 28 CO 0.05 -1.11 0.00 0.41 0.00 0.00 0.00 175.76 175.10 2g0l n GLY 29 N 4.07 0.69 3.69 0.00 0.00 -0.42 -5.01 105.19 108.21 2g0l n GLY 29 Ca 0.16 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.83 2g0l n GLY 29 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2g0l s THR 30 N -2.14 4.89 -0.15 2.61 2.01 -0.79 -4.90 115.64 117.17 2g0l s THR 30 Ca 0.00 -0.01 -0.18 0.00 0.31 0.00 0.00 61.69 61.81 2g0l s THR 30 Cb 0.00 -3.17 -0.04 0.00 0.01 0.00 0.00 72.50 69.30 2g0l s THR 30 CO 0.00 0.51 0.48 0.00 -0.69 0.00 0.00 174.62 174.92 2g0l s ALA 31 N -0.09 3.51 -0.17 7.40 0.00 -1.26 -0.80 121.76 130.34 2g0l s ALA 31 Ca 0.07 -0.29 -0.05 0.00 0.00 0.00 0.00 51.96 51.69 2g0l s ALA 31 Cb -0.12 -2.70 -0.03 0.00 0.00 0.00 0.00 23.12 20.27 2g0l s ALA 31 CO 0.01 -0.17 -0.00 0.71 0.00 0.00 0.00 175.76 176.31 2g0l s TYR 32 N 1.02 3.09 -0.29 0.00 1.51 0.19 -2.83 117.35 120.04 2g0l s TYR 32 Ca 0.25 -0.20 -0.18 0.00 -1.01 0.00 0.00 57.07 55.92 2g0l s TYR 32 Cb -0.15 -2.01 -0.02 0.00 -0.11 0.00 0.00 41.96 39.67 2g0l s TYR 32 CO 0.10 -0.00 0.52 0.34 -1.11 0.00 0.00 175.55 175.39 2g0l s ASP 33 N 0.44 6.39 -0.14 2.29 -1.08 0.17 -1.32 116.67 123.43 2g0l s ASP 33 Ca -0.01 0.34 0.00 0.00 -0.52 0.00 0.00 52.55 52.36 2g0l s ASP 33 Cb -0.14 -2.28 0.02 0.00 -1.46 0.00 0.00 42.92 39.07 2g0l s ASP 33 CO 0.02 -0.36 -0.13 -0.69 0.52 0.00 0.00 175.17 174.54 2g0l s VAL 34 N 2.35 1.42 0.24 1.11 1.01 -1.24 -1.50 120.40 123.79 2g0l s VAL 34 Ca 0.20 -0.54 -0.10 0.00 0.00 0.00 0.00 61.98 61.54 2g0l s VAL 34 Cb -0.15 -1.35 -0.01 0.00 0.00 0.00 0.00 36.38 34.86 2g0l s VAL 34 CO 0.11 0.43 0.40 -0.83 0.00 0.00 0.00 175.10 175.22 2g0l s GLY 35 N 1.50 0.71 -0.13 4.51 0.00 -0.36 -2.52 107.32 111.04 2g0l s GLY 35 Ca 0.04 -1.04 -0.22 0.00 0.00 0.00 0.00 44.72 43.50 2g0l s GLY 35 CO -0.09 -0.78 0.64 -0.86 0.00 0.00 0.00 173.10 172.00 2g0l s GLN 36 N -4.04 4.33 0.34 2.90 -2.07 -1.26 -0.95 119.66 118.91 2g0l s GLN 36 Ca 0.26 0.71 0.03 0.00 -1.82 0.00 0.00 55.36 54.53 2g0l s GLN 36 Cb 0.01 -3.50 -0.01 0.00 -1.09 0.00 0.00 33.01 28.42 2g0l s GLN 36 CO 0.09 -0.04 0.11 0.00 -1.32 0.00 0.00 175.29 174.13 2g0l s ALA 38 N -2.89 -1.82 -0.34 0.00 0.00 -1.14 0.48 121.76 116.05 2g0l s ALA 38 Ca 0.15 1.19 -0.28 0.00 0.00 0.00 0.00 51.96 53.02 2g0l s ALA 38 Cb 0.01 0.04 -0.04 0.00 0.00 0.00 0.00 23.12 23.13 2g0l s ALA 38 CO 0.11 -0.51 2.06 -0.46 0.00 0.00 0.00 175.76 176.95 2g0l s TRP 39 N -2.18 1.44 -0.24 0.00 -0.00 -1.26 -3.12 118.94 113.57 2g0l s TRP 39 Ca -0.01 0.75 0.05 0.00 -0.00 0.00 0.00 56.10 56.89 2g0l s TRP 39 Cb -0.01 -3.97 -0.18 0.00 -0.00 0.00 0.00 33.47 29.32 2g0l s TRP 39 CO -0.02 -3.26 -0.17 1.55 -0.00 0.00 0.00 176.95 175.04 2g0l n VAL 40 N 7.62 1.43 -4.25 5.86 3.14 -0.82 -5.01 118.33 126.30 2g0l n VAL 40 Ca 0.27 -0.61 -0.14 0.00 -2.96 0.00 0.00 64.34 60.91 2g0l n VAL 40 Cb 0.48 -1.23 -0.10 0.00 -1.06 0.00 0.00 33.84 31.93 2g0l n VAL 40 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 2g0l s ASP 41 N -6.27 0.71 -0.67 6.55 2.15 -0.52 -5.02 116.67 113.61 2g0l s ASP 41 Ca -0.30 -1.35 -0.26 0.00 0.43 0.00 0.00 52.55 51.07 2g0l s ASP 41 Cb 0.08 0.25 -0.11 0.00 -0.30 0.00 0.00 42.92 42.84 2g0l s ASP 41 CO 0.62 -0.76 2.42 0.41 -0.17 0.00 0.00 175.17 177.70 2g0l n THR 42 N -0.34 -0.04 -0.41 1.71 -1.04 -1.26 -1.24 114.28 111.66 2g0l n THR 42 Ca -0.00 -0.62 0.00 0.00 -2.04 0.00 0.00 64.05 61.38 2g0l n THR 42 Cb 0.66 -2.32 0.00 0.00 -1.82 0.00 0.00 70.33 66.85 2g0l n THR 42 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2g0l n GLY 43 N 6.49 0.72 3.22 3.41 0.00 -1.26 -5.05 105.19 112.71 2g0l n GLY 43 Ca 0.43 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.15 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 -2.69 1.84 0.34 1.61 1.01 -0.38 -5.10 120.40 117.03 2g0l s VAL 44 Ca 0.00 -0.94 0.04 0.00 0.00 0.00 0.00 61.98 61.08 2g0l s VAL 44 Cb 0.00 -1.57 -0.06 0.00 0.00 0.00 0.00 36.38 34.75 2g0l s VAL 44 CO 0.00 0.52 0.06 -0.76 0.00 0.00 0.00 175.10 174.91 2g0l s LEU 45 N -0.03 2.21 -0.16 3.92 1.02 -1.26 -1.44 118.68 122.95 2g0l s LEU 45 Ca -0.05 -1.40 -0.13 0.00 0.02 0.00 0.00 54.13 52.56 2g0l s LEU 45 Cb -0.14 -0.40 0.04 0.00 0.02 0.00 0.00 46.19 45.72 2g0l s LEU 45 CO 0.04 -0.63 0.41 0.00 0.02 0.00 0.00 176.35 176.19 2g0l s ALA 46 N -3.25 -1.02 0.43 4.21 0.00 -1.18 -4.75 121.76 116.21 2g0l s ALA 46 Ca 0.35 1.22 0.07 0.00 0.00 0.00 0.00 51.96 53.60 2g0l s ALA 46 Cb 0.08 -0.71 -0.03 0.00 0.00 0.00 0.00 23.12 22.46 2g0l s ALA 46 CO 0.15 -0.21 0.28 0.00 0.00 0.00 0.00 175.76 175.99 2g0l s ASN 48 N -4.04 7.11 0.00 0.00 4.22 -0.85 -0.13 114.94 121.25 2g0l s ASN 48 Ca 0.42 1.32 0.26 0.00 -2.14 0.00 0.00 52.86 52.72 2g0l s ASN 48 Cb 0.00 -2.41 0.64 0.00 1.28 0.00 0.00 41.25 40.76 2g0l s ASN 48 CO 0.24 0.12 1.51 -0.81 -2.04 0.00 0.00 177.10 176.11 2g0l n PRO 49 N 2.44 1.72 -0.01 3.55 -0.04 -1.26 -4.32 135.00 137.08 2g0l n PRO 49 Ca -0.06 -1.21 -0.01 0.00 -0.04 0.00 0.00 63.50 62.18 2g0l n PRO 49 Cb 0.50 -1.47 -0.00 0.00 -0.04 0.00 0.00 33.50 32.49 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 0.42 0.35 -0.72 0.55 0.00 -1.26 -4.61 120.51 115.24 2g0l n ALA 50 Ca 0.16 -0.27 -0.06 0.00 0.00 0.00 0.00 53.44 53.27 2g0l n ALA 50 Cb 0.44 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.82 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 -2.65 5.21 -4.79 0.00 9.92 -1.26 -4.83 116.55 118.14 2g0l n ASP 51 Ca -0.01 -2.42 -0.24 0.00 -0.53 0.00 0.00 54.79 51.59 2g0l n ASP 51 Cb 0.04 -1.24 -0.06 0.00 -0.64 0.00 0.00 41.12 39.22 2g0l n ASP 51 CO 0.00 0.00 0.00 0.72 0.13 0.00 0.00 177.20 178.05 2g0l s PHE 52 N 0.50 2.55 -0.22 1.24 -0.71 -1.26 -4.41 117.98 115.67 2g0l s PHE 52 Ca 0.31 -0.58 -0.03 0.00 -1.04 0.00 0.00 56.93 55.58 2g0l s PHE 52 Cb 0.15 -2.02 0.11 0.00 -1.21 0.00 0.00 43.02 40.05 2g0l s PHE 52 CO 0.00 0.04 0.31 -1.12 -1.34 0.00 0.00 175.22 173.11 2g0l s SER 53 N -4.00 0.66 0.08 1.98 0.01 -1.05 -5.07 113.70 106.32 2g0l s SER 53 Ca 0.42 0.09 -0.28 0.00 1.31 0.00 0.00 55.95 57.49 2g0l s SER 53 Cb 0.01 0.83 -0.06 0.00 0.21 0.00 0.00 66.02 67.01 2g0l s SER 53 CO 0.24 -0.31 0.87 -0.44 0.41 0.00 0.00 173.24 174.02 2g0l s SER 54 N 2.46 7.37 -0.03 2.44 0.01 -1.26 -3.72 113.70 120.96 2g0l s SER 54 Ca 0.10 1.64 0.05 0.00 1.31 0.00 0.00 55.95 59.04 2g0l s SER 54 Cb -0.15 -2.53 -0.01 0.00 0.21 0.00 0.00 66.02 63.53 2g0l s SER 54 CO -0.14 -0.03 -0.18 0.54 0.41 0.00 0.00 173.24 173.84 2g0l s VAL 55 N -0.00 1.46 -0.15 3.43 0.11 -0.43 -4.97 120.40 119.84 2g0l s VAL 55 Ca 0.43 -0.76 -0.06 0.00 -2.93 0.00 0.00 61.98 58.66 2g0l s VAL 55 Cb -0.22 -1.23 -0.04 0.00 -1.53 0.00 0.00 36.38 33.36 2g0l s VAL 55 CO 0.27 0.42 0.06 0.28 -3.33 0.00 0.00 175.10 172.80 2g0l s THR 56 N -0.19 4.82 -0.00 5.04 -1.32 -1.26 0.54 115.64 123.26 2g0l s THR 56 Ca 0.01 -0.04 -0.30 0.00 -1.21 0.00 0.00 61.69 60.16 2g0l s THR 56 Cb -0.09 -3.13 -0.06 0.00 -1.51 0.00 0.00 72.50 67.71 2g0l s THR 56 CO 0.01 0.52 1.48 0.00 -2.21 0.00 0.00 174.62 174.42 2g0l s ALA 57 N -0.14 3.61 1.19 11.08 0.00 0.02 -4.72 121.76 132.79 2g0l s ALA 57 Ca 0.07 0.94 -0.15 0.00 0.00 0.00 0.00 51.96 52.82 2g0l s ALA 57 Cb -0.12 -3.64 0.23 0.00 0.00 0.00 0.00 23.12 19.59 2g0l s ALA 57 CO 0.01 -1.04 0.81 -0.40 0.00 0.00 0.00 175.76 175.14 2g0l n ASP 58 N 5.73 -1.82 0.23 0.00 5.75 -0.86 -1.30 116.55 124.28 2g0l n ASP 58 Ca 0.14 -0.99 0.15 0.00 -0.01 0.00 0.00 54.79 54.08 2g0l n ASP 58 Cb 0.43 -0.74 0.81 0.00 -1.03 0.00 0.00 41.12 40.59 2g0l n ASP 58 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2g0l h ALA 59 N -2.55 1.80 -0.00 2.12 0.00 -1.94 0.26 119.26 118.95 2g0l h ALA 59 Ca -0.30 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.60 2g0l h ALA 59 Cb 0.93 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.73 2g0l h ALA 59 CO 0.20 -0.16 -0.03 0.09 0.00 0.00 0.00 179.25 179.35 2g0l n ASN 60 N -4.02 0.08 -1.33 0.00 3.02 -1.26 -4.84 115.26 106.92 2g0l n ASN 60 Ca -0.00 -0.06 -0.06 0.00 -0.03 0.00 0.00 54.58 54.43 2g0l n ASN 60 Cb 0.21 -0.29 0.02 0.00 -0.61 0.00 0.00 39.78 39.11 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 1.34 0.54 3.04 7.41 0.00 0.93 -4.66 105.19 113.79 2g0l n GLY 61 Ca 0.12 -0.43 -0.20 0.00 0.00 0.00 0.00 46.02 45.52 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 -3.11 1.24 -0.12 1.61 1.04 -1.26 0.12 113.70 113.22 2g0l s SER 62 Ca 0.14 -0.19 -0.01 0.00 0.48 0.00 0.00 55.95 56.36 2g0l s SER 62 Cb -0.06 -0.17 0.04 0.00 0.10 0.00 0.00 66.02 65.92 2g0l s SER 62 CO 0.19 0.12 -0.02 0.00 0.98 0.00 0.00 173.24 174.50 2g0l s ALA 63 N -0.17 1.09 -0.06 5.32 0.00 0.51 -2.03 121.76 126.42 2g0l s ALA 63 Ca 0.03 -0.49 0.06 0.00 0.00 0.00 0.00 51.96 51.55 2g0l s ALA 63 Cb -0.05 -0.95 -0.01 0.00 0.00 0.00 0.00 23.12 22.11 2g0l s ALA 63 CO -0.00 -0.65 -0.24 -1.12 0.00 0.00 0.00 175.76 173.75 2g0l s SER 64 N 1.81 2.94 0.23 0.00 0.01 -1.26 -0.32 113.70 117.11 2g0l s SER 64 Ca 0.03 -0.50 -0.12 0.00 1.31 0.00 0.00 55.95 56.67 2g0l s SER 64 Cb -0.14 -0.89 -0.00 0.00 0.21 0.00 0.00 66.02 65.20 2g0l s SER 64 CO -0.07 0.22 0.45 0.28 0.41 0.00 0.00 173.24 174.53 2g0l s THR 65 N -0.06 0.01 -0.08 1.44 -1.32 0.84 -4.97 115.64 111.50 2g0l s THR 65 Ca -0.06 -1.35 0.02 0.00 -1.21 0.00 0.00 61.69 59.09 2g0l s THR 65 Cb -0.14 -2.09 0.01 0.00 -1.51 0.00 0.00 72.50 68.77 2g0l s THR 65 CO 0.04 -0.05 -0.14 -0.44 -2.21 0.00 0.00 174.62 171.82 2g0l s SER 66 N -3.00 2.11 -0.15 8.08 0.01 -1.26 -0.27 113.70 119.21 2g0l s SER 66 Ca 0.21 -0.36 0.00 0.00 1.31 0.00 0.00 55.95 57.11 2g0l s SER 66 Cb 0.00 -0.95 -0.00 0.00 0.21 0.00 0.00 66.02 65.28 2g0l s SER 66 CO 0.07 0.02 -0.15 -0.76 0.41 0.00 0.00 173.24 172.82 2g0l s LEU 67 N 0.83 2.47 -0.56 2.44 2.01 0.68 -4.79 118.68 121.76 2g0l s LEU 67 Ca -0.11 -0.47 -0.22 0.00 0.01 0.00 0.00 54.13 53.34 2g0l s LEU 67 Cb -0.15 -1.56 0.06 0.00 0.01 0.00 0.00 46.19 44.54 2g0l s LEU 67 CO 0.02 0.09 0.82 -0.89 1.01 0.00 0.00 176.35 177.39 2g0l s THR 68 N 0.80 4.58 -0.14 5.49 2.01 -1.26 0.70 115.64 127.82 2g0l s THR 68 Ca -0.05 -0.22 -0.27 0.00 0.31 0.00 0.00 61.69 61.46 2g0l s THR 68 Cb -0.15 -4.48 -0.01 0.00 0.01 0.00 0.00 72.50 67.86 2g0l s THR 68 CO -0.00 -1.08 0.89 0.54 -0.69 0.00 0.00 174.62 174.28 2g0l s VAL 69 N 3.42 4.85 0.39 3.82 0.11 -0.65 -4.92 120.40 127.42 2g0l s VAL 69 Ca 0.22 1.79 0.05 0.00 -2.93 0.00 0.00 61.98 61.11 2g0l s VAL 69 Cb -0.17 -4.20 -0.00 0.00 -1.53 0.00 0.00 36.38 30.48 2g0l s VAL 69 CO 0.14 0.03 0.55 -0.13 -3.33 0.00 0.00 175.10 172.36 2g0l s ARG 70 N 2.00 3.04 0.20 1.54 1.81 -1.26 0.23 118.95 126.51 2g0l s ARG 70 Ca 0.42 -0.89 0.04 0.00 -1.72 0.00 0.00 55.73 53.58 2g0l s ARG 70 Cb -0.17 -2.73 0.11 0.00 -0.45 0.00 0.00 34.95 31.70 2g0l s ARG 70 CO 0.15 -0.10 1.46 -0.09 -0.68 0.00 0.00 175.30 176.03 2g0l h ARG 71 N 0.69 0.18 -4.84 3.54 9.65 -1.93 -3.44 114.38 118.23 2g0l h ARG 71 Ca -0.45 -0.17 -0.43 0.00 -1.10 0.00 0.00 59.98 57.84 2g0l h ARG 71 Cb 1.26 0.04 -0.29 0.00 -1.39 0.00 0.00 29.97 29.59 2g0l h ARG 71 CO 0.53 0.86 -0.79 -1.12 2.80 0.00 0.00 179.97 182.25 2g0l s SER 72 N -6.90 1.25 0.35 -3.80 0.01 -1.26 0.43 113.70 103.77 2g0l s SER 72 Ca -0.03 -0.19 -0.10 0.00 1.31 0.00 0.00 55.95 56.94 2g0l s SER 72 Cb 0.11 -0.19 0.03 0.00 0.21 0.00 0.00 66.02 66.18 2g0l s SER 72 CO 0.81 0.12 0.63 0.72 0.41 0.00 0.00 173.24 175.92 2g0l s PHE 73 N -0.14 0.51 0.26 2.43 -0.71 -0.19 -5.02 117.98 115.12 2g0l s PHE 73 Ca 0.02 -0.97 -0.12 0.00 -1.04 0.00 0.00 56.93 54.83 2g0l s PHE 73 Cb -0.05 0.39 -0.08 0.00 -1.21 0.00 0.00 43.02 42.07 2g0l s PHE 73 CO -0.00 -1.32 0.61 -1.21 -1.34 0.00 0.00 175.22 171.95 2g0l s GLU 74 N -2.86 3.87 -0.23 1.99 8.01 -1.26 -0.35 118.70 127.87 2g0l s GLU 74 Ca 0.22 0.41 -0.04 0.00 0.01 0.00 0.00 54.97 55.58 2g0l s GLU 74 Cb -0.03 -2.59 0.00 0.00 -4.31 0.00 0.00 34.13 27.20 2g0l s GLU 74 CO 0.15 0.27 -0.04 0.20 0.01 0.00 0.00 175.26 175.85 2g0l s GLY 75 N -2.30 1.62 -0.02 -1.39 0.00 0.84 -2.81 107.32 103.26 2g0l s GLY 75 Ca 0.49 -1.25 0.04 0.00 0.00 0.00 0.00 44.72 44.00 2g0l s GLY 75 CO 0.20 0.46 -0.14 -1.36 0.00 0.00 0.00 173.10 172.26 2g0l s PHE 76 N 1.45 1.29 0.74 1.90 0.40 0.81 -1.07 117.98 123.50 2g0l s PHE 76 Ca 0.04 -0.27 -0.11 0.00 -0.60 0.00 0.00 56.93 55.99 2g0l s PHE 76 Cb -0.15 -0.84 0.04 0.00 0.51 0.00 0.00 43.02 42.57 2g0l s PHE 76 CO -0.03 -0.04 1.12 -0.51 0.70 0.00 0.00 175.22 176.45 2g0l s LEU 77 N -0.25 2.77 0.43 -0.37 1.43 0.13 -2.00 118.68 120.83 2g0l s LEU 77 Ca 0.04 0.99 0.12 0.00 -1.03 0.00 0.00 54.13 54.25 2g0l s LEU 77 Cb -0.06 -3.68 0.94 0.00 0.03 0.00 0.00 46.19 43.42 2g0l s LEU 77 CO -0.00 -1.53 1.98 0.15 0.23 0.00 0.00 176.35 177.18 2g0l h PHE 78 N -0.78 0.11 -0.00 0.29 3.57 -1.90 -1.58 116.94 116.66 2g0l h PHE 78 Ca -0.45 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.04 2g0l h PHE 78 Cb 1.28 -0.03 0.00 0.00 2.79 0.00 0.00 35.95 39.99 2g0l h PHE 78 CO 0.43 0.24 -0.04 -0.40 -2.23 0.00 0.00 178.31 176.31 2g0l n ASP 79 N -4.33 0.15 0.00 0.41 5.75 -1.26 -4.89 116.55 112.38 2g0l n ASP 79 Ca -0.02 -0.28 0.00 0.00 -0.01 0.00 0.00 54.79 54.48 2g0l n ASP 79 Cb 0.23 -0.21 0.00 0.00 -1.03 0.00 0.00 41.12 40.11 2g0l n ASP 79 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2g0l n GLY 80 N 1.29 1.49 3.72 6.12 0.00 -0.59 -5.06 105.19 112.15 2g0l n GLY 80 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.30 2.66 0.22 2.61 2.01 -1.26 -4.66 115.64 114.91 2g0l s THR 81 Ca 0.00 0.48 -0.17 0.00 0.31 0.00 0.00 61.69 62.31 2g0l s THR 81 Cb 0.00 -3.31 -0.08 0.00 0.01 0.00 0.00 72.50 69.12 2g0l s THR 81 CO 0.00 0.04 0.67 0.00 -0.69 0.00 0.00 174.62 174.65 2g0l s ARG 82 N 0.93 4.13 -0.15 4.92 3.03 -1.26 0.23 118.95 130.77 2g0l s ARG 82 Ca 0.68 0.72 -0.05 0.00 2.03 0.00 0.00 55.73 59.12 2g0l s ARG 82 Cb -0.43 -2.83 -0.08 0.00 -1.03 0.00 0.00 34.95 30.59 2g0l s ARG 82 CO 0.33 0.38 -0.17 1.87 -1.13 0.00 0.00 175.30 176.58 2g0l n TRP 83 N 0.57 0.00 0.00 5.89 -0.00 -0.23 -4.92 117.44 118.76 2g0l n TRP 83 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.48 2g0l n TRP 83 Cb 0.52 -0.55 0.00 0.00 -0.00 0.00 0.00 31.31 31.28 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 2.32 -0.17 3.41 5.87 0.00 -1.18 -5.01 105.19 110.43 2g0l n GLY 84 Ca -0.28 -0.56 -0.34 0.00 0.00 0.00 0.00 46.02 44.84 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 -1.99 3.52 -0.04 2.61 2.01 -1.26 -0.12 115.64 120.38 2g0l s THR 85 Ca 0.00 -0.48 -0.00 0.00 0.31 0.00 0.00 61.69 61.52 2g0l s THR 85 Cb 0.00 -2.54 -0.03 0.00 0.01 0.00 0.00 72.50 69.93 2g0l s THR 85 CO 0.00 0.48 0.01 -0.69 -0.69 0.00 0.00 174.62 173.73 2g0l s VAL 86 N 0.65 4.31 -0.00 3.82 1.01 0.52 -4.87 120.40 125.85 2g0l s VAL 86 Ca -0.04 -0.40 0.05 0.00 0.00 0.00 0.00 61.98 61.59 2g0l s VAL 86 Cb -0.15 -2.88 -0.01 0.00 0.00 0.00 0.00 36.38 33.34 2g0l s VAL 86 CO 0.02 0.49 -0.15 -0.62 0.00 0.00 0.00 175.10 174.84 2g0l s ASP 87 N -1.25 1.78 -0.14 3.32 2.15 -1.26 -1.03 116.67 120.24 2g0l s ASP 87 Ca 0.17 -0.30 0.15 0.00 0.43 0.00 0.00 52.55 52.99 2g0l s ASP 87 Cb -0.11 -0.19 0.33 0.00 -0.30 0.00 0.00 42.92 42.65 2g0l s ASP 87 CO 0.07 0.17 1.17 0.00 -0.17 0.00 0.00 175.17 176.40 2g0l h THR 89 N 1.43 1.31 -0.25 0.00 2.02 -1.94 -3.32 112.91 112.15 2g0l h THR 89 Ca -0.02 -2.78 0.00 0.00 0.77 0.00 0.00 66.41 64.38 2g0l h THR 89 Cb 1.09 2.99 0.00 0.00 -1.74 0.00 0.00 68.15 70.50 2g0l h THR 89 CO 0.01 0.83 0.00 1.07 0.37 0.00 0.00 175.52 177.80 2g0l n THR 90 N -3.65 2.08 -3.73 3.16 5.66 -1.26 -5.00 114.28 111.53 2g0l n THR 90 Ca -0.15 -1.78 -0.08 0.00 -3.05 0.00 0.00 64.05 58.99 2g0l n THR 90 Cb 1.08 -0.15 -0.00 0.00 -1.55 0.00 0.00 70.33 69.71 2g0l n THR 90 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2g0l n ALA 91 N -0.43 -0.57 -2.78 1.79 0.00 -1.25 -5.17 120.51 112.10 2g0l n ALA 91 Ca 0.19 -0.94 -0.33 0.00 0.00 0.00 0.00 53.44 52.37 2g0l n ALA 91 Cb 0.81 0.75 -0.07 0.00 0.00 0.00 0.00 19.45 20.95 2g0l n ALA 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2g0l s ALA 92 N -2.08 3.59 0.49 0.00 0.00 -1.26 -4.66 121.76 117.85 2g0l s ALA 92 Ca 0.15 -0.88 -0.01 0.00 0.00 0.00 0.00 51.96 51.22 2g0l s ALA 92 Cb -0.02 -1.57 0.00 0.00 0.00 0.00 0.00 23.12 21.54 2g0l s ALA 92 CO 0.11 0.70 0.74 0.00 0.00 0.00 0.00 175.76 177.31 2g0l s GLN 94 N -4.69 0.91 -0.32 0.00 1.11 0.18 0.26 119.66 117.12 2g0l s GLN 94 Ca 0.50 -0.78 -0.17 0.00 0.01 0.00 0.00 55.36 54.92 2g0l s GLN 94 Cb -0.10 -0.92 -0.01 0.00 -1.01 0.00 0.00 33.01 30.96 2g0l s GLN 94 CO 0.40 0.22 0.49 0.08 0.01 0.00 0.00 175.29 176.49 2g0l s VAL 95 N -0.91 5.06 -0.18 1.09 1.01 0.13 -0.18 120.40 126.41 2g0l s VAL 95 Ca 0.01 0.47 -0.08 0.00 0.00 0.00 0.00 61.98 62.38 2g0l s VAL 95 Cb -0.08 -3.89 -0.04 0.00 0.00 0.00 0.00 36.38 32.36 2g0l s VAL 95 CO 0.01 -0.10 0.10 -0.83 0.00 0.00 0.00 175.10 174.28 2g0l s GLY 96 N 1.70 1.98 -0.14 4.51 0.00 -0.13 -3.25 107.32 112.00 2g0l s GLY 96 Ca 0.18 -0.71 -0.06 0.00 0.00 0.00 0.00 44.72 44.13 2g0l s GLY 96 CO 0.12 0.05 0.30 0.48 0.00 0.00 0.00 173.10 174.06 2g0l s LEU 97 N 0.25 -0.08 0.17 0.66 0.05 -1.26 -1.22 118.68 117.25 2g0l s LEU 97 Ca 0.06 0.68 -0.14 0.00 0.05 0.00 0.00 54.13 54.78 2g0l s LEU 97 Cb -0.12 0.92 0.02 0.00 -2.05 0.00 0.00 46.19 44.95 2g0l s LEU 97 CO -0.01 -0.21 0.41 -0.44 -0.55 0.00 0.00 176.35 175.56 2g0l s SER 98 N 1.89 -0.14 0.00 1.48 0.01 -0.56 -4.53 113.70 111.84 2g0l s SER 98 Ca -0.05 -0.59 0.00 0.00 1.31 0.00 0.00 55.95 56.62 2g0l s SER 98 Cb -0.11 0.50 0.00 0.00 0.21 0.00 0.00 66.02 66.63 2g0l s SER 98 CO -0.10 -0.95 0.00 -0.90 0.41 0.00 0.00 173.24 171.70 2g0l n ASP 99 N -0.27 0.00 0.19 2.44 5.75 -0.09 0.42 116.55 124.99 2g0l n ASP 99 Ca -0.10 0.00 0.05 0.00 -0.01 0.00 0.00 54.79 54.73 2g0l n ASP 99 Cb 0.63 0.00 0.39 0.00 -1.03 0.00 0.00 41.12 41.11 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 -1.63 1.17 0.03 2.12 0.00 -1.87 -3.26 119.26 115.81 2g0l h ALA 100 Ca 0.00 -0.33 -0.24 0.00 0.00 0.00 0.00 54.91 54.35 2g0l h ALA 100 Cb 0.00 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 2g0l h ALA 100 CO 0.00 0.45 -1.28 0.00 0.00 0.00 0.00 179.25 178.41 2g0l h ALA 101 N 1.64 0.26 0.00 0.00 0.00 -1.93 -3.49 119.26 115.74 2g0l h ALA 101 Ca -0.00 -1.18 0.00 0.00 0.00 0.00 0.00 54.91 53.73 2g0l h ALA 101 Cb 0.75 0.67 0.00 0.00 0.00 0.00 0.00 17.79 19.21 2g0l h ALA 101 CO 0.05 0.75 0.00 0.41 0.00 0.00 0.00 179.25 180.45 2g0l n GLY 102 N 1.54 0.40 1.17 0.00 0.00 -1.23 -5.14 105.19 101.93 2g0l n GLY 102 Ca -0.30 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.62 2g0l n GLY 102 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2g0l n ASN 103 N 0.00 1.58 0.00 1.61 3.02 -1.26 -4.80 115.26 115.41 2g0l n ASN 103 Ca 0.00 -1.74 0.00 0.00 -0.03 0.00 0.00 54.58 52.81 2g0l n ASN 103 Cb 0.00 0.26 0.00 0.00 -0.61 0.00 0.00 39.78 39.43 2g0l n ASN 103 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2g0l n GLY 104 N 1.92 0.51 3.63 7.41 0.00 -1.26 -0.92 105.19 116.48 2g0l n GLY 104 Ca -0.04 -1.76 -0.29 0.00 0.00 0.00 0.00 46.02 43.93 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 -1.18 -0.25 0.18 1.61 0.02 -1.26 -5.02 135.00 129.10 2g0l s PRO 105 Ca 0.00 0.34 -0.20 0.00 0.02 0.00 0.00 61.00 61.17 2g0l s PRO 105 Cb 0.00 -1.67 -0.08 0.00 0.02 0.00 0.00 34.50 32.77 2g0l s PRO 105 CO 0.00 -3.15 0.68 -2.00 -0.33 0.00 0.00 177.00 172.20 2g0l s GLU 106 N -5.06 4.24 0.20 5.54 2.12 -1.26 -4.88 118.70 119.61 2g0l s GLU 106 Ca 0.67 0.83 -0.30 0.00 0.36 0.00 0.00 54.97 56.53 2g0l s GLU 106 Cb -0.16 -2.99 -0.09 0.00 0.26 0.00 0.00 34.13 31.15 2g0l s GLU 106 CO 0.58 0.47 1.30 0.20 -0.54 0.00 0.00 175.26 177.27 2g0l s GLY 107 N -1.51 2.48 -0.12 -1.50 0.00 -1.26 -4.97 107.32 100.44 2g0l s GLY 107 Ca 0.39 1.10 -0.03 0.00 0.00 0.00 0.00 44.72 46.17 2g0l s GLY 107 CO 0.21 2.05 0.01 0.14 0.00 0.00 0.00 173.10 175.52 2g0l s VAL 108 N 0.08 4.40 0.03 1.40 1.01 -1.20 -4.90 120.40 121.22 2g0l s VAL 108 Ca 0.56 -0.20 -0.21 0.00 0.00 0.00 0.00 61.98 62.13 2g0l s VAL 108 Cb -0.36 -2.89 -0.06 0.00 0.00 0.00 0.00 36.38 33.07 2g0l s VAL 108 CO 0.38 0.56 0.64 0.00 0.00 0.00 0.00 175.10 176.68 2g0l s ALA 109 N -0.45 3.48 -0.12 5.51 0.00 -1.26 0.17 121.76 129.09 2g0l s ALA 109 Ca 0.08 0.10 0.01 0.00 0.00 0.00 0.00 51.96 52.16 2g0l s ALA 109 Cb -0.12 -2.79 0.02 0.00 0.00 0.00 0.00 23.12 20.23 2g0l s ALA 109 CO 0.02 0.20 -0.14 0.96 0.00 0.00 0.00 175.76 176.80 2g0l s ILE 110 N -0.41 1.48 -0.08 0.00 -4.36 0.14 -4.91 121.20 113.06 2g0l s ILE 110 Ca 0.32 -0.61 0.00 0.00 -0.26 0.00 0.00 60.65 60.10 2g0l s ILE 110 Cb -0.19 -1.38 -0.03 0.00 1.25 0.00 0.00 42.46 42.11 2g0l s ILE 110 CO 0.19 0.44 -0.07 -0.44 0.24 0.00 0.00 174.94 175.30 2g0l s SER 111 N 1.18 4.59 0.43 4.36 0.01 -1.26 -1.09 113.70 121.91 2g0l s SER 111 Ca -0.03 -0.06 -0.03 0.00 1.31 0.00 0.00 55.95 57.14 2g0l s SER 111 Cb -0.14 -1.26 -0.03 0.00 0.21 0.00 0.00 66.02 64.80 2g0l s SER 111 CO -0.05 0.32 0.69 -0.36 0.41 0.00 0.00 173.24 174.26 2g0l s PHE 112 N -0.58 3.52 -2.65 2.43 0.08 -1.26 -1.16 117.98 118.35 2g0l s PHE 112 Ca 0.09 0.61 0.27 0.00 0.12 0.00 0.00 56.93 58.01 2g0l s PHE 112 Cb -0.12 -2.15 0.79 0.00 -0.57 0.00 0.00 43.02 40.97 2g0l s PHE 112 CO 0.02 -0.14 1.60 0.27 -0.10 0.00 0.00 175.22 176.87