#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 3.59 0.91 0.00 0.00 -1.26 -5.05 121.76 119.95 2g0l s ALA 2 Ca 0.00 0.02 -0.15 0.00 0.00 0.00 0.00 51.96 51.83 2g0l s ALA 2 Cb 0.00 -3.32 0.16 0.00 0.00 0.00 0.00 23.12 19.97 2g0l s ALA 2 CO 0.00 -0.81 1.28 -1.25 0.00 0.00 0.00 175.76 174.98 2g0l s PRO 3 N 2.56 1.04 -0.29 0.00 0.04 -1.26 -5.01 135.00 132.09 2g0l s PRO 3 Ca 0.39 -0.26 -0.00 0.00 0.04 0.00 0.00 61.00 61.17 2g0l s PRO 3 Cb -0.16 -1.88 0.05 0.00 0.04 0.00 0.00 34.50 32.55 2g0l s PRO 3 CO 0.10 -2.16 -0.04 0.99 0.04 0.00 0.00 177.00 175.93 2g0l s THR 4 N -3.79 2.74 -1.11 1.26 2.01 0.35 -5.00 115.64 112.11 2g0l s THR 4 Ca 0.70 -1.43 -0.08 0.00 0.31 0.00 0.00 61.69 61.19 2g0l s THR 4 Cb -0.06 -2.57 0.28 0.00 0.01 0.00 0.00 72.50 70.16 2g0l s THR 4 CO 0.52 -0.06 1.18 0.00 -0.69 0.00 0.00 174.62 175.56 2g0l n ALA 5 N 4.57 4.40 -2.77 7.40 0.00 -1.26 -0.26 120.51 132.58 2g0l n ALA 5 Ca -0.14 -4.69 -0.43 0.00 0.00 0.00 0.00 53.44 48.18 2g0l n ALA 5 Cb 0.43 -2.42 -0.02 0.00 0.00 0.00 0.00 19.45 17.44 2g0l n ALA 5 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2g0l s THR 6 N -1.58 4.43 0.04 0.00 -4.23 -0.67 -4.99 115.64 108.64 2g0l s THR 6 Ca 0.31 -1.40 0.03 0.00 -1.18 0.00 0.00 61.69 59.45 2g0l s THR 6 Cb -0.07 -4.92 -0.04 0.00 1.34 0.00 0.00 72.50 68.81 2g0l s THR 6 CO -0.05 -1.71 -0.01 0.68 -0.54 0.00 0.00 174.62 173.00 2g0l s VAL 7 N 3.51 4.05 -0.40 2.29 -7.23 -1.26 -2.31 120.40 119.05 2g0l s VAL 7 Ca 0.40 -0.78 -0.07 0.00 -1.81 0.00 0.00 61.98 59.71 2g0l s VAL 7 Cb -0.02 -2.85 0.08 0.00 0.56 0.00 0.00 36.38 34.14 2g0l s VAL 7 CO -0.08 0.27 0.21 -0.89 -0.31 0.00 0.00 175.10 174.30 2g0l s THR 8 N -1.17 3.90 0.39 5.32 2.01 0.14 -5.01 115.64 121.22 2g0l s THR 8 Ca 0.22 -1.50 -0.25 0.00 0.31 0.00 0.00 61.69 60.47 2g0l s THR 8 Cb -0.12 -3.41 -0.09 0.00 0.01 0.00 0.00 72.50 68.89 2g0l s THR 8 CO 0.13 -0.48 1.08 -2.16 -0.69 0.00 0.00 174.62 172.51 2g0l s PRO 9 N 1.35 4.17 -0.30 4.92 0.04 -1.26 -3.82 135.00 140.10 2g0l s PRO 9 Ca 0.03 1.62 0.03 0.00 0.04 0.00 0.00 61.00 62.72 2g0l s PRO 9 Cb -0.22 -2.63 0.48 0.00 0.04 0.00 0.00 34.50 32.17 2g0l s PRO 9 CO 0.01 -0.16 1.62 -1.13 0.04 0.00 0.00 177.00 177.38 2g0l n SER 10 N 0.07 3.60 -4.69 6.66 3.41 -1.26 -4.96 113.62 116.45 2g0l n SER 10 Ca 0.04 -3.09 -0.42 0.00 -0.26 0.00 0.00 58.87 55.14 2g0l n SER 10 Cb 0.48 -0.73 -0.03 0.00 -0.26 0.00 0.00 64.21 63.68 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 -0.61 6.53 0.00 4.04 0.01 -1.26 -1.67 113.70 120.75 2g0l s SER 11 Ca 0.40 2.58 0.00 0.00 1.31 0.00 0.00 55.95 60.23 2g0l s SER 11 Cb 0.33 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 64.00 2g0l s SER 11 CO 0.08 -0.94 0.00 0.61 0.41 0.00 0.00 173.24 173.40 2g0l n GLY 12 N 4.14 0.74 3.95 3.44 0.00 0.18 -4.92 105.19 112.71 2g0l n GLY 12 Ca 0.17 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.99 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 3.33 0.00 0.99 1.43 -0.67 -3.95 118.68 119.81 2g0l s LEU 13 Ca 0.00 -0.73 0.00 0.00 -1.03 0.00 0.00 54.13 52.37 2g0l s LEU 13 Cb 0.00 -2.04 0.00 0.00 0.03 0.00 0.00 46.19 44.18 2g0l s LEU 13 CO 0.00 -0.87 0.00 -1.20 0.23 0.00 0.00 176.35 174.51 2g0l n SER 14 N -1.79 0.00 -4.84 2.29 7.64 -1.26 -2.07 113.62 113.59 2g0l n SER 14 Ca 0.06 -0.74 -0.32 0.00 1.01 0.00 0.00 58.87 58.89 2g0l n SER 14 Cb 0.61 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.77 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 -1.00 6.66 0.00 6.43 -4.77 -1.26 -3.82 116.67 118.91 2g0l s ASP 15 Ca 0.00 1.52 0.00 0.00 -3.30 0.00 0.00 52.55 50.77 2g0l s ASP 15 Cb 0.00 -2.49 0.00 0.00 -1.09 0.00 0.00 42.92 39.34 2g0l s ASP 15 CO 0.00 -0.52 0.00 0.61 0.70 0.00 0.00 175.17 175.96 2g0l n GLY 16 N -1.38 0.75 3.76 2.12 0.00 0.14 -5.01 105.19 105.57 2g0l n GLY 16 Ca 0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.42 3.30 -0.60 2.61 2.01 -1.25 -4.75 115.64 114.54 2g0l s THR 17 Ca 0.00 1.30 -0.25 0.00 0.31 0.00 0.00 61.69 63.06 2g0l s THR 17 Cb 0.00 -3.83 0.04 0.00 0.01 0.00 0.00 72.50 68.73 2g0l s THR 17 CO 0.00 0.31 1.02 -0.69 -0.69 0.00 0.00 174.62 174.57 2g0l s VAL 18 N -1.12 4.25 -0.20 3.82 1.01 -1.26 -2.26 120.40 124.64 2g0l s VAL 18 Ca 0.46 0.25 -0.27 0.00 0.00 0.00 0.00 61.98 62.42 2g0l s VAL 18 Cb -0.34 -4.64 -0.01 0.00 0.00 0.00 0.00 36.38 31.40 2g0l s VAL 18 CO 0.44 -1.30 0.90 -0.69 0.00 0.00 0.00 175.10 174.46 2g0l s VAL 19 N 4.31 4.81 -0.35 2.92 1.01 0.64 -4.85 120.40 128.88 2g0l s VAL 19 Ca 0.31 1.76 -0.18 0.00 0.00 0.00 0.00 61.98 63.87 2g0l s VAL 19 Cb -0.12 -4.20 -0.00 0.00 0.00 0.00 0.00 36.38 32.06 2g0l s VAL 19 CO 0.18 -0.06 0.50 -0.75 0.00 0.00 0.00 175.10 174.98 2g0l s LYS 20 N 2.59 3.60 -0.36 2.72 2.20 -1.25 -1.03 119.74 128.20 2g0l s LYS 20 Ca 0.40 -0.20 -0.03 0.00 -0.36 0.00 0.00 55.97 55.78 2g0l s LYS 20 Cb -0.16 -3.82 0.08 0.00 -1.51 0.00 0.00 37.83 32.42 2g0l s LYS 20 CO 0.10 -0.65 0.11 0.08 -0.36 0.00 0.00 175.35 174.63 2g0l s VAL 21 N 2.37 3.26 -0.24 4.02 1.01 0.14 -0.69 120.40 130.27 2g0l s VAL 21 Ca 0.18 -1.65 0.02 0.00 0.00 0.00 0.00 61.98 60.53 2g0l s VAL 21 Cb -0.16 -3.03 0.04 0.00 0.00 0.00 0.00 36.38 33.23 2g0l s VAL 21 CO 0.13 -0.39 -0.13 0.00 0.00 0.00 0.00 175.10 174.72 2g0l s ALA 22 N 1.23 2.52 -0.12 5.51 0.00 -0.98 -0.97 121.76 128.94 2g0l s ALA 22 Ca 0.02 -1.57 -0.02 0.00 0.00 0.00 0.00 51.96 50.39 2g0l s ALA 22 Cb -0.21 -1.49 -0.03 0.00 0.00 0.00 0.00 23.12 21.40 2g0l s ALA 22 CO -0.02 -0.90 -0.05 0.20 0.00 0.00 0.00 175.76 174.99 2g0l s GLY 23 N 1.19 1.71 0.10 0.00 0.00 0.69 -1.66 107.32 109.34 2g0l s GLY 23 Ca -0.04 -0.85 0.09 0.00 0.00 0.00 0.00 44.72 43.93 2g0l s GLY 23 CO -0.07 -0.32 -0.23 0.00 0.00 0.00 0.00 173.10 172.48 2g0l s ALA 24 N -0.13 1.97 -0.14 3.20 0.00 0.64 -1.29 121.76 126.01 2g0l s ALA 24 Ca 0.02 -1.28 -0.00 0.00 0.00 0.00 0.00 51.96 50.70 2g0l s ALA 24 Cb -0.13 -0.31 0.00 0.00 0.00 0.00 0.00 23.12 22.68 2g0l s ALA 24 CO 0.03 0.42 0.03 0.41 0.00 0.00 0.00 175.76 176.65 2g0l n GLY 25 N 1.18 0.46 0.49 0.00 0.00 -1.13 -0.49 105.19 105.69 2g0l n GLY 25 Ca -0.19 -0.75 -0.03 0.00 0.00 0.00 0.00 46.02 45.05 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 -0.43 0.00 -4.41 0.99 4.77 -0.05 -4.66 117.00 113.20 2g0l n LEU 26 Ca -0.01 -0.28 -0.44 0.00 -0.03 0.00 0.00 56.01 55.25 2g0l n LEU 26 Cb 0.51 -0.08 -0.07 0.00 -2.33 0.00 0.00 43.42 41.46 2g0l n LEU 26 CO 0.03 -0.55 0.17 -1.58 -1.33 0.00 0.00 177.39 174.13 2g0l s GLN 27 N -2.64 3.04 0.27 3.23 2.00 -1.26 -4.73 119.66 119.58 2g0l s GLN 27 Ca 0.08 -1.16 -0.30 0.00 -2.00 0.00 0.00 55.36 51.98 2g0l s GLN 27 Cb -0.00 -4.13 -0.13 0.00 0.80 0.00 0.00 33.01 29.55 2g0l s GLN 27 CO 0.05 -1.13 1.35 0.00 -0.50 0.00 0.00 175.29 175.06 2g0l n ALA 28 N 5.65 1.08 0.00 1.58 0.00 -1.26 -2.33 120.51 125.23 2g0l n ALA 28 Ca -0.10 0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.74 2g0l n ALA 28 Cb 0.44 -2.25 0.00 0.00 0.00 0.00 0.00 19.45 17.64 2g0l n ALA 28 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2g0l n GLY 29 N 1.67 3.11 3.91 0.00 0.00 -0.96 -4.99 105.19 107.92 2g0l n GLY 29 Ca 0.09 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.84 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 -2.83 4.16 -0.07 2.61 -4.23 -0.99 -4.80 115.64 109.50 2g0l s THR 30 Ca 0.00 0.20 0.01 0.00 -1.18 0.00 0.00 61.69 60.72 2g0l s THR 30 Cb 0.00 -3.63 -0.03 0.00 1.34 0.00 0.00 72.50 70.18 2g0l s THR 30 CO 0.00 -0.68 -0.08 0.00 -0.54 0.00 0.00 174.62 173.32 2g0l s ALA 31 N -2.96 2.91 -0.10 3.99 0.00 -1.26 -1.03 121.76 123.31 2g0l s ALA 31 Ca 0.52 -0.90 0.03 0.00 0.00 0.00 0.00 51.96 51.61 2g0l s ALA 31 Cb -0.11 -1.19 -0.01 0.00 0.00 0.00 0.00 23.12 21.81 2g0l s ALA 31 CO 0.47 0.55 -0.19 0.71 0.00 0.00 0.00 175.76 177.29 2g0l s TYR 32 N -0.72 2.64 -0.21 0.00 1.51 0.87 -3.14 117.35 118.30 2g0l s TYR 32 Ca 0.11 -0.73 -0.09 0.00 -1.01 0.00 0.00 57.07 55.34 2g0l s TYR 32 Cb -0.11 -1.72 -0.05 0.00 -0.11 0.00 0.00 41.96 39.97 2g0l s TYR 32 CO 0.01 -0.23 0.12 0.34 -1.11 0.00 0.00 175.55 174.68 2g0l s ASP 33 N 0.11 5.90 -0.04 2.29 2.15 0.56 -0.39 116.67 127.25 2g0l s ASP 33 Ca -0.09 0.10 0.03 0.00 0.43 0.00 0.00 52.55 53.02 2g0l s ASP 33 Cb -0.15 -2.04 0.00 0.00 -0.30 0.00 0.00 42.92 40.43 2g0l s ASP 33 CO 0.06 0.11 -0.12 -0.69 -0.17 0.00 0.00 175.17 174.36 2g0l s VAL 34 N 0.75 1.08 0.33 1.11 1.01 -0.92 -1.70 120.40 122.05 2g0l s VAL 34 Ca 0.06 -0.50 -0.17 0.00 0.00 0.00 0.00 61.98 61.37 2g0l s VAL 34 Cb -0.13 -0.96 0.03 0.00 0.00 0.00 0.00 36.38 35.33 2g0l s VAL 34 CO 0.02 0.33 0.71 -0.83 0.00 0.00 0.00 175.10 175.33 2g0l s GLY 35 N 0.29 0.28 -0.23 4.51 0.00 -0.06 -1.62 107.32 110.49 2g0l s GLY 35 Ca -0.07 -0.64 -0.23 0.00 0.00 0.00 0.00 44.72 43.78 2g0l s GLY 35 CO 0.02 -0.30 0.77 -0.86 0.00 0.00 0.00 173.10 172.73 2g0l s GLN 36 N -3.19 4.19 -0.13 2.90 -2.07 -1.26 -0.47 119.66 119.64 2g0l s GLN 36 Ca 0.15 0.85 0.03 0.00 -1.82 0.00 0.00 55.36 54.57 2g0l s GLN 36 Cb -0.05 -3.63 0.01 0.00 -1.09 0.00 0.00 33.01 28.25 2g0l s GLN 36 CO 0.10 -0.44 -0.22 0.00 -1.32 0.00 0.00 175.29 173.42 2g0l s ALA 38 N 0.69 3.67 -0.45 0.00 0.00 -0.51 -1.15 121.76 124.02 2g0l s ALA 38 Ca -0.10 -1.87 -0.28 0.00 0.00 0.00 0.00 51.96 49.72 2g0l s ALA 38 Cb -0.16 -0.78 -0.01 0.00 0.00 0.00 0.00 23.12 22.16 2g0l s ALA 38 CO 0.01 -0.06 1.74 -0.46 0.00 0.00 0.00 175.76 176.99 2g0l s TRP 39 N -2.45 1.87 -0.20 0.00 -0.00 -0.56 -1.65 118.94 115.95 2g0l s TRP 39 Ca 0.41 0.68 0.21 0.00 -0.00 0.00 0.00 56.10 57.40 2g0l s TRP 39 Cb -0.02 -4.16 -0.05 0.00 -0.00 0.00 0.00 33.47 29.24 2g0l s TRP 39 CO 0.24 -2.53 0.95 1.55 -0.00 0.00 0.00 176.95 177.16 2g0l n VAL 40 N 7.27 0.67 -3.83 5.86 3.14 -0.11 -4.88 118.33 126.45 2g0l n VAL 40 Ca 0.21 -0.57 -0.07 0.00 -2.96 0.00 0.00 64.34 60.95 2g0l n VAL 40 Cb 0.49 -0.38 0.01 0.00 -1.06 0.00 0.00 33.84 32.90 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 -5.36 -0.06 -0.74 6.55 -1.08 -0.57 -5.00 116.67 110.41 2g0l s ASP 41 Ca -0.02 -0.88 -0.26 0.00 -0.52 0.00 0.00 52.55 50.88 2g0l s ASP 41 Cb 0.10 0.72 -0.04 0.00 -1.46 0.00 0.00 42.92 42.24 2g0l s ASP 41 CO 0.80 -1.41 1.93 -0.89 0.52 0.00 0.00 175.17 176.12 2g0l s THR 42 N -2.68 3.38 0.00 1.71 2.01 -1.26 -1.78 115.64 117.01 2g0l s THR 42 Ca 0.16 -0.05 0.00 0.00 0.31 0.00 0.00 61.69 62.10 2g0l s THR 42 Cb -0.04 -3.92 0.00 0.00 0.01 0.00 0.00 72.50 68.55 2g0l s THR 42 CO 0.08 -0.88 0.00 0.61 -0.69 0.00 0.00 174.62 173.74 2g0l n GLY 43 N 6.23 0.73 3.12 4.40 0.00 -1.26 -5.06 105.19 113.35 2g0l n GLY 43 Ca 0.30 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.06 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 -2.20 1.39 0.46 1.61 1.01 -0.73 -5.10 120.40 116.83 2g0l s VAL 44 Ca 0.00 -0.69 0.04 0.00 0.00 0.00 0.00 61.98 61.33 2g0l s VAL 44 Cb 0.00 -1.19 -0.05 0.00 0.00 0.00 0.00 36.38 35.14 2g0l s VAL 44 CO 0.00 0.40 0.01 -0.76 0.00 0.00 0.00 175.10 174.76 2g0l s LEU 45 N 0.06 2.63 -0.28 3.92 1.02 -1.26 -0.94 118.68 123.83 2g0l s LEU 45 Ca -0.04 -1.49 -0.20 0.00 0.02 0.00 0.00 54.13 52.42 2g0l s LEU 45 Cb -0.11 -0.84 0.08 0.00 0.02 0.00 0.00 46.19 45.34 2g0l s LEU 45 CO 0.02 -0.64 0.74 0.00 0.02 0.00 0.00 176.35 176.50 2g0l s ALA 46 N -2.78 -1.87 0.39 4.21 0.00 -0.66 -4.72 121.76 116.33 2g0l s ALA 46 Ca 0.22 2.23 0.08 0.00 0.00 0.00 0.00 51.96 54.49 2g0l s ALA 46 Cb 0.06 -1.35 -0.01 0.00 0.00 0.00 0.00 23.12 21.81 2g0l s ALA 46 CO 0.12 -0.35 0.41 0.00 0.00 0.00 0.00 175.76 175.93 2g0l s ASN 48 N -4.15 6.53 -0.15 0.00 4.22 -1.07 -0.56 114.94 119.75 2g0l s ASN 48 Ca 0.47 0.63 0.06 0.00 -2.14 0.00 0.00 52.86 51.88 2g0l s ASN 48 Cb -0.06 -2.19 0.40 0.00 1.28 0.00 0.00 41.25 40.68 2g0l s ASN 48 CO 0.29 0.19 1.24 -0.81 -2.04 0.00 0.00 177.10 175.97 2g0l n PRO 49 N 2.95 2.61 -0.05 3.55 -0.04 -1.26 -3.62 135.00 139.14 2g0l n PRO 49 Ca -0.13 -1.60 -0.06 0.00 -0.04 0.00 0.00 63.50 61.66 2g0l n PRO 49 Cb 0.52 -1.81 -0.02 0.00 -0.04 0.00 0.00 33.50 32.15 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 0.12 1.43 -0.81 0.55 0.00 -1.26 -4.68 120.51 115.87 2g0l n ALA 50 Ca 0.19 -0.58 0.07 0.00 0.00 0.00 0.00 53.44 53.13 2g0l n ALA 50 Cb 0.85 0.09 0.39 0.00 0.00 0.00 0.00 19.45 20.78 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 -4.12 5.51 -4.83 0.00 8.00 -1.26 -4.96 116.55 114.88 2g0l n ASP 51 Ca -0.10 -2.85 -0.31 0.00 0.71 0.00 0.00 54.79 52.25 2g0l n ASP 51 Cb 0.36 -0.67 0.03 0.00 -0.02 0.00 0.00 41.12 40.83 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 -2.60 3.26 -0.11 1.24 -0.71 -1.24 -4.25 117.98 113.56 2g0l s PHE 52 Ca 0.53 1.39 -0.05 0.00 -1.04 0.00 0.00 56.93 57.76 2g0l s PHE 52 Cb 0.40 -2.84 0.05 0.00 -1.21 0.00 0.00 43.02 39.42 2g0l s PHE 52 CO 0.17 -1.05 0.25 -1.12 -1.34 0.00 0.00 175.22 172.12 2g0l s SER 53 N -3.82 0.00 -0.21 1.98 0.01 -0.64 -5.03 113.70 105.99 2g0l s SER 53 Ca 0.58 0.53 -0.13 0.00 1.31 0.00 0.00 55.95 58.24 2g0l s SER 53 Cb -0.13 0.50 -0.05 0.00 0.21 0.00 0.00 66.02 66.55 2g0l s SER 53 CO 0.53 -0.19 0.26 -0.44 0.41 0.00 0.00 173.24 173.81 2g0l s SER 54 N 1.71 6.29 -0.08 2.44 0.01 -1.26 -2.18 113.70 120.64 2g0l s SER 54 Ca -0.05 0.33 0.04 0.00 1.31 0.00 0.00 55.95 57.58 2g0l s SER 54 Cb -0.11 -2.16 -0.00 0.00 0.21 0.00 0.00 66.02 63.96 2g0l s SER 54 CO -0.08 0.03 -0.21 0.54 0.41 0.00 0.00 173.24 173.93 2g0l s VAL 55 N 0.97 1.82 -0.05 3.43 0.11 0.47 -4.93 120.40 122.22 2g0l s VAL 55 Ca 0.13 -0.90 -0.10 0.00 -2.93 0.00 0.00 61.98 58.18 2g0l s VAL 55 Cb -0.14 -1.57 -0.05 0.00 -1.53 0.00 0.00 36.38 33.09 2g0l s VAL 55 CO 0.05 0.51 0.28 0.28 -3.33 0.00 0.00 175.10 172.88 2g0l s THR 56 N 0.22 5.27 0.19 5.04 -1.32 -1.26 -0.09 115.64 123.69 2g0l s THR 56 Ca -0.12 0.48 -0.31 0.00 -1.21 0.00 0.00 61.69 60.53 2g0l s THR 56 Cb -0.16 -3.56 -0.09 0.00 -1.51 0.00 0.00 72.50 67.18 2g0l s THR 56 CO 0.06 0.56 1.42 0.00 -2.21 0.00 0.00 174.62 174.45 2g0l s ALA 57 N -1.10 3.63 1.12 11.08 0.00 -0.20 -4.76 121.76 131.53 2g0l s ALA 57 Ca 0.21 1.24 -0.16 0.00 0.00 0.00 0.00 51.96 53.24 2g0l s ALA 57 Cb -0.14 -3.55 0.23 0.00 0.00 0.00 0.00 23.12 19.66 2g0l s ALA 57 CO 0.10 -0.67 1.01 -0.40 0.00 0.00 0.00 175.76 175.80 2g0l n ASP 58 N 3.09 -1.07 0.26 0.00 5.75 -0.31 -2.28 116.55 122.00 2g0l n ASP 58 Ca 0.09 -1.21 0.15 0.00 -0.01 0.00 0.00 54.79 53.81 2g0l n ASP 58 Cb 0.41 -0.86 0.87 0.00 -1.03 0.00 0.00 41.12 40.51 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 -2.28 1.67 0.00 2.12 0.00 -1.95 0.11 119.26 118.93 2g0l h ALA 59 Ca -0.36 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.55 2g0l h ALA 59 Cb 1.04 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.83 2g0l h ALA 59 CO 0.24 -0.11 -0.22 -0.91 0.00 0.00 0.00 179.25 178.26 2g0l h ASN 60 N 0.00 0.00 0.00 0.00 2.35 -2.00 -3.47 115.58 112.46 2g0l h ASN 60 Ca 0.03 -0.06 0.00 0.00 -0.55 0.00 0.00 56.30 55.72 2g0l h ASN 60 Cb 0.18 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.55 2g0l h ASN 60 CO -0.00 0.03 0.00 0.61 -1.65 0.00 0.00 177.43 176.42 2g0l n GLY 61 N 1.30 1.06 3.39 2.83 0.00 0.40 -4.78 105.19 109.38 2g0l n GLY 61 Ca 0.05 -0.49 -0.27 0.00 0.00 0.00 0.00 46.02 45.30 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 -2.54 3.26 -0.17 1.61 1.04 -1.26 -0.88 113.70 114.77 2g0l s SER 62 Ca 0.00 -0.81 -0.09 0.00 0.48 0.00 0.00 55.95 55.53 2g0l s SER 62 Cb 0.00 -0.22 0.06 0.00 0.10 0.00 0.00 66.02 65.95 2g0l s SER 62 CO 0.00 0.13 0.41 0.00 0.98 0.00 0.00 173.24 174.75 2g0l s ALA 63 N -1.44 -1.04 -0.08 5.32 0.00 -0.41 -1.16 121.76 122.96 2g0l s ALA 63 Ca 0.17 1.51 -0.00 0.00 0.00 0.00 0.00 51.96 53.63 2g0l s ALA 63 Cb -0.09 -0.91 0.02 0.00 0.00 0.00 0.00 23.12 22.14 2g0l s ALA 63 CO 0.08 -0.26 -0.04 -1.12 0.00 0.00 0.00 175.76 174.42 2g0l s SER 64 N 1.37 1.63 0.12 0.00 0.01 -1.26 -0.22 113.70 115.34 2g0l s SER 64 Ca -0.09 -0.17 0.02 0.00 1.31 0.00 0.00 55.95 57.02 2g0l s SER 64 Cb -0.08 -0.58 -0.04 0.00 0.21 0.00 0.00 66.02 65.52 2g0l s SER 64 CO -0.12 -0.13 -0.05 0.28 0.41 0.00 0.00 173.24 173.63 2g0l s THR 65 N 1.58 0.72 -0.09 1.44 -1.32 -0.15 -4.99 115.64 112.83 2g0l s THR 65 Ca 0.00 -1.95 0.04 0.00 -1.21 0.00 0.00 61.69 58.57 2g0l s THR 65 Cb -0.13 -1.78 0.00 0.00 -1.51 0.00 0.00 72.50 69.08 2g0l s THR 65 CO -0.04 -0.79 -0.23 -0.44 -2.21 0.00 0.00 174.62 170.91 2g0l s SER 66 N -3.08 2.93 -0.02 8.08 0.01 -1.26 -0.69 113.70 119.67 2g0l s SER 66 Ca 0.15 -0.52 0.06 0.00 1.31 0.00 0.00 55.95 56.94 2g0l s SER 66 Cb 0.05 -1.28 -0.02 0.00 0.21 0.00 0.00 66.02 64.98 2g0l s SER 66 CO -0.03 0.15 -0.19 -0.76 0.41 0.00 0.00 173.24 172.82 2g0l s LEU 67 N 0.32 2.45 -0.56 2.44 2.01 -0.20 -4.89 118.68 120.26 2g0l s LEU 67 Ca -0.17 -0.33 -0.20 0.00 0.01 0.00 0.00 54.13 53.44 2g0l s LEU 67 Cb -0.17 -1.46 0.07 0.00 0.01 0.00 0.00 46.19 44.64 2g0l s LEU 67 CO 0.08 0.32 0.72 -0.89 1.01 0.00 0.00 176.35 177.59 2g0l s THR 68 N -0.71 4.75 -0.47 5.49 2.01 -1.26 -0.26 115.64 125.19 2g0l s THR 68 Ca 0.11 -0.57 -0.29 0.00 0.31 0.00 0.00 61.69 61.25 2g0l s THR 68 Cb -0.10 -4.43 0.02 0.00 0.01 0.00 0.00 72.50 68.00 2g0l s THR 68 CO 0.01 -1.01 1.28 0.54 -0.69 0.00 0.00 174.62 174.75 2g0l s VAL 69 N 2.93 4.02 0.69 3.82 0.11 -0.96 -4.88 120.40 126.13 2g0l s VAL 69 Ca 0.16 1.02 -0.05 0.00 -2.93 0.00 0.00 61.98 60.18 2g0l s VAL 69 Cb -0.20 -4.44 0.07 0.00 -1.53 0.00 0.00 36.38 30.29 2g0l s VAL 69 CO 0.10 -0.95 0.97 -0.13 -3.33 0.00 0.00 175.10 171.77 2g0l s ARG 70 N 4.81 2.11 0.07 1.54 1.81 -1.26 0.27 118.95 128.30 2g0l s ARG 70 Ca 0.54 -0.51 0.17 0.00 -1.72 0.00 0.00 55.73 54.21 2g0l s ARG 70 Cb -0.10 -2.25 -0.12 0.00 -0.45 0.00 0.00 34.95 32.03 2g0l s ARG 70 CO 0.31 -1.22 0.83 -2.13 -0.68 0.00 0.00 175.30 172.42 2g0l n ARG 71 N -2.82 0.62 -3.87 3.54 3.00 -1.26 -4.85 116.66 111.01 2g0l n ARG 71 Ca 0.09 0.21 -0.12 0.00 -0.00 0.00 0.00 57.85 58.03 2g0l n ARG 71 Cb 0.60 -1.80 -0.13 0.00 0.00 0.00 0.00 32.46 31.12 2g0l n ARG 71 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.63 176.51 2g0l s SER 72 N -5.72 0.00 0.32 6.15 0.01 -1.26 -0.27 113.70 112.94 2g0l s SER 72 Ca -0.03 -0.01 -0.18 0.00 1.31 0.00 0.00 55.95 57.04 2g0l s SER 72 Cb 0.09 0.05 0.05 0.00 0.21 0.00 0.00 66.02 66.42 2g0l s SER 72 CO 0.81 -0.04 0.81 0.72 0.41 0.00 0.00 173.24 175.95 2g0l s PHE 73 N -0.14 0.03 -0.24 2.43 -0.12 -1.11 -5.01 117.98 113.81 2g0l s PHE 73 Ca -0.02 -0.60 -0.12 0.00 -0.05 0.00 0.00 56.93 56.15 2g0l s PHE 73 Cb -0.01 0.78 -0.05 0.00 -0.63 0.00 0.00 43.02 43.11 2g0l s PHE 73 CO -0.00 -1.38 0.21 -1.21 -0.05 0.00 0.00 175.22 172.79 2g0l s GLU 74 N -2.72 4.08 0.05 1.99 2.02 -1.26 0.37 118.70 123.22 2g0l s GLU 74 Ca 0.15 -0.18 -0.24 0.00 0.02 0.00 0.00 54.97 54.72 2g0l s GLU 74 Cb -0.05 -3.55 -0.06 0.00 0.10 0.00 0.00 34.13 30.57 2g0l s GLU 74 CO 0.09 0.02 0.72 0.20 0.02 0.00 0.00 175.26 176.31 2g0l s GLY 75 N 1.12 2.76 0.02 -1.39 0.00 0.60 -3.55 107.32 106.88 2g0l s GLY 75 Ca 0.10 0.23 0.08 0.00 0.00 0.00 0.00 44.72 45.12 2g0l s GLY 75 CO 0.06 0.98 -0.23 -1.36 0.00 0.00 0.00 173.10 172.55 2g0l s PHE 76 N -0.21 2.03 0.82 1.90 0.40 0.27 -1.20 117.98 121.99 2g0l s PHE 76 Ca 0.36 -0.39 -0.12 0.00 -0.60 0.00 0.00 56.93 56.19 2g0l s PHE 76 Cb -0.20 -1.25 0.08 0.00 0.51 0.00 0.00 43.02 42.16 2g0l s PHE 76 CO 0.22 0.04 1.11 -0.51 0.70 0.00 0.00 175.22 176.78 2g0l s LEU 77 N -0.90 2.46 0.35 -0.37 1.43 0.93 -3.24 118.68 119.33 2g0l s LEU 77 Ca 0.09 1.16 0.08 0.00 -1.03 0.00 0.00 54.13 54.44 2g0l s LEU 77 Cb -0.09 -3.71 0.65 0.00 0.03 0.00 0.00 46.19 43.07 2g0l s LEU 77 CO 0.01 -2.07 1.83 -0.26 0.23 0.00 0.00 176.35 176.09 2g0l h PHE 78 N -1.16 0.28 0.00 0.29 0.04 -1.90 -2.22 116.94 112.27 2g0l h PHE 78 Ca -0.48 -0.05 -0.09 0.00 2.80 0.00 0.00 57.97 60.16 2g0l h PHE 78 Cb 1.29 -0.07 -0.01 0.00 2.20 0.00 0.00 35.95 39.35 2g0l h PHE 78 CO 0.41 0.47 -0.42 0.38 -0.60 0.00 0.00 178.31 178.55 2g0l h ASP 79 N 0.23 0.00 0.00 2.17 2.03 -2.03 -3.47 116.42 115.36 2g0l h ASP 79 Ca 0.04 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.34 2g0l h ASP 79 Cb 0.53 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.03 2g0l h ASP 79 CO 0.04 0.42 0.00 0.61 -1.03 0.00 0.00 179.24 179.28 2g0l n GLY 80 N 0.01 1.70 3.76 7.15 0.00 -0.83 -5.11 105.19 111.85 2g0l n GLY 80 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.60 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 -1.23 2.93 0.29 2.61 2.01 -1.26 -4.63 115.64 116.36 2g0l s THR 81 Ca 0.00 0.87 -0.14 0.00 0.31 0.00 0.00 61.69 62.73 2g0l s THR 81 Cb 0.00 -3.56 -0.08 0.00 0.01 0.00 0.00 72.50 68.87 2g0l s THR 81 CO 0.00 0.18 0.69 0.00 -0.69 0.00 0.00 174.62 174.80 2g0l s ARG 82 N -1.19 3.99 -0.17 4.92 1.70 -1.26 -0.05 118.95 126.89 2g0l s ARG 82 Ca 0.51 0.61 -0.13 0.00 -0.47 0.00 0.00 55.73 56.25 2g0l s ARG 82 Cb -0.38 -2.54 -0.07 0.00 -0.57 0.00 0.00 34.95 31.39 2g0l s ARG 82 CO 0.47 0.22 -0.29 1.87 -1.08 0.00 0.00 175.30 176.50 2g0l n TRP 83 N -0.17 0.00 -2.99 5.89 -0.00 -0.34 -4.90 117.44 114.93 2g0l n TRP 83 Ca 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.52 2g0l n TRP 83 Cb 0.53 -0.57 0.00 0.00 -0.00 0.00 0.00 31.31 31.26 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 1.74 -1.77 3.66 5.87 0.00 -1.23 -5.01 105.19 108.45 2g0l n GLY 84 Ca -0.25 -1.25 -0.42 0.00 0.00 0.00 0.00 46.02 44.10 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 -2.75 4.78 0.54 2.61 2.01 -1.26 -0.29 115.64 121.28 2g0l s THR 85 Ca 0.00 1.81 0.07 0.00 0.31 0.00 0.00 61.69 63.88 2g0l s THR 85 Cb 0.00 -4.22 0.05 0.00 0.01 0.00 0.00 72.50 68.35 2g0l s THR 85 CO 0.00 -0.09 0.56 0.68 -0.69 0.00 0.00 174.62 175.08 2g0l s VAL 86 N 2.75 1.97 0.04 3.82 -7.23 0.16 -4.93 120.40 116.98 2g0l s VAL 86 Ca 0.40 -1.27 0.02 0.00 -1.81 0.00 0.00 61.98 59.33 2g0l s VAL 86 Cb -0.16 -2.24 -0.02 0.00 0.56 0.00 0.00 36.38 34.52 2g0l s VAL 86 CO 0.09 0.00 -0.07 -0.62 -0.31 0.00 0.00 175.10 174.19 2g0l s ASP 87 N -4.42 0.80 -0.01 4.85 2.15 -1.26 -2.77 116.67 116.01 2g0l s ASP 87 Ca 0.47 -0.49 0.01 0.00 0.43 0.00 0.00 52.55 52.96 2g0l s ASP 87 Cb -0.04 0.03 0.01 0.00 -0.30 0.00 0.00 42.92 42.62 2g0l s ASP 87 CO 0.29 -0.18 0.92 0.00 -0.17 0.00 0.00 175.17 176.03 2g0l h THR 89 N 0.59 1.42 0.00 0.00 2.02 -1.95 -3.37 112.91 111.61 2g0l h THR 89 Ca 0.00 -1.98 -0.02 0.00 0.77 0.00 0.00 66.41 65.18 2g0l h THR 89 Cb 0.62 2.49 -0.04 0.00 -1.74 0.00 0.00 68.15 69.48 2g0l h THR 89 CO 0.00 0.58 -0.34 1.07 0.37 0.00 0.00 175.52 177.19 2g0l n THR 90 N -4.25 1.05 -4.45 3.16 5.66 -1.26 -5.02 114.28 109.16 2g0l n THR 90 Ca -0.10 -1.43 -0.22 0.00 -3.05 0.00 0.00 64.05 59.26 2g0l n THR 90 Cb 0.63 0.16 -0.10 0.00 -1.55 0.00 0.00 70.33 69.47 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 -1.58 2.46 -0.20 1.79 0.00 -1.26 -5.11 121.76 117.86 2g0l s ALA 91 Ca 0.21 -1.74 -0.29 0.00 0.00 0.00 0.00 51.96 50.14 2g0l s ALA 91 Cb 0.20 0.75 0.00 0.00 0.00 0.00 0.00 23.12 24.08 2g0l s ALA 91 CO -0.01 -0.34 1.07 0.00 0.00 0.00 0.00 175.76 176.47 2g0l s ALA 92 N -3.34 3.64 -0.04 0.00 0.00 -1.26 -4.70 121.76 116.06 2g0l s ALA 92 Ca 0.32 0.26 0.05 0.00 0.00 0.00 0.00 51.96 52.59 2g0l s ALA 92 Cb 0.06 -3.54 -0.01 0.00 0.00 0.00 0.00 23.12 19.64 2g0l s ALA 92 CO 0.15 -1.00 -0.18 0.00 0.00 0.00 0.00 175.76 174.73 2g0l s GLN 94 N -0.03 1.33 -0.20 0.00 -2.07 -0.30 -1.78 119.66 116.61 2g0l s GLN 94 Ca -0.03 -1.64 -0.15 0.00 -1.82 0.00 0.00 55.36 51.73 2g0l s GLN 94 Cb -0.11 0.31 -0.04 0.00 -1.09 0.00 0.00 33.01 32.07 2g0l s GLN 94 CO 0.02 -0.47 0.34 0.08 -1.32 0.00 0.00 175.29 173.94 2g0l s VAL 95 N -4.02 5.25 -0.18 3.63 1.01 -0.60 -0.67 120.40 124.83 2g0l s VAL 95 Ca 0.37 0.58 -0.03 0.00 0.00 0.00 0.00 61.98 62.90 2g0l s VAL 95 Cb 0.05 -3.67 -0.02 0.00 0.00 0.00 0.00 36.38 32.75 2g0l s VAL 95 CO 0.14 0.29 -0.07 -0.83 0.00 0.00 0.00 175.10 174.63 2g0l s GLY 96 N 0.96 1.62 -0.05 4.51 0.00 0.38 -3.70 107.32 111.03 2g0l s GLY 96 Ca 0.16 -0.99 0.00 0.00 0.00 0.00 0.00 44.72 43.90 2g0l s GLY 96 CO 0.07 0.11 -0.03 0.48 0.00 0.00 0.00 173.10 173.73 2g0l s LEU 97 N 0.84 1.16 0.14 0.66 2.34 -1.26 -0.88 118.68 121.67 2g0l s LEU 97 Ca -0.02 -0.11 -0.15 0.00 0.06 0.00 0.00 54.13 53.91 2g0l s LEU 97 Cb -0.15 -0.42 0.03 0.00 -0.56 0.00 0.00 46.19 45.09 2g0l s LEU 97 CO 0.01 -0.09 0.40 -0.44 -1.06 0.00 0.00 176.35 175.17 2g0l s SER 98 N 1.15 -0.20 0.77 1.48 0.01 -0.69 -4.68 113.70 111.54 2g0l s SER 98 Ca -0.08 -0.41 0.00 0.00 1.31 0.00 0.00 55.95 56.77 2g0l s SER 98 Cb -0.14 0.48 0.00 0.00 0.21 0.00 0.00 66.02 66.57 2g0l s SER 98 CO -0.01 -0.88 0.00 -0.90 0.41 0.00 0.00 173.24 171.85 2g0l n ASP 99 N -0.23 0.00 0.26 2.44 5.75 -0.38 -0.32 116.55 124.06 2g0l n ASP 99 Ca -0.14 -0.99 0.12 0.00 -0.01 0.00 0.00 54.79 53.77 2g0l n ASP 99 Cb 0.63 0.00 0.68 0.00 -1.03 0.00 0.00 41.12 41.40 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 -1.43 1.21 0.12 2.12 0.00 -1.89 -2.93 119.26 116.46 2g0l h ALA 100 Ca 0.00 -0.13 -0.33 0.00 0.00 0.00 0.00 54.91 54.45 2g0l h ALA 100 Cb 0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2g0l h ALA 100 CO 0.00 0.17 -1.74 0.00 0.00 0.00 0.00 179.25 177.69 2g0l h ALA 101 N 1.86 0.37 0.00 0.00 0.00 -1.92 -3.48 119.26 116.08 2g0l h ALA 101 Ca -0.00 -1.25 0.00 0.00 0.00 0.00 0.00 54.91 53.66 2g0l h ALA 101 Cb 0.42 0.47 0.00 0.00 0.00 0.00 0.00 17.79 18.68 2g0l h ALA 101 CO 0.02 1.23 0.00 0.41 0.00 0.00 0.00 179.25 180.91 2g0l n GLY 102 N 1.79 1.99 1.74 0.00 0.00 -1.10 -5.14 105.19 104.45 2g0l n GLY 102 Ca -0.23 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.64 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 2.34 0.00 1.61 3.02 -1.26 -4.83 115.26 116.15 2g0l n ASN 103 Ca 0.00 -2.07 0.00 0.00 -0.03 0.00 0.00 54.58 52.48 2g0l n ASN 103 Cb 0.00 0.24 0.00 0.00 -0.61 0.00 0.00 39.78 39.41 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 1.80 0.45 3.73 7.41 0.00 -1.26 -1.25 105.19 116.06 2g0l n GLY 104 Ca -0.09 -2.22 -0.34 0.00 0.00 0.00 0.00 46.02 43.37 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 -0.42 2.20 0.50 1.61 0.02 -1.26 -4.99 135.00 132.67 2g0l s PRO 105 Ca 0.00 1.68 -0.20 0.00 0.02 0.00 0.00 61.00 62.50 2g0l s PRO 105 Cb 0.00 -1.85 -0.07 0.00 0.02 0.00 0.00 34.50 32.60 2g0l s PRO 105 CO 0.00 -1.77 1.09 -2.00 -0.33 0.00 0.00 177.00 173.99 2g0l s GLU 106 N -3.98 3.62 0.28 5.54 2.12 -1.26 -4.83 118.70 120.20 2g0l s GLU 106 Ca 0.73 1.52 -0.06 0.00 0.36 0.00 0.00 54.97 57.51 2g0l s GLU 106 Cb -0.27 -2.11 -0.06 0.00 0.26 0.00 0.00 34.13 31.95 2g0l s GLU 106 CO 0.45 -0.61 0.56 0.20 -0.54 0.00 0.00 175.26 175.33 2g0l s GLY 107 N -1.81 1.96 0.10 -1.50 0.00 -1.26 -4.98 107.32 99.83 2g0l s GLY 107 Ca 0.69 -0.48 0.09 0.00 0.00 0.00 0.00 44.72 45.02 2g0l s GLY 107 CO 0.25 -0.36 -0.21 0.14 0.00 0.00 0.00 173.10 172.92 2g0l s VAL 108 N -2.04 2.62 0.33 1.40 1.01 -1.24 -4.97 120.40 117.51 2g0l s VAL 108 Ca 0.45 -1.48 -0.11 0.00 0.00 0.00 0.00 61.98 60.84 2g0l s VAL 108 Cb -0.11 -2.16 -0.07 0.00 0.00 0.00 0.00 36.38 34.04 2g0l s VAL 108 CO 0.28 0.18 0.68 0.00 0.00 0.00 0.00 175.10 176.24 2g0l s ALA 109 N -1.04 3.43 0.16 5.51 0.00 -1.26 -1.55 121.76 127.00 2g0l s ALA 109 Ca 0.16 -0.19 0.07 0.00 0.00 0.00 0.00 51.96 52.00 2g0l s ALA 109 Cb -0.10 -2.61 -0.04 0.00 0.00 0.00 0.00 23.12 20.37 2g0l s ALA 109 CO 0.07 0.24 -0.16 0.96 0.00 0.00 0.00 175.76 176.87 2g0l s ILE 110 N -2.09 1.63 -0.04 0.00 -4.36 -0.73 -4.90 121.20 110.71 2g0l s ILE 110 Ca 0.50 -1.91 0.03 0.00 -0.26 0.00 0.00 60.65 59.01 2g0l s ILE 110 Cb -0.10 -1.78 0.01 0.00 1.25 0.00 0.00 42.46 41.83 2g0l s ILE 110 CO 0.25 -0.41 -0.10 -0.44 0.24 0.00 0.00 174.94 174.48 2g0l s SER 111 N -2.72 1.41 0.41 4.36 0.01 -1.26 -4.44 113.70 111.47 2g0l s SER 111 Ca 0.15 -0.22 -0.12 0.00 1.31 0.00 0.00 55.95 57.06 2g0l s SER 111 Cb -0.04 -0.46 -0.07 0.00 0.21 0.00 0.00 66.02 65.65 2g0l s SER 111 CO 0.05 0.06 0.81 -0.36 0.41 0.00 0.00 173.24 174.21 2g0l s PHE 112 N 0.34 3.45 -2.00 2.43 0.08 -1.26 0.51 117.98 121.53 2g0l s PHE 112 Ca -0.06 1.15 0.20 0.00 0.12 0.00 0.00 56.93 58.33 2g0l s PHE 112 Cb -0.11 -2.52 1.18 0.00 -0.57 0.00 0.00 43.02 41.00 2g0l s PHE 112 CO 0.01 -0.13 1.57 0.27 -0.10 0.00 0.00 175.22 176.85