#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g0k n ALA 2 N 0.00 -0.16 -1.16 0.00 0.00 -1.26 -4.70 120.51 113.23 2g0k n ALA 2 Ca 0.00 0.38 -0.11 0.00 0.00 0.00 0.00 53.44 53.71 2g0k n ALA 2 Cb 0.00 -2.23 0.13 0.00 0.00 0.00 0.00 19.45 17.35 2g0k n ALA 2 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2g0k n PRO 3 N 5.44 -1.81 -3.40 0.00 -0.04 -1.26 -3.75 135.00 130.18 2g0k n PRO 3 Ca 0.27 -1.00 -0.43 0.00 -0.04 0.00 0.00 63.50 62.29 2g0k n PRO 3 Cb 0.13 -0.86 -0.09 0.00 -0.04 0.00 0.00 33.50 32.63 2g0k n PRO 3 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 2g0k s THR 4 N -2.22 5.18 0.08 0.52 2.01 0.16 -1.05 115.64 120.33 2g0k s THR 4 Ca 0.40 -0.54 0.07 0.00 0.31 0.00 0.00 61.69 61.93 2g0k s THR 4 Cb -0.03 -3.99 -0.03 0.00 0.01 0.00 0.00 72.50 68.46 2g0k s THR 4 CO 0.30 -0.37 -0.19 0.00 -0.69 0.00 0.00 174.62 173.66 2g0k s ALA 5 N 1.88 1.63 -0.24 7.40 0.00 -1.24 0.77 121.76 131.98 2g0k s ALA 5 Ca 0.08 -1.14 -0.03 0.00 0.00 0.00 0.00 51.96 50.87 2g0k s ALA 5 Cb -0.18 -0.23 0.01 0.00 0.00 0.00 0.00 23.12 22.72 2g0k s ALA 5 CO 0.11 0.32 -0.05 0.95 0.00 0.00 0.00 175.76 177.10 2g0k s THR 6 N -1.11 3.17 0.04 0.00 -4.23 0.81 -4.86 115.64 109.47 2g0k s THR 6 Ca 0.05 -0.73 0.06 0.00 -1.18 0.00 0.00 61.69 59.88 2g0k s THR 6 Cb -0.10 -2.52 -0.03 0.00 1.34 0.00 0.00 72.50 71.19 2g0k s THR 6 CO 0.03 0.31 -0.12 -0.69 -0.54 0.00 0.00 174.62 173.61 2g0k s VAL 7 N 1.41 3.22 0.94 2.29 1.01 -1.24 -1.15 120.40 126.88 2g0k s VAL 7 Ca 0.03 -1.06 -0.12 0.00 0.00 0.00 0.00 61.98 60.83 2g0k s VAL 7 Cb -0.15 -2.41 0.15 0.00 0.00 0.00 0.00 36.38 33.97 2g0k s VAL 7 CO -0.04 0.30 1.09 0.28 0.00 0.00 0.00 175.10 176.74 2g0k s THR 8 N -1.02 2.43 -0.19 3.92 -1.32 -0.57 -4.88 115.64 114.01 2g0k s THR 8 Ca 0.17 0.14 -0.29 0.00 -1.21 0.00 0.00 61.69 60.50 2g0k s THR 8 Cb -0.11 -2.62 -0.02 0.00 -1.51 0.00 0.00 72.50 68.24 2g0k s THR 8 CO 0.08 -0.18 1.44 -2.16 -2.21 0.00 0.00 174.62 171.58 2g0k s PRO 9 N -4.94 4.04 -0.02 7.08 0.04 -1.26 -4.64 135.00 135.30 2g0k s PRO 9 Ca 0.64 1.67 0.04 0.00 0.04 0.00 0.00 61.00 63.38 2g0k s PRO 9 Cb -0.18 -3.90 0.06 0.00 0.04 0.00 0.00 34.50 30.51 2g0k s PRO 9 CO 0.57 -0.98 0.90 0.45 0.04 0.00 0.00 177.00 177.98 2g0k n SER 10 N 7.42 1.31 -4.47 6.66 2.88 -1.26 -4.89 113.62 121.27 2g0k n SER 10 Ca 0.16 -1.95 -0.43 0.00 -1.33 0.00 0.00 58.87 55.32 2g0k n SER 10 Cb 0.45 -0.11 -0.06 0.00 -0.75 0.00 0.00 64.21 63.74 2g0k n SER 10 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2g0k s SER 11 N -1.10 6.26 0.00 -3.46 1.04 -1.21 -3.77 113.70 111.46 2g0k s SER 11 Ca 0.06 -0.71 0.00 0.00 0.48 0.00 0.00 55.95 55.78 2g0k s SER 11 Cb 0.05 -2.32 0.00 0.00 0.10 0.00 0.00 66.02 63.86 2g0k s SER 11 CO 0.01 -0.92 0.00 0.61 0.98 0.00 0.00 173.24 173.92 2g0k n GLY 12 N 5.14 1.29 3.60 7.32 0.00 -0.97 -4.39 105.19 117.18 2g0k n GLY 12 Ca -0.04 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.64 2g0k n GLY 12 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2g0k s LEU 13 N 0.00 3.25 0.70 0.99 1.43 -1.25 -4.51 118.68 119.29 2g0k s LEU 13 Ca 0.00 -0.00 -0.04 0.00 -1.03 0.00 0.00 54.13 53.06 2g0k s LEU 13 Cb 0.00 -1.73 0.09 0.00 0.03 0.00 0.00 46.19 44.58 2g0k s LEU 13 CO 0.00 0.36 0.98 -0.94 0.23 0.00 0.00 176.35 176.98 2g0k s SER 14 N -0.90 4.60 0.64 2.29 1.04 -1.26 -4.87 113.70 115.25 2g0k s SER 14 Ca 0.13 0.07 -0.17 0.00 0.48 0.00 0.00 55.95 56.46 2g0k s SER 14 Cb -0.11 -0.63 -0.11 0.00 0.10 0.00 0.00 66.02 65.27 2g0k s SER 14 CO 0.02 -1.69 0.09 -0.90 0.98 0.00 0.00 173.24 171.74 2g0k n ASP 15 N -2.85 -2.81 0.00 7.02 5.75 -1.26 -2.23 116.55 120.17 2g0k n ASP 15 Ca 0.11 0.59 0.00 0.00 -0.01 0.00 0.00 54.79 55.48 2g0k n ASP 15 Cb 0.60 -1.00 0.00 0.00 -1.03 0.00 0.00 41.12 39.69 2g0k n ASP 15 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2g0k n GLY 16 N 2.27 3.28 3.74 6.12 0.00 -1.26 -5.04 105.19 114.30 2g0k n GLY 16 Ca 0.08 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.74 2g0k n GLY 16 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2g0k s THR 17 N -2.49 2.42 -0.17 2.61 2.01 -0.95 -4.97 115.64 114.10 2g0k s THR 17 Ca 0.00 0.25 -0.01 0.00 0.31 0.00 0.00 61.69 62.24 2g0k s THR 17 Cb 0.00 -3.07 0.05 0.00 0.01 0.00 0.00 72.50 69.49 2g0k s THR 17 CO 0.00 -0.06 -0.03 0.68 -0.69 0.00 0.00 174.62 174.52 2g0k s VAL 18 N -1.57 0.98 -0.29 3.82 -7.23 -1.26 -3.16 120.40 111.69 2g0k s VAL 18 Ca 0.79 -0.62 -0.14 0.00 -1.81 0.00 0.00 61.98 60.21 2g0k s VAL 18 Cb -0.32 -1.23 -0.04 0.00 0.56 0.00 0.00 36.38 35.35 2g0k s VAL 18 CO 0.36 0.05 0.30 0.68 -0.31 0.00 0.00 175.10 176.19 2g0k s VAL 19 N 1.68 5.22 0.38 1.32 -7.23 -0.40 -4.91 120.40 116.47 2g0k s VAL 19 Ca 0.00 0.32 -0.24 0.00 -1.81 0.00 0.00 61.98 60.25 2g0k s VAL 19 Cb -0.16 -3.66 -0.10 0.00 0.56 0.00 0.00 36.38 33.03 2g0k s VAL 19 CO -0.07 0.14 1.00 -0.75 -0.31 0.00 0.00 175.10 175.11 2g0k s LYS 20 N 1.94 4.32 -0.28 4.82 2.36 -1.26 -1.00 119.74 130.64 2g0k s LYS 20 Ca 0.11 1.39 -0.01 0.00 -2.55 0.00 0.00 55.97 54.91 2g0k s LYS 20 Cb -0.16 -2.57 0.09 0.00 -1.05 0.00 0.00 37.83 34.14 2g0k s LYS 20 CO 0.11 0.02 0.07 0.08 1.55 0.00 0.00 175.35 177.17 2g0k s VAL 21 N -1.72 0.91 -0.25 4.02 1.01 -0.81 -1.51 120.40 122.04 2g0k s VAL 21 Ca 0.56 -1.25 -0.03 0.00 0.00 0.00 0.00 61.98 61.26 2g0k s VAL 21 Cb -0.19 -1.59 0.02 0.00 0.00 0.00 0.00 36.38 34.62 2g0k s VAL 21 CO 0.24 -0.53 -0.03 0.00 0.00 0.00 0.00 175.10 174.78 2g0k s ALA 22 N 1.62 2.79 0.18 5.51 0.00 -0.30 -2.32 121.76 129.23 2g0k s ALA 22 Ca 0.06 -1.39 -0.18 0.00 0.00 0.00 0.00 51.96 50.45 2g0k s ALA 22 Cb -0.17 -1.78 -0.08 0.00 0.00 0.00 0.00 23.12 21.09 2g0k s ALA 22 CO -0.20 -0.75 0.64 0.20 0.00 0.00 0.00 175.76 175.66 2g0k s GLY 23 N 1.39 2.57 -0.21 0.00 0.00 -0.91 0.28 107.32 110.45 2g0k s GLY 23 Ca 0.02 0.04 -0.04 0.00 0.00 0.00 0.00 44.72 44.75 2g0k s GLY 23 CO -0.03 0.38 0.07 0.00 0.00 0.00 0.00 173.10 173.53 2g0k s ALA 24 N -1.45 0.80 0.00 3.20 0.00 4.05 -2.96 121.76 125.40 2g0k s ALA 24 Ca 0.39 -0.69 0.00 0.00 0.00 0.00 0.00 51.96 51.66 2g0k s ALA 24 Cb -0.16 -1.19 0.00 0.00 0.00 0.00 0.00 23.12 21.76 2g0k s ALA 24 CO 0.20 -1.27 0.00 0.41 0.00 0.00 0.00 175.76 175.10 2g0k n GLY 25 N 5.14 1.55 2.30 0.00 0.00 -1.26 0.40 105.19 113.31 2g0k n GLY 25 Ca -0.07 -0.03 -0.15 0.00 0.00 0.00 0.00 46.02 45.76 2g0k n GLY 25 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2g0k n LEU 26 N 0.00 0.00 -4.67 0.99 4.77 -1.02 -4.69 117.00 112.38 2g0k n LEU 26 Ca 0.00 -1.12 -0.43 0.00 -0.03 0.00 0.00 56.01 54.44 2g0k n LEU 26 Cb 0.01 -0.46 -0.02 0.00 -2.33 0.00 0.00 43.42 40.62 2g0k n LEU 26 CO 0.00 -0.88 1.06 -1.10 -1.33 0.00 0.00 177.39 175.14 2g0k s GLN 27 N -4.25 4.27 0.10 3.23 -0.21 -1.26 -4.63 119.66 116.91 2g0k s GLN 27 Ca 0.41 1.73 -0.31 0.00 0.02 0.00 0.00 55.36 57.22 2g0k s GLN 27 Cb -0.02 -3.69 -0.07 0.00 1.00 0.00 0.00 33.01 30.23 2g0k s GLN 27 CO 0.28 -0.62 1.27 0.00 -2.12 0.00 0.00 175.29 174.10 2g0k s ALA 28 N 2.99 3.47 0.00 6.09 0.00 -1.26 -2.19 121.76 130.86 2g0k s ALA 28 Ca 0.57 0.97 0.00 0.00 0.00 0.00 0.00 51.96 53.50 2g0k s ALA 28 Cb -0.24 -3.48 0.00 0.00 0.00 0.00 0.00 23.12 19.40 2g0k s ALA 28 CO 0.19 -0.49 0.00 0.41 0.00 0.00 0.00 175.76 175.87 2g0k n GLY 29 N 3.14 0.39 3.86 0.00 0.00 -0.89 -4.96 105.19 106.73 2g0k n GLY 29 Ca 0.09 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.74 2g0k n GLY 29 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2g0k s THR 30 N -1.84 5.32 0.32 2.61 2.01 -0.93 -4.85 115.64 118.29 2g0k s THR 30 Ca 0.00 0.45 -0.11 0.00 0.31 0.00 0.00 61.69 62.34 2g0k s THR 30 Cb 0.00 -3.52 -0.07 0.00 0.01 0.00 0.00 72.50 68.92 2g0k s THR 30 CO 0.00 0.60 0.69 0.00 -0.69 0.00 0.00 174.62 175.22 2g0k s ALA 31 N -1.04 3.41 0.03 7.40 0.00 -1.26 -1.20 121.76 129.10 2g0k s ALA 31 Ca 0.18 -0.17 0.01 0.00 0.00 0.00 0.00 51.96 51.99 2g0k s ALA 31 Cb -0.14 -2.63 -0.02 0.00 0.00 0.00 0.00 23.12 20.33 2g0k s ALA 31 CO 0.08 0.25 -0.06 0.71 0.00 0.00 0.00 175.76 176.74 2g0k s TYR 32 N -2.08 0.51 -0.28 0.00 2.02 -0.37 -3.34 117.35 113.81 2g0k s TYR 32 Ca 0.51 -0.50 -0.04 0.00 -0.37 0.00 0.00 57.07 56.67 2g0k s TYR 32 Cb -0.10 -0.32 0.02 0.00 -0.40 0.00 0.00 41.96 41.16 2g0k s TYR 32 CO 0.24 -0.12 0.02 -0.51 -1.57 0.00 0.00 175.55 173.61 2g0k s ASP 33 N -1.49 4.82 -0.07 2.29 1.01 9.71 -2.97 116.67 129.97 2g0k s ASP 33 Ca -0.12 -0.89 -0.05 0.00 0.71 0.00 0.00 52.55 52.21 2g0k s ASP 33 Cb -0.10 -1.78 -0.04 0.00 1.01 0.00 0.00 42.92 42.02 2g0k s ASP 33 CO -0.00 -0.19 0.14 -0.69 0.21 0.00 0.00 175.17 174.63 2g0k s VAL 34 N 1.39 5.31 0.03 -1.27 1.01 -0.73 1.10 120.40 127.24 2g0k s VAL 34 Ca 0.00 -0.01 -0.28 0.00 0.00 0.00 0.00 61.98 61.69 2g0k s VAL 34 Cb -0.18 -3.37 0.09 0.00 0.00 0.00 0.00 36.38 32.93 2g0k s VAL 34 CO -0.01 0.50 0.99 -0.83 0.00 0.00 0.00 175.10 175.75 2g0k s GLY 35 N -1.38 -0.36 -0.34 4.51 0.00 2.05 -0.36 107.32 111.43 2g0k s GLY 35 Ca 0.20 0.74 -0.09 0.00 0.00 0.00 0.00 44.72 45.57 2g0k s GLY 35 CO 0.09 0.22 0.15 1.62 0.00 0.00 0.00 173.10 175.18 2g0k s GLN 36 N -3.03 2.87 0.12 2.90 0.74 -1.25 -0.93 119.66 121.07 2g0k s GLN 36 Ca 0.09 -1.03 0.06 0.00 0.05 0.00 0.00 55.36 54.53 2g0k s GLN 36 Cb -0.01 -3.57 -0.04 0.00 1.10 0.00 0.00 33.01 30.50 2g0k s GLN 36 CO -0.04 -0.61 -0.04 0.00 -0.55 0.00 0.00 175.29 174.04 2g0k s ALA 38 N -1.39 1.21 -0.05 0.00 0.00 0.79 -2.29 121.76 120.03 2g0k s ALA 38 Ca 0.24 -0.42 -0.30 0.00 0.00 0.00 0.00 51.96 51.49 2g0k s ALA 38 Cb -0.11 -0.68 -0.06 0.00 0.00 0.00 0.00 23.12 22.27 2g0k s ALA 38 CO 0.16 -0.10 1.76 -0.46 0.00 0.00 0.00 175.76 177.12 2g0k s TRP 39 N 1.09 1.77 -0.25 0.00 -0.00 -1.24 -0.23 118.94 120.08 2g0k s TRP 39 Ca -0.07 0.07 -0.02 0.00 -0.00 0.00 0.00 56.10 56.08 2g0k s TRP 39 Cb -0.14 -4.01 -0.15 0.00 -0.00 0.00 0.00 33.47 29.17 2g0k s TRP 39 CO -0.01 -4.22 -0.25 1.33 -0.00 0.00 0.00 176.95 173.80 2g0k n VAL 40 N 5.69 1.43 -4.16 5.86 0.24 0.92 -4.78 118.33 123.53 2g0k n VAL 40 Ca 0.19 -0.50 -0.10 0.00 -2.04 0.00 0.00 64.34 61.89 2g0k n VAL 40 Cb 0.43 -1.51 -0.10 0.00 -1.47 0.00 0.00 33.84 31.19 2g0k n VAL 40 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 2g0k s ASP 41 N -6.67 0.39 -0.30 -1.34 1.01 0.35 -5.00 116.67 105.12 2g0k s ASP 41 Ca -0.34 -1.22 -0.36 0.00 0.71 0.00 0.00 52.55 51.34 2g0k s ASP 41 Cb 0.10 0.28 -0.12 0.00 1.01 0.00 0.00 42.92 44.20 2g0k s ASP 41 CO 0.54 -0.72 2.09 1.07 0.21 0.00 0.00 175.17 178.36 2g0k n THR 42 N -0.12 0.26 -0.96 -1.27 5.66 -1.26 0.19 114.28 116.78 2g0k n THR 42 Ca -0.05 -0.21 0.00 0.00 -3.05 0.00 0.00 64.05 60.73 2g0k n THR 42 Cb 0.64 -1.64 0.00 0.00 -1.55 0.00 0.00 70.33 67.78 2g0k n THR 42 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2g0k n GLY 43 N 5.91 0.33 2.97 1.09 0.00 -1.26 -4.96 105.19 109.27 2g0k n GLY 43 Ca 0.36 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.07 2g0k n GLY 43 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2g0k s VAL 44 N -1.76 1.85 -0.04 1.61 1.01 0.51 -5.05 120.40 118.53 2g0k s VAL 44 Ca 0.00 -1.74 0.06 0.00 0.00 0.00 0.00 61.98 60.30 2g0k s VAL 44 Cb 0.00 -2.20 -0.01 0.00 0.00 0.00 0.00 36.38 34.17 2g0k s VAL 44 CO 0.00 -0.34 -0.22 -1.48 0.00 0.00 0.00 175.10 173.06 2g0k s LEU 45 N 1.18 2.02 0.39 3.92 2.34 -1.26 0.13 118.68 127.41 2g0k s LEU 45 Ca 0.02 -0.42 -0.06 0.00 0.06 0.00 0.00 54.13 53.73 2g0k s LEU 45 Cb -0.19 -1.17 -0.05 0.00 -0.56 0.00 0.00 46.19 44.23 2g0k s LEU 45 CO -0.09 0.23 0.69 0.00 -1.06 0.00 0.00 176.35 176.12 2g0k s ALA 46 N -0.27 3.49 0.15 1.48 0.00 0.68 -2.75 121.76 124.53 2g0k s ALA 46 Ca 0.02 -0.50 0.10 0.00 0.00 0.00 0.00 51.96 51.58 2g0k s ALA 46 Cb -0.11 -2.48 -0.04 0.00 0.00 0.00 0.00 23.12 20.49 2g0k s ALA 46 CO 0.01 -0.07 -0.24 0.00 0.00 0.00 0.00 175.76 175.46 2g0k s ASN 48 N -2.29 5.00 0.00 0.00 2.47 -0.88 0.13 114.94 119.38 2g0k s ASN 48 Ca 0.15 -1.61 0.20 0.00 0.42 0.00 0.00 52.86 52.02 2g0k s ASN 48 Cb -0.09 -1.74 1.15 0.00 -1.45 0.00 0.00 41.25 39.12 2g0k s ASN 48 CO 0.07 -0.37 1.57 -0.81 -3.72 0.00 0.00 177.10 173.85 2g0k n PRO 49 N 4.58 0.56 0.02 0.43 -0.04 -1.26 -2.02 135.00 137.27 2g0k n PRO 49 Ca -0.08 0.02 0.12 0.00 -0.04 0.00 0.00 63.50 63.52 2g0k n PRO 49 Cb 0.43 -1.50 0.21 0.00 -0.04 0.00 0.00 33.50 32.59 2g0k n PRO 49 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2g0k n ALA 50 N -1.05 3.37 -1.99 0.55 0.00 -1.26 -3.96 120.51 116.17 2g0k n ALA 50 Ca 0.14 -0.33 0.04 0.00 0.00 0.00 0.00 53.44 53.29 2g0k n ALA 50 Cb 0.08 -1.12 0.08 0.00 0.00 0.00 0.00 19.45 18.49 2g0k n ALA 50 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2g0k n ASP 51 N -1.71 1.12 -4.61 0.00 9.92 -0.86 -5.02 116.55 115.39 2g0k n ASP 51 Ca 0.05 -2.59 -0.39 0.00 -0.53 0.00 0.00 54.79 51.33 2g0k n ASP 51 Cb 0.37 -0.35 -0.09 0.00 -0.64 0.00 0.00 41.12 40.41 2g0k n ASP 51 CO 0.00 0.00 0.00 0.72 0.13 0.00 0.00 177.20 178.05 2g0k s PHE 52 N -1.14 3.26 0.26 1.24 -0.12 -1.17 -3.92 117.98 116.39 2g0k s PHE 52 Ca 0.27 0.35 0.02 0.00 -0.05 0.00 0.00 56.93 57.51 2g0k s PHE 52 Cb 0.28 -2.50 0.02 0.00 -0.63 0.00 0.00 43.02 40.19 2g0k s PHE 52 CO -0.08 -0.17 0.13 0.45 -0.05 0.00 0.00 175.22 175.49 2g0k n SER 53 N 5.12 2.14 -3.87 1.98 2.88 0.51 -4.96 113.62 117.42 2g0k n SER 53 Ca -0.10 -1.97 -0.10 0.00 -1.33 0.00 0.00 58.87 55.37 2g0k n SER 53 Cb 0.51 0.05 -0.08 0.00 -0.75 0.00 0.00 64.21 63.94 2g0k n SER 53 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2g0k s SER 54 N -2.49 0.10 -0.04 -3.46 1.04 -1.26 -2.28 113.70 105.31 2g0k s SER 54 Ca 0.10 -0.52 -0.29 0.00 0.48 0.00 0.00 55.95 55.71 2g0k s SER 54 Cb -0.01 0.30 0.10 0.00 0.10 0.00 0.00 66.02 66.52 2g0k s SER 54 CO 0.06 -0.63 0.89 0.54 0.98 0.00 0.00 173.24 175.08 2g0k s VAL 55 N -3.17 0.00 -0.09 5.02 0.11 -1.16 -4.96 120.40 116.16 2g0k s VAL 55 Ca -0.00 0.00 0.02 0.00 -2.93 0.00 0.00 61.98 59.06 2g0k s VAL 55 Cb 0.02 -1.00 0.01 0.00 -1.53 0.00 0.00 36.38 33.88 2g0k s VAL 55 CO -0.07 0.00 -0.13 -0.89 -3.33 0.00 0.00 175.10 170.68 2g0k s THR 56 N -2.53 1.25 0.55 5.04 2.01 -1.26 -1.24 115.64 119.45 2g0k s THR 56 Ca 0.02 -0.51 -0.22 0.00 0.31 0.00 0.00 61.69 61.29 2g0k s THR 56 Cb -0.01 -1.15 -0.05 0.00 0.01 0.00 0.00 72.50 71.30 2g0k s THR 56 CO -0.05 0.39 1.37 0.00 -0.69 0.00 0.00 174.62 175.63 2g0k n ALA 57 N 4.08 1.63 -1.86 7.40 0.00 -0.34 -4.83 120.51 126.59 2g0k n ALA 57 Ca -0.20 0.13 -0.05 0.00 0.00 0.00 0.00 53.44 53.32 2g0k n ALA 57 Cb 0.51 -2.36 0.03 0.00 0.00 0.00 0.00 19.45 17.63 2g0k n ALA 57 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2g0k n ASP 58 N -1.04 0.17 0.26 0.00 5.68 -0.91 -2.10 116.55 118.61 2g0k n ASP 58 Ca 0.10 -1.18 0.10 0.00 -0.50 0.00 0.00 54.79 53.31 2g0k n ASP 58 Cb 0.45 -0.16 0.69 0.00 -1.14 0.00 0.00 41.12 40.95 2g0k n ASP 58 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2g0k h ALA 59 N -1.08 1.76 0.00 2.12 0.00 -1.93 0.19 119.26 120.32 2g0k h ALA 59 Ca -0.08 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.79 2g0k h ALA 59 Cb 0.25 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2g0k h ALA 59 CO 0.07 0.06 0.00 0.09 0.00 0.00 0.00 179.25 179.47 2g0k n ASN 60 N -4.25 0.16 0.00 0.00 4.13 -1.26 -4.83 115.26 109.21 2g0k n ASN 60 Ca -0.03 0.52 0.00 0.00 1.68 0.00 0.00 54.58 56.75 2g0k n ASN 60 Cb 0.13 -0.56 0.00 0.00 -1.54 0.00 0.00 39.78 37.81 2g0k n ASN 60 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2g0k n GLY 61 N 0.95 0.88 3.80 7.41 0.00 0.67 -4.77 105.19 114.14 2g0k n GLY 61 Ca 0.05 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.70 2g0k n GLY 61 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2g0k s SER 62 N -2.88 6.69 0.31 1.61 1.04 -1.26 -2.44 113.70 116.76 2g0k s SER 62 Ca 0.00 0.82 0.09 0.00 0.48 0.00 0.00 55.95 57.34 2g0k s SER 62 Cb 0.00 -2.23 -0.06 0.00 0.10 0.00 0.00 66.02 63.83 2g0k s SER 62 CO 0.00 0.24 -0.11 0.00 0.98 0.00 0.00 173.24 174.35 2g0k s ALA 63 N -0.54 2.73 -0.15 5.32 0.00 -1.16 -2.15 121.76 125.82 2g0k s ALA 63 Ca 0.22 -1.98 -0.08 0.00 0.00 0.00 0.00 51.96 50.12 2g0k s ALA 63 Cb -0.15 -0.04 0.05 0.00 0.00 0.00 0.00 23.12 22.98 2g0k s ALA 63 CO 0.10 0.09 0.36 -1.54 0.00 0.00 0.00 175.76 174.77 2g0k s SER 64 N -3.54 -0.44 0.32 0.00 1.04 -1.26 -2.14 113.70 107.69 2g0k s SER 64 Ca 0.31 0.77 -0.14 0.00 0.48 0.00 0.00 55.95 57.37 2g0k s SER 64 Cb 0.01 0.65 0.02 0.00 0.10 0.00 0.00 66.02 66.81 2g0k s SER 64 CO 0.15 -0.18 0.65 0.28 0.98 0.00 0.00 173.24 175.12 2g0k s THR 65 N 1.35 0.00 -0.10 2.02 -1.32 -0.98 -4.91 115.64 111.70 2g0k s THR 65 Ca -0.09 -1.19 0.02 0.00 -1.21 0.00 0.00 61.69 59.22 2g0k s THR 65 Cb -0.09 -2.47 0.01 0.00 -1.51 0.00 0.00 72.50 68.44 2g0k s THR 65 CO -0.11 0.00 -0.16 -0.44 -2.21 0.00 0.00 174.62 171.69 2g0k s SER 66 N -3.05 2.47 -0.23 8.08 0.01 -1.26 -1.93 113.70 117.78 2g0k s SER 66 Ca 0.18 -0.44 -0.04 0.00 1.31 0.00 0.00 55.95 56.96 2g0k s SER 66 Cb -0.04 -1.11 -0.01 0.00 0.21 0.00 0.00 66.02 65.07 2g0k s SER 66 CO 0.11 0.04 -0.02 -0.22 0.41 0.00 0.00 173.24 173.56 2g0k s LEU 67 N 0.84 3.03 0.17 2.44 1.98 -0.17 -4.80 118.68 122.18 2g0k s LEU 67 Ca -0.09 -0.41 -0.29 0.00 -2.89 0.00 0.00 54.13 50.44 2g0k s LEU 67 Cb -0.15 -1.77 -0.07 0.00 0.66 0.00 0.00 46.19 44.86 2g0k s LEU 67 CO 0.01 -0.04 0.92 0.28 -1.89 0.00 0.00 176.35 175.63 2g0k s THR 68 N 1.49 4.31 -0.17 3.68 -1.32 -1.26 -1.27 115.64 121.10 2g0k s THR 68 Ca 0.05 2.02 -0.05 0.00 -1.21 0.00 0.00 61.69 62.50 2g0k s THR 68 Cb -0.15 -4.30 -0.03 0.00 -1.51 0.00 0.00 72.50 66.52 2g0k s THR 68 CO -0.02 0.42 -0.00 0.54 -2.21 0.00 0.00 174.62 173.35 2g0k s VAL 69 N -0.64 4.10 -0.01 5.08 0.11 -1.19 -4.79 120.40 123.07 2g0k s VAL 69 Ca 0.43 -0.27 0.07 0.00 -2.93 0.00 0.00 61.98 59.27 2g0k s VAL 69 Cb -0.24 -2.83 -0.03 0.00 -1.53 0.00 0.00 36.38 31.75 2g0k s VAL 69 CO 0.30 0.47 -0.21 -0.13 -3.33 0.00 0.00 175.10 172.20 2g0k s ARG 70 N 0.56 2.18 0.22 1.54 3.00 -1.26 -4.10 118.95 121.08 2g0k s ARG 70 Ca -0.01 -0.90 -0.09 0.00 0.00 0.00 0.00 55.73 54.74 2g0k s ARG 70 Cb -0.14 -2.17 0.23 0.00 0.00 0.00 0.00 34.95 32.88 2g0k s ARG 70 CO 0.02 0.57 1.85 0.00 0.00 0.00 0.00 175.30 177.74 2g0k h ARG 71 N 5.14 0.87 -3.64 3.54 3.08 -1.91 -3.42 114.38 118.05 2g0k h ARG 71 Ca -0.46 -0.05 -0.10 0.00 0.07 0.00 0.00 59.98 59.44 2g0k h ARG 71 Cb 1.14 -0.20 -0.16 0.00 0.08 0.00 0.00 29.97 30.83 2g0k h ARG 71 CO 0.48 0.58 -0.37 0.45 -1.07 0.00 0.00 179.97 180.03 2g0k s SER 72 N -5.76 0.06 -0.24 7.04 0.15 -1.25 -0.12 113.70 113.57 2g0k s SER 72 Ca -0.13 -0.46 -0.35 0.00 0.70 0.00 0.00 55.95 55.71 2g0k s SER 72 Cb 0.16 0.31 0.15 0.00 -1.71 0.00 0.00 66.02 64.94 2g0k s SER 72 CO 0.78 -0.62 1.28 0.72 1.20 0.00 0.00 173.24 176.59 2g0k s PHE 73 N -3.05 -0.08 -0.26 3.44 -0.12 -0.70 -4.92 117.98 112.29 2g0k s PHE 73 Ca -0.01 0.07 -0.32 0.00 -0.05 0.00 0.00 56.93 56.62 2g0k s PHE 73 Cb 0.01 0.50 -0.09 0.00 -0.63 0.00 0.00 43.02 42.82 2g0k s PHE 73 CO -0.07 -0.12 2.16 -0.85 -0.05 0.00 0.00 175.22 176.29 2g0k n GLU 74 N 0.07 1.58 -2.38 1.99 0.28 -1.26 0.13 120.64 121.06 2g0k n GLU 74 Ca 0.02 0.46 -0.40 0.00 -0.16 0.00 0.00 57.16 57.08 2g0k n GLU 74 Cb 0.58 -2.79 -0.03 0.00 1.43 0.00 0.00 31.44 30.63 2g0k n GLU 74 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 2g0k s GLY 75 N 7.23 0.67 -0.71 -1.84 0.00 0.19 -4.08 107.32 108.78 2g0k s GLY 75 Ca 1.04 -1.21 -0.24 0.00 0.00 0.00 0.00 44.72 44.31 2g0k s GLY 75 CO 0.44 2.92 1.12 -1.36 0.00 0.00 0.00 173.10 176.22 2g0k s PHE 76 N 6.87 2.51 0.18 1.90 0.08 0.36 -1.04 117.98 128.84 2g0k s PHE 76 Ca 0.47 -0.36 -0.33 0.00 0.12 0.00 0.00 56.93 56.82 2g0k s PHE 76 Cb -0.09 -4.45 -0.14 0.00 -0.57 0.00 0.00 43.02 37.77 2g0k s PHE 76 CO 0.15 -1.84 1.50 -0.11 -0.10 0.00 0.00 175.22 174.82 2g0k n LEU 77 N 8.43 2.93 -0.35 -0.37 7.94 0.15 0.21 117.00 135.94 2g0k n LEU 77 Ca 0.01 1.10 0.26 0.00 -1.11 0.00 0.00 56.01 56.27 2g0k n LEU 77 Cb 0.47 -1.40 0.54 0.00 0.53 0.00 0.00 43.42 43.56 2g0k n LEU 77 CO 0.67 -0.43 1.22 2.19 -1.11 0.00 0.00 177.39 179.93 2g0k h PHE 78 N 5.29 0.63 0.00 1.96 -5.15 -1.82 1.61 116.94 119.46 2g0k h PHE 78 Ca -0.45 0.02 0.00 0.00 -0.20 0.00 0.00 57.97 57.34 2g0k h PHE 78 Cb 1.27 -0.18 0.00 0.00 0.22 0.00 0.00 35.95 37.26 2g0k h PHE 78 CO 0.60 0.00 0.12 0.22 -2.00 0.00 0.00 178.31 177.25 2g0k h ASP 79 N 0.33 0.00 0.00 -0.68 1.82 -1.88 -3.44 116.42 112.57 2g0k h ASP 79 Ca 0.64 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 57.28 2g0k h ASP 79 Cb 1.73 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.74 2g0k h ASP 79 CO -0.32 0.00 0.00 0.61 -1.61 0.00 0.00 179.24 177.92 2g0k n GLY 80 N -1.22 1.69 3.47 -0.78 0.00 0.55 -5.10 105.19 103.80 2g0k n GLY 80 Ca -0.02 -0.10 -0.31 0.00 0.00 0.00 0.00 46.02 45.60 2g0k n GLY 80 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2g0k s THR 81 N -2.00 2.88 -0.81 2.61 2.01 -1.05 -4.93 115.64 114.34 2g0k s THR 81 Ca 0.00 -1.14 -0.23 0.00 0.31 0.00 0.00 61.69 60.63 2g0k s THR 81 Cb 0.00 -2.22 0.07 0.00 0.01 0.00 0.00 72.50 70.37 2g0k s THR 81 CO 0.00 0.34 1.17 -0.60 -0.69 0.00 0.00 174.62 174.84 2g0k s ARG 82 N -1.44 3.34 0.03 4.92 3.52 -1.26 0.31 118.95 128.37 2g0k s ARG 82 Ca 0.15 -1.00 -0.27 0.00 -0.13 0.00 0.00 55.73 54.48 2g0k s ARG 82 Cb -0.11 -4.62 -0.16 0.00 -1.56 0.00 0.00 34.95 28.50 2g0k s ARG 82 CO 0.06 -1.95 1.28 2.35 -0.81 0.00 0.00 175.30 176.23 2g0k h TRP 83 N 9.53 -0.67 0.00 5.12 7.01 -1.46 -3.48 115.95 132.00 2g0k h TRP 83 Ca -0.08 -0.02 0.00 0.00 2.11 0.00 0.00 58.89 60.91 2g0k h TRP 83 Cb 1.04 0.22 0.00 0.00 -2.10 0.00 0.00 29.16 28.32 2g0k h TRP 83 CO 1.11 -0.34 0.00 0.41 -2.79 0.00 0.00 178.44 176.83 2g0k n GLY 84 N -0.71 3.10 3.56 2.65 0.00 -1.21 -4.94 105.19 107.64 2g0k n GLY 84 Ca -0.11 -1.56 -0.40 0.00 0.00 0.00 0.00 46.02 43.95 2g0k n GLY 84 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2g0k n THR 85 N -1.77 0.10 -2.66 2.61 -1.04 -1.26 0.55 114.28 110.81 2g0k n THR 85 Ca 0.00 -0.59 -0.31 0.00 -2.04 0.00 0.00 64.05 61.10 2g0k n THR 85 Cb 0.00 -2.52 -0.04 0.00 -1.82 0.00 0.00 70.33 65.96 2g0k n THR 85 CO 0.00 0.00 0.00 0.68 -0.64 0.00 0.00 175.07 175.11 2g0k s VAL 86 N 10.21 4.65 -0.49 12.58 -7.23 0.12 -4.73 120.40 135.51 2g0k s VAL 86 Ca 1.02 0.95 0.02 0.00 -1.81 0.00 0.00 61.98 62.16 2g0k s VAL 86 Cb -0.34 -3.71 0.13 0.00 0.56 0.00 0.00 36.38 33.01 2g0k s VAL 86 CO 0.33 -0.57 0.24 -1.81 -0.31 0.00 0.00 175.10 172.98 2g0k s ASP 87 N -3.02 4.69 0.55 4.85 1.11 -1.26 -1.72 116.67 121.87 2g0k s ASP 87 Ca 0.55 -2.70 0.32 0.00 0.18 0.00 0.00 52.55 50.91 2g0k s ASP 87 Cb -0.10 -1.70 1.49 0.00 1.07 0.00 0.00 42.92 43.68 2g0k s ASP 87 CO 0.30 -0.32 1.86 0.00 1.18 0.00 0.00 175.17 178.18 2g0k n THR 89 N -4.15 0.11 -0.02 0.00 5.66 -1.24 -2.65 114.28 111.99 2g0k n THR 89 Ca 0.19 0.03 -0.01 0.00 -3.05 0.00 0.00 64.05 61.20 2g0k n THR 89 Cb 1.00 -0.69 -0.04 0.00 -1.55 0.00 0.00 70.33 69.05 2g0k n THR 89 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 175.07 172.43 2g0k n THR 90 N -1.08 0.24 -3.42 1.09 -1.04 0.64 -4.93 114.28 105.78 2g0k n THR 90 Ca 0.14 -0.17 0.00 0.00 -2.04 0.00 0.00 64.05 61.98 2g0k n THR 90 Cb 0.10 -0.56 0.00 0.00 -1.82 0.00 0.00 70.33 68.05 2g0k n THR 90 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2g0k n ALA 91 N -2.04 0.00 -2.91 2.41 0.00 -0.65 -5.07 120.51 112.25 2g0k n ALA 91 Ca -0.06 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.02 2g0k n ALA 91 Cb 0.52 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.85 2g0k n ALA 91 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2g0k s ALA 92 N -2.00 3.28 0.25 0.00 0.00 -1.26 -4.42 121.76 117.61 2g0k s ALA 92 Ca 0.00 -1.00 0.06 0.00 0.00 0.00 0.00 51.96 51.03 2g0k s ALA 92 Cb 0.00 -2.07 -0.03 0.00 0.00 0.00 0.00 23.12 21.02 2g0k s ALA 92 CO 0.00 -0.27 0.25 0.00 0.00 0.00 0.00 175.76 175.74 2g0k s GLN 94 N -3.89 0.99 0.34 0.00 -2.07 -0.97 0.04 119.66 114.10 2g0k s GLN 94 Ca 0.33 0.42 0.07 0.00 -1.82 0.00 0.00 55.36 54.37 2g0k s GLN 94 Cb -0.08 0.47 -0.03 0.00 -1.09 0.00 0.00 33.01 32.28 2g0k s GLN 94 CO 0.26 -0.27 0.29 0.08 -1.32 0.00 0.00 175.29 174.33 2g0k s VAL 95 N -0.83 3.44 -0.16 3.63 1.01 -1.03 -1.37 120.40 125.10 2g0k s VAL 95 Ca -0.08 -1.38 -0.35 0.00 0.00 0.00 0.00 61.98 60.17 2g0k s VAL 95 Cb -0.01 -3.16 0.14 0.00 0.00 0.00 0.00 36.38 33.35 2g0k s VAL 95 CO 0.08 -0.16 1.31 -0.83 0.00 0.00 0.00 175.10 175.50 2g0k s GLY 96 N -4.00 -0.33 -0.05 4.51 0.00 -0.10 -3.22 107.32 104.13 2g0k s GLY 96 Ca 0.41 1.36 0.02 0.00 0.00 0.00 0.00 44.72 46.52 2g0k s GLY 96 CO 0.26 0.40 -0.08 0.48 0.00 0.00 0.00 173.10 174.16 2g0k s LEU 97 N -2.46 1.55 0.13 0.66 2.34 0.53 0.53 118.68 121.96 2g0k s LEU 97 Ca 0.12 -0.20 0.08 0.00 0.06 0.00 0.00 54.13 54.18 2g0k s LEU 97 Cb 0.02 -0.61 -0.04 0.00 -0.56 0.00 0.00 46.19 45.00 2g0k s LEU 97 CO -0.04 0.00 -0.11 -0.44 -1.06 0.00 0.00 176.35 174.70 2g0k s SER 98 N 0.66 4.28 0.00 1.48 0.01 8.12 -2.83 113.70 125.42 2g0k s SER 98 Ca -0.11 -0.47 0.00 0.00 1.31 0.00 0.00 55.95 56.68 2g0k s SER 98 Cb -0.14 -0.76 0.00 0.00 0.21 0.00 0.00 66.02 65.33 2g0k s SER 98 CO 0.02 0.15 0.00 -0.90 0.41 0.00 0.00 173.24 172.92 2g0k n ASP 99 N 0.51 0.70 -0.04 2.44 5.75 -1.05 1.20 116.55 126.06 2g0k n ASP 99 Ca -0.13 0.00 -0.13 0.00 -0.01 0.00 0.00 54.79 54.52 2g0k n ASP 99 Cb 0.53 0.00 -0.08 0.00 -1.03 0.00 0.00 41.12 40.55 2g0k n ASP 99 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2g0k h ALA 100 N -0.13 0.14 0.00 2.12 0.00 -1.92 -2.92 119.26 116.54 2g0k h ALA 100 Ca 0.00 -0.25 -0.05 0.00 0.00 0.00 0.00 54.91 54.61 2g0k h ALA 100 Cb 0.00 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2g0k h ALA 100 CO 0.00 -0.09 -0.23 0.00 0.00 0.00 0.00 179.25 178.93 2g0k h ALA 101 N 0.63 1.13 -0.68 0.00 0.00 -1.96 -3.47 119.26 114.90 2g0k h ALA 101 Ca 0.02 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.72 2g0k h ALA 101 Cb 0.51 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2g0k h ALA 101 CO 0.02 0.29 0.00 0.41 0.00 0.00 0.00 179.25 179.96 2g0k n GLY 102 N -0.15 0.65 3.34 0.00 0.00 -1.10 -5.13 105.19 102.80 2g0k n GLY 102 Ca -0.01 -0.35 -0.17 0.00 0.00 0.00 0.00 46.02 45.49 2g0k n GLY 102 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2g0k s ASN 103 N -1.85 1.77 0.14 1.61 6.03 -1.26 -4.81 114.94 116.55 2g0k s ASN 103 Ca 0.00 -1.27 -0.25 0.00 -1.03 0.00 0.00 52.86 50.32 2g0k s ASN 103 Cb 0.00 0.03 0.08 0.00 -3.03 0.00 0.00 41.25 38.33 2g0k s ASN 103 CO 0.00 -0.56 1.06 -0.83 -2.03 0.00 0.00 177.10 174.73 2g0k s GLY 104 N -3.33 -0.09 0.91 0.45 0.00 -1.25 -2.54 107.32 101.47 2g0k s GLY 104 Ca 0.31 -0.02 -0.12 0.00 0.00 0.00 0.00 44.72 44.88 2g0k s GLY 104 CO 0.10 1.45 1.11 2.56 0.00 0.00 0.00 173.10 178.32 2g0k s PRO 105 N -2.58 1.19 -0.24 2.90 0.04 -1.26 -4.24 135.00 130.81 2g0k s PRO 105 Ca 0.18 0.55 -0.40 0.00 0.04 0.00 0.00 61.00 61.37 2g0k s PRO 105 Cb -0.01 -1.82 -0.18 0.00 0.04 0.00 0.00 34.50 32.52 2g0k s PRO 105 CO 0.03 -2.22 1.23 -0.85 0.04 0.00 0.00 177.00 175.23 2g0k n GLU 106 N -3.83 0.00 -0.92 4.56 0.00 -0.21 -4.44 120.64 115.80 2g0k n GLU 106 Ca 0.06 0.00 -0.31 0.00 0.00 0.00 0.00 57.16 56.91 2g0k n GLU 106 Cb 0.57 -1.38 0.03 0.00 0.00 0.00 0.00 31.44 30.66 2g0k n GLU 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2g0k n GLY 107 N 2.56 -3.57 3.06 -1.84 0.00 -1.26 -4.85 105.19 99.30 2g0k n GLY 107 Ca 0.24 -0.51 -0.32 0.00 0.00 0.00 0.00 46.02 45.42 2g0k n GLY 107 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2g0k s VAL 108 N -1.70 2.49 0.09 1.61 1.01 -1.20 -5.06 120.40 117.64 2g0k s VAL 108 Ca 0.39 -2.04 -0.26 0.00 0.00 0.00 0.00 61.98 60.06 2g0k s VAL 108 Cb -0.24 -2.69 -0.06 0.00 0.00 0.00 0.00 36.38 33.39 2g0k s VAL 108 CO 0.66 -0.43 0.81 0.00 0.00 0.00 0.00 175.10 176.13 2g0k s ALA 109 N 1.02 3.36 0.23 5.51 0.00 -1.26 -2.47 121.76 128.16 2g0k s ALA 109 Ca 0.04 0.36 0.01 0.00 0.00 0.00 0.00 51.96 52.38 2g0k s ALA 109 Cb -0.20 -3.04 -0.00 0.00 0.00 0.00 0.00 23.12 19.87 2g0k s ALA 109 CO -0.06 0.11 0.27 0.44 0.00 0.00 0.00 175.76 176.52 2g0k n ILE 110 N 2.48 0.00 -3.92 0.00 -5.35 0.11 -4.93 119.36 107.75 2g0k n ILE 110 Ca -0.02 -1.39 0.03 0.00 -0.27 0.00 0.00 62.75 61.09 2g0k n ILE 110 Cb 0.50 0.78 0.01 0.00 -1.74 0.00 0.00 39.64 39.18 2g0k n ILE 110 CO 0.00 0.00 0.00 -0.44 -1.76 0.00 0.00 176.55 174.35 2g0k s SER 111 N -2.52 -0.00 -0.19 7.28 0.01 -1.19 -2.90 113.70 114.19 2g0k s SER 111 Ca 0.23 -0.18 -0.00 0.00 1.31 0.00 0.00 55.95 57.31 2g0k s SER 111 Cb 0.00 0.14 0.05 0.00 0.21 0.00 0.00 66.02 66.42 2g0k s SER 111 CO 0.16 -0.27 -0.06 -0.36 0.41 0.00 0.00 173.24 173.12 2g0k s PHE 112 N -2.08 1.95 0.00 2.43 0.40 -1.25 -2.29 117.98 117.14 2g0k s PHE 112 Ca 0.27 -1.31 0.00 0.00 -0.60 0.00 0.00 56.93 55.29 2g0k s PHE 112 Cb 0.01 -1.42 0.00 0.00 0.51 0.00 0.00 43.02 42.12 2g0k s PHE 112 CO -0.01 -0.67 0.00 0.27 0.70 0.00 0.00 175.22 175.50