#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x5x s SER 2 N 0.00 4.44 0.36 1.61 0.01 -1.26 -4.88 113.70 113.98 1x5x s SER 2 Ca 0.00 -0.70 0.00 0.00 1.31 0.00 0.00 55.95 56.56 1x5x s SER 2 Cb 0.00 -1.72 0.00 0.00 0.21 0.00 0.00 66.02 64.51 1x5x s SER 2 CO 0.00 -0.11 0.00 -1.54 0.41 0.00 0.00 173.24 172.00 1x5x n SER 3 N 4.74 -1.53 0.00 2.44 3.41 -1.26 -5.16 113.62 116.26 1x5x n SER 3 Ca -0.17 0.64 0.00 0.00 -0.26 0.00 0.00 58.87 59.09 1x5x n SER 3 Cb 0.48 1.59 0.00 0.00 -0.26 0.00 0.00 64.21 66.02 1x5x n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1x5x n GLY 4 N 0.55 -0.21 2.35 5.00 0.00 -1.26 -5.13 105.19 106.49 1x5x n GLY 4 Ca 0.00 0.57 -0.04 0.00 0.00 0.00 0.00 46.02 46.56 1x5x n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1x5x n SER 5 N 0.00 -1.75 -3.45 1.61 2.88 -1.26 -5.07 113.62 106.57 1x5x n SER 5 Ca 0.00 1.04 -0.02 0.00 -1.33 0.00 0.00 58.87 58.56 1x5x n SER 5 Cb 0.00 -4.27 -0.04 0.00 -0.75 0.00 0.00 64.21 59.15 1x5x n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1x5x s SER 6 N -0.64 -0.92 0.00 -3.46 0.15 -1.26 -4.99 113.70 102.57 1x5x s SER 6 Ca -0.18 1.09 0.00 0.00 0.70 0.00 0.00 55.95 57.56 1x5x s SER 6 Cb 0.01 1.97 0.00 0.00 -1.71 0.00 0.00 66.02 66.29 1x5x s SER 6 CO 0.61 -0.24 0.00 0.61 1.20 0.00 0.00 173.24 175.41 1x5x n GLY 7 N 5.42 0.95 3.78 9.45 0.00 -1.09 -5.03 105.19 118.67 1x5x n GLY 7 Ca -0.07 -0.94 -0.29 0.00 0.00 0.00 0.00 46.02 44.72 1x5x n GLY 7 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x5x s PRO 8 N 0.55 0.68 0.50 1.61 0.04 -1.26 -4.91 135.00 132.21 1x5x s PRO 8 Ca 0.00 0.12 -0.08 0.00 0.04 0.00 0.00 61.00 61.08 1x5x s PRO 8 Cb 0.00 -1.80 0.12 0.00 0.04 0.00 0.00 34.50 32.86 1x5x s PRO 8 CO 0.00 -2.47 0.51 0.43 0.04 0.00 0.00 177.00 175.51 1x5x n SER 9 N -3.92 -0.99 -4.66 6.66 7.64 -1.26 -4.71 113.62 112.37 1x5x n SER 9 Ca 0.09 -0.92 -0.43 0.00 1.01 0.00 0.00 58.87 58.62 1x5x n SER 9 Cb 0.59 -0.44 -0.02 0.00 -1.01 0.00 0.00 64.21 63.33 1x5x n SER 9 CO 0.00 0.00 0.00 -0.32 -3.01 0.00 0.00 175.04 171.71 1x5x s MET 10 N -4.14 4.26 0.79 1.43 1.75 -1.26 -4.80 119.30 117.34 1x5x s MET 10 Ca 0.31 1.47 -0.11 0.00 -1.25 0.00 0.00 55.69 56.11 1x5x s MET 10 Cb -0.02 -3.67 0.06 0.00 2.84 0.00 0.00 34.83 34.04 1x5x s MET 10 CO 0.23 -0.63 1.09 -1.25 -0.65 0.00 0.00 175.02 173.82 1x5x s PRO 11 N 3.20 2.15 0.17 4.11 0.04 -1.26 -4.11 135.00 139.30 1x5x s PRO 11 Ca 0.48 0.66 -0.30 0.00 0.04 0.00 0.00 61.00 61.88 1x5x s PRO 11 Cb -0.18 -1.92 -0.07 0.00 0.04 0.00 0.00 34.50 32.37 1x5x s PRO 11 CO 0.10 -1.58 0.99 0.00 0.04 0.00 0.00 177.00 176.56 1x5x s ALA 12 N -3.15 3.31 0.45 8.56 0.00 -1.26 -4.60 121.76 125.07 1x5x s ALA 12 Ca 0.61 0.66 -0.22 0.00 0.00 0.00 0.00 51.96 53.01 1x5x s ALA 12 Cb -0.14 -3.28 -0.12 0.00 0.00 0.00 0.00 23.12 19.58 1x5x s ALA 12 CO 0.54 -0.01 0.55 0.43 0.00 0.00 0.00 175.76 177.28 1x5x n SER 13 N 2.23 -0.86 -4.74 0.00 7.64 -1.26 -4.43 113.62 112.20 1x5x n SER 13 Ca 0.01 0.88 -0.41 0.00 1.01 0.00 0.00 58.87 60.36 1x5x n SER 13 Cb 0.48 -1.13 -0.04 0.00 -1.01 0.00 0.00 64.21 62.51 1x5x n SER 13 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1x5x s PRO 14 N -1.67 4.59 0.00 1.43 0.04 -1.26 -4.79 135.00 133.33 1x5x s PRO 14 Ca 0.64 1.75 0.00 0.00 0.04 0.00 0.00 61.00 63.43 1x5x s PRO 14 Cb -0.57 -3.26 0.00 0.00 0.04 0.00 0.00 34.50 30.71 1x5x s PRO 14 CO 0.58 0.07 0.00 1.33 0.04 0.00 0.00 177.00 179.02 1x5x n VAL 15 N 2.22 0.00 -3.49 -0.36 0.24 0.26 -4.79 118.33 112.41 1x5x n VAL 15 Ca 0.02 0.00 -0.29 0.00 -2.04 0.00 0.00 64.34 62.04 1x5x n VAL 15 Cb 0.46 -1.44 -0.12 0.00 -1.47 0.00 0.00 33.84 31.27 1x5x n VAL 15 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 1x5x s LEU 16 N 0.00 1.38 0.07 1.34 2.96 -1.26 -2.08 118.68 121.09 1x5x s LEU 16 Ca 0.00 -2.49 -0.33 0.00 -0.22 0.00 0.00 54.13 51.09 1x5x s LEU 16 Cb 0.00 -0.51 -0.16 0.00 0.50 0.00 0.00 46.19 46.01 1x5x s LEU 16 CO 0.00 -0.27 1.50 0.71 -1.32 0.00 0.00 176.35 176.98 1x5x h THR 17 N 4.94 0.00 -3.53 3.68 1.35 -1.20 -3.43 112.91 114.73 1x5x h THR 17 Ca 0.10 0.00 -0.45 0.00 -0.55 0.00 0.00 66.41 65.51 1x5x h THR 17 Cb 0.94 0.00 -0.33 0.00 -1.73 0.00 0.00 68.15 67.04 1x5x h THR 17 CO 0.33 0.00 -0.79 -0.75 -0.25 0.00 0.00 175.52 174.05 1x5x s LYS 18 N -5.59 1.19 -0.24 4.72 2.20 -1.16 -5.04 119.74 115.82 1x5x s LYS 18 Ca -0.17 -0.27 -0.05 0.00 -0.36 0.00 0.00 55.97 55.13 1x5x s LYS 18 Cb 0.03 -1.07 -0.01 0.00 -1.51 0.00 0.00 37.83 35.28 1x5x s LYS 18 CO 0.54 0.01 0.00 0.00 -0.36 0.00 0.00 175.35 175.54 1x5x s ALA 19 N 0.64 2.93 0.09 3.13 0.00 -1.26 -0.65 121.76 126.64 1x5x s ALA 19 Ca -0.11 -1.24 0.00 0.00 0.00 0.00 0.00 51.96 50.61 1x5x s ALA 19 Cb -0.14 -1.87 0.00 0.00 0.00 0.00 0.00 23.12 21.12 1x5x s ALA 19 CO 0.02 -0.57 0.00 0.41 0.00 0.00 0.00 175.76 175.62 1x5x n GLY 20 N 4.83 1.65 0.11 0.00 0.00 -0.29 -4.58 105.19 106.91 1x5x n GLY 20 Ca -0.17 -2.05 -0.22 0.00 0.00 0.00 0.00 46.02 43.58 1x5x n GLY 20 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1x5x n ILE 21 N -0.58 1.59 -1.66 -0.61 5.41 -1.26 -0.94 119.36 121.31 1x5x n ILE 21 Ca 0.00 -0.18 0.02 0.00 1.00 0.00 0.00 62.75 63.59 1x5x n ILE 21 Cb 0.00 -1.97 0.18 0.00 -0.71 0.00 0.00 39.64 37.15 1x5x n ILE 21 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 1x5x n THR 22 N -4.22 2.26 -3.47 1.39 -2.24 -1.26 -3.62 114.28 103.12 1x5x n THR 22 Ca -0.33 -3.39 -0.11 0.00 -2.27 0.00 0.00 64.05 57.95 1x5x n THR 22 Cb 0.77 -0.37 -0.02 0.00 -2.10 0.00 0.00 70.33 68.60 1x5x n THR 22 CO 0.00 0.00 0.00 -1.66 -0.57 0.00 0.00 175.07 172.84 1x5x s TRP 23 N -3.29 -0.46 -0.13 4.78 1.48 -1.26 -2.49 118.94 117.57 1x5x s TRP 23 Ca 0.40 0.36 -0.05 0.00 -1.06 0.00 0.00 56.10 55.75 1x5x s TRP 23 Cb 0.38 0.53 0.06 0.00 -1.16 0.00 0.00 33.47 33.28 1x5x s TRP 23 CO -0.05 -0.68 0.28 -0.51 -4.06 0.00 0.00 176.95 171.93 1x5x s LEU 24 N -2.44 -0.12 -0.52 -4.66 1.43 -0.94 -1.14 118.68 110.29 1x5x s LEU 24 Ca 0.02 0.63 -0.16 0.00 -1.03 0.00 0.00 54.13 53.59 1x5x s LEU 24 Cb -0.01 0.81 0.12 0.00 0.03 0.00 0.00 46.19 47.13 1x5x s LEU 24 CO -0.09 -0.22 0.47 -0.44 0.23 0.00 0.00 176.35 176.31 1x5x s SER 25 N 2.05 6.18 0.44 2.29 0.01 0.18 -0.92 113.70 123.94 1x5x s SER 25 Ca -0.03 -1.68 0.02 0.00 1.31 0.00 0.00 55.95 55.58 1x5x s SER 25 Cb -0.11 -2.20 0.00 0.00 0.21 0.00 0.00 66.02 63.92 1x5x s SER 25 CO -0.09 -0.81 0.65 -0.76 0.41 0.00 0.00 173.24 172.64 1x5x s LEU 26 N 1.61 3.64 -0.11 2.44 1.43 -1.11 -0.68 118.68 125.90 1x5x s LEU 26 Ca 0.03 0.10 -0.05 0.00 -1.03 0.00 0.00 54.13 53.18 1x5x s LEU 26 Cb -0.29 -3.00 0.05 0.00 0.03 0.00 0.00 46.19 42.99 1x5x s LEU 26 CO 0.04 -0.74 0.24 -1.10 0.23 0.00 0.00 176.35 175.03 1x5x s GLN 27 N -4.51 0.17 0.21 1.70 -1.52 -0.88 -3.64 119.66 111.20 1x5x s GLN 27 Ca 0.50 0.60 0.03 0.00 -1.95 0.00 0.00 55.36 54.54 1x5x s GLN 27 Cb -0.10 -0.10 -0.05 0.00 -0.22 0.00 0.00 33.01 32.54 1x5x s GLN 27 CO 0.36 -0.22 0.00 1.67 -0.25 0.00 0.00 175.29 176.86 1x5x s TRP 28 N 1.73 1.44 0.15 0.91 -2.14 -0.84 0.91 118.94 121.10 1x5x s TRP 28 Ca -0.05 -0.97 0.03 0.00 2.66 0.00 0.00 56.10 57.77 1x5x s TRP 28 Cb -0.11 -0.83 -0.05 0.00 -3.10 0.00 0.00 33.47 29.38 1x5x s TRP 28 CO -0.08 -0.11 -0.06 -1.54 -2.66 0.00 0.00 176.95 172.49 1x5x s SER 29 N -3.26 1.53 1.02 -2.66 1.04 -1.26 -4.69 113.70 105.42 1x5x s SER 29 Ca 0.27 -1.07 -0.16 0.00 0.48 0.00 0.00 55.95 55.48 1x5x s SER 29 Cb 0.06 0.04 0.04 0.00 0.10 0.00 0.00 66.02 66.26 1x5x s SER 29 CO 0.07 -0.43 0.10 2.29 0.98 0.00 0.00 173.24 176.25 1x5x n LYS 30 N -0.20 -0.72 -0.18 4.02 2.85 -1.26 -4.00 118.16 118.68 1x5x n LYS 30 Ca -0.09 -0.18 -0.04 0.00 -1.05 0.00 0.00 58.31 56.95 1x5x n LYS 30 Cb 0.62 -1.70 0.03 0.00 -0.65 0.00 0.00 35.03 33.32 1x5x n LYS 30 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 177.40 177.00 1x5x n PRO 31 N -1.36 -0.70 -3.39 -1.58 -0.04 -1.26 -4.40 135.00 122.26 1x5x n PRO 31 Ca 0.04 -0.23 -0.43 0.00 -0.04 0.00 0.00 63.50 62.84 1x5x n PRO 31 Cb 0.58 -0.18 -0.09 0.00 -0.04 0.00 0.00 33.50 33.76 1x5x n PRO 31 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1x5x s SER 32 N -1.72 6.15 -0.03 3.54 0.01 -1.26 -4.64 113.70 115.75 1x5x s SER 32 Ca 0.09 -0.79 -0.00 0.00 1.31 0.00 0.00 55.95 56.55 1x5x s SER 32 Cb -0.01 -2.19 0.00 0.00 0.21 0.00 0.00 66.02 64.03 1x5x s SER 32 CO 0.06 -0.51 0.02 0.61 0.41 0.00 0.00 173.24 173.83 1x5x n GLY 33 N 5.14 -2.30 3.75 3.44 0.00 -1.26 -4.66 105.19 109.29 1x5x n GLY 33 Ca -0.09 -0.12 -0.32 0.00 0.00 0.00 0.00 46.02 45.49 1x5x n GLY 33 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1x5x s THR 34 N -0.46 2.95 0.09 2.61 -4.23 -1.26 -4.48 115.64 110.85 1x5x s THR 34 Ca 0.01 0.38 -0.13 0.00 -1.18 0.00 0.00 61.69 60.77 1x5x s THR 34 Cb -0.00 -2.82 -0.20 0.00 1.34 0.00 0.00 72.50 70.82 1x5x s THR 34 CO 0.08 -0.34 1.24 1.55 -0.54 0.00 0.00 174.62 176.61 1x5x h PRO 35 N -0.72 0.72 0.00 3.99 0.13 -1.95 -3.43 132.00 130.73 1x5x h PRO 35 Ca -0.45 -0.70 0.00 0.00 -0.87 0.00 0.00 66.00 63.98 1x5x h PRO 35 Cb 1.25 0.18 0.00 0.00 0.13 0.00 0.00 31.00 32.57 1x5x h PRO 35 CO 0.50 1.29 0.00 0.45 -0.23 0.00 0.00 178.00 180.02 1x5x n SER 36 N -3.87 0.00 0.03 1.44 2.88 -1.26 -5.10 113.62 107.74 1x5x n SER 36 Ca -0.10 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.44 1x5x n SER 36 Cb 0.84 -0.14 0.00 0.00 -0.75 0.00 0.00 64.21 64.16 1x5x n SER 36 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1x5x n ASP 37 N -2.19 -0.60 -3.92 -3.46 2.03 -1.26 -5.16 116.55 101.99 1x5x n ASP 37 Ca 0.00 0.51 -0.10 0.00 0.52 0.00 0.00 54.79 55.72 1x5x n ASP 37 Cb 0.00 0.94 -0.05 0.00 -0.72 0.00 0.00 41.12 41.29 1x5x n ASP 37 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 1x5x s GLU 38 N -2.00 1.58 0.00 -0.67 0.41 -1.26 -4.90 118.70 111.87 1x5x s GLU 38 Ca 0.00 -1.31 0.00 0.00 -0.41 0.00 0.00 54.97 53.25 1x5x s GLU 38 Cb 0.00 0.47 0.00 0.00 -1.78 0.00 0.00 34.13 32.82 1x5x s GLU 38 CO 0.00 -0.66 0.00 0.41 -0.49 0.00 0.00 175.26 174.52 1x5x n GLY 39 N -0.40 1.12 3.85 -1.39 0.00 -1.26 -5.09 105.19 102.02 1x5x n GLY 39 Ca -0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.66 1x5x n GLY 39 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1x5x s ILE 40 N -2.00 4.89 0.25 -0.61 1.01 -1.26 -4.96 121.20 118.52 1x5x s ILE 40 Ca 0.00 0.76 0.11 0.00 0.00 0.00 0.00 60.65 61.52 1x5x s ILE 40 Cb 0.00 -3.72 -0.05 0.00 0.01 0.00 0.00 42.46 38.71 1x5x s ILE 40 CO 0.00 0.24 -0.15 -0.44 0.00 0.00 0.00 174.94 174.58 1x5x s SER 41 N -1.75 3.84 0.01 3.58 0.01 -1.22 -4.71 113.70 113.45 1x5x s SER 41 Ca 0.37 -0.86 0.02 0.00 1.31 0.00 0.00 55.95 56.79 1x5x s SER 41 Cb -0.15 -0.46 -0.01 0.00 0.21 0.00 0.00 66.02 65.62 1x5x s SER 41 CO 0.19 0.06 -0.07 -0.31 0.41 0.00 0.00 173.24 173.52 1x5x s TYR 42 N -2.21 0.58 -0.18 2.43 1.51 -1.08 -1.95 117.35 116.45 1x5x s TYR 42 Ca 0.28 -0.20 -0.05 0.00 -1.01 0.00 0.00 57.07 56.09 1x5x s TYR 42 Cb -0.06 -0.36 -0.03 0.00 -0.11 0.00 0.00 41.96 41.40 1x5x s TYR 42 CO 0.15 -0.03 -0.01 0.42 -1.11 0.00 0.00 175.55 174.97 1x5x s ILE 43 N -0.46 3.98 -0.48 2.71 1.01 0.56 -3.77 121.20 124.75 1x5x s ILE 43 Ca -0.01 -0.32 -0.24 0.00 0.00 0.00 0.00 60.65 60.09 1x5x s ILE 43 Cb -0.04 -2.77 0.03 0.00 0.01 0.00 0.00 42.46 39.69 1x5x s ILE 43 CO -0.00 0.46 0.84 -0.22 0.00 0.00 0.00 174.94 176.02 1x5x s LEU 44 N 0.66 4.20 0.05 2.97 2.96 -1.05 -2.16 118.68 126.32 1x5x s LEU 44 Ca -0.01 -0.15 -0.00 0.00 -0.22 0.00 0.00 54.13 53.75 1x5x s LEU 44 Cb -0.14 -2.96 -0.04 0.00 0.50 0.00 0.00 46.19 43.55 1x5x s LEU 44 CO 0.02 -1.01 0.20 -1.61 -1.32 0.00 0.00 176.35 172.63 1x5x s GLU 45 N 3.50 3.40 -0.22 1.98 2.02 -1.08 -0.72 118.70 127.59 1x5x s GLU 45 Ca 0.31 -0.44 -0.20 0.00 0.02 0.00 0.00 54.97 54.66 1x5x s GLU 45 Cb -0.12 -3.03 0.06 0.00 0.10 0.00 0.00 34.13 31.14 1x5x s GLU 45 CO 0.22 0.61 0.58 1.41 0.02 0.00 0.00 175.26 178.11 1x5x s MET 46 N -2.44 0.67 0.09 1.61 -2.45 -1.09 -2.25 119.30 113.44 1x5x s MET 46 Ca 0.34 0.82 0.07 0.00 -1.25 0.00 0.00 55.69 55.67 1x5x s MET 46 Cb -0.13 0.31 -0.03 0.00 1.25 0.00 0.00 34.83 36.23 1x5x s MET 46 CO 0.27 -0.09 -0.18 -2.00 1.05 0.00 0.00 175.02 174.07 1x5x s GLU 47 N 0.40 1.00 0.16 4.11 -6.30 -1.11 -2.28 118.70 114.68 1x5x s GLU 47 Ca -0.01 -1.08 -0.25 0.00 -2.50 0.00 0.00 54.97 51.13 1x5x s GLU 47 Cb -0.04 -1.17 0.02 0.00 0.00 0.00 0.00 34.13 32.94 1x5x s GLU 47 CO -0.01 0.27 1.59 0.93 0.02 0.00 0.00 175.26 178.06 1x5x h GLU 48 N 4.16 -0.30 -4.10 4.30 3.07 -1.91 -3.21 114.58 116.60 1x5x h GLU 48 Ca -0.44 0.02 -0.27 0.00 -0.50 0.00 0.00 59.36 58.17 1x5x h GLU 48 Cb 1.18 0.07 -0.08 0.00 -0.84 0.00 0.00 28.75 29.09 1x5x h GLU 48 CO 0.40 -0.20 -0.17 -2.00 -1.40 0.00 0.00 179.01 175.63 1x5x s GLU 49 N -5.94 1.94 0.07 2.33 2.12 -1.26 -4.59 118.70 113.37 1x5x s GLU 49 Ca -0.15 -1.76 -0.36 0.00 0.36 0.00 0.00 54.97 53.06 1x5x s GLU 49 Cb 0.12 0.45 -0.19 0.00 0.26 0.00 0.00 34.13 34.78 1x5x s GLU 49 CO 0.66 -0.81 0.96 -2.37 -0.54 0.00 0.00 175.26 173.17 1x5x n THR 50 N -0.57 0.57 0.00 -1.70 5.66 -1.26 -4.59 114.28 112.39 1x5x n THR 50 Ca 0.01 -0.14 0.00 0.00 -3.05 0.00 0.00 64.05 60.86 1x5x n THR 50 Cb 0.61 -0.12 0.00 0.00 -1.55 0.00 0.00 70.33 69.27 1x5x n THR 50 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 1x5x n SER 51 N 1.72 0.00 -0.50 1.09 7.64 -1.26 -5.04 113.62 117.27 1x5x n SER 51 Ca 0.19 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.07 1x5x n SER 51 Cb 0.14 0.03 0.00 0.00 -1.01 0.00 0.00 64.21 63.37 1x5x n SER 51 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1x5x n GLY 52 N -1.27 0.79 1.08 0.23 0.00 -1.26 -4.93 105.19 99.83 1x5x n GLY 52 Ca 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.57 1x5x n GLY 52 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1x5x n TYR 53 N -1.46 -1.23 1.57 1.61 4.01 -1.26 -4.88 117.16 115.52 1x5x n TYR 53 Ca 0.00 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.86 1x5x n TYR 53 Cb 0.37 0.27 0.72 0.00 -0.31 0.00 0.00 39.34 40.39 1x5x n TYR 53 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1x5x n GLY 54 N -1.22 -0.79 3.68 2.72 0.00 -1.26 -4.84 105.19 103.48 1x5x n GLY 54 Ca 0.00 -0.15 -0.50 0.00 0.00 0.00 0.00 46.02 45.37 1x5x n GLY 54 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1x5x n PHE 55 N -0.98 2.20 -4.24 1.61 3.72 -1.26 -4.83 117.46 113.68 1x5x n PHE 55 Ca 0.18 0.20 -0.31 0.00 -0.05 0.00 0.00 57.45 57.47 1x5x n PHE 55 Cb 0.08 -2.58 -0.09 0.00 -0.94 0.00 0.00 39.48 35.96 1x5x n PHE 55 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1x5x s LYS 56 N 3.03 2.53 0.11 -1.08 -0.14 -0.97 -4.85 119.74 118.37 1x5x s LYS 56 Ca 0.90 -0.80 -0.30 0.00 -1.36 0.00 0.00 55.97 54.41 1x5x s LYS 56 Cb -0.78 -2.52 -0.06 0.00 -1.68 0.00 0.00 37.83 32.79 1x5x s LYS 56 CO 0.51 0.56 1.15 -1.25 -0.76 0.00 0.00 175.35 175.56 1x5x s PRO 57 N -1.97 4.51 -0.11 -1.68 0.04 -1.26 -2.66 135.00 131.87 1x5x s PRO 57 Ca 0.22 1.73 -0.08 0.00 0.04 0.00 0.00 61.00 62.91 1x5x s PRO 57 Cb -0.11 -3.32 -0.05 0.00 0.04 0.00 0.00 34.50 31.05 1x5x s PRO 57 CO 0.14 -0.10 -0.19 1.63 0.04 0.00 0.00 177.00 178.51 1x5x n LYS 58 N 3.22 0.30 -4.23 4.56 5.02 0.10 -5.02 118.16 122.12 1x5x n LYS 58 Ca 0.06 0.13 -0.27 0.00 -2.02 0.00 0.00 58.31 56.21 1x5x n LYS 58 Cb 0.46 -1.02 -0.08 0.00 -0.02 0.00 0.00 35.03 34.37 1x5x n LYS 58 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 1x5x s TYR 59 N -2.36 2.79 -0.50 2.13 5.04 -1.22 -4.96 117.35 118.26 1x5x s TYR 59 Ca -0.19 -0.16 0.07 0.00 -2.44 0.00 0.00 57.07 54.36 1x5x s TYR 59 Cb 0.06 -1.36 0.19 0.00 0.35 0.00 0.00 41.96 41.19 1x5x s TYR 59 CO 0.25 0.51 0.70 0.34 -1.34 0.00 0.00 175.55 176.01 1x5x s ASP 60 N -2.84 -1.36 0.05 4.32 -1.08 -1.26 -2.53 116.67 111.97 1x5x s ASP 60 Ca 0.26 -1.63 -0.00 0.00 -0.52 0.00 0.00 52.55 50.66 1x5x s ASP 60 Cb -0.09 1.84 0.00 0.00 -1.46 0.00 0.00 42.92 43.20 1x5x s ASP 60 CO 0.17 -0.07 0.07 0.61 0.52 0.00 0.00 175.17 176.47 1x5x n GLY 61 N 3.17 3.00 0.03 2.66 0.00 -1.25 -5.04 105.19 107.77 1x5x n GLY 61 Ca 0.17 -1.42 0.11 0.00 0.00 0.00 0.00 46.02 44.89 1x5x n GLY 61 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1x5x n GLU 62 N -0.09 0.09 -1.51 1.61 1.02 -1.26 -2.63 120.64 117.87 1x5x n GLU 62 Ca 0.00 -0.07 -0.32 0.00 -0.02 0.00 0.00 57.16 56.76 1x5x n GLU 62 Cb 0.09 -1.50 0.06 0.00 -0.02 0.00 0.00 31.44 30.07 1x5x n GLU 62 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1x5x s ASP 63 N -2.95 4.97 -0.21 1.62 1.01 -1.26 -4.84 116.67 115.00 1x5x s ASP 63 Ca 0.11 1.80 0.14 0.00 0.71 0.00 0.00 52.55 55.31 1x5x s ASP 63 Cb 0.17 -2.52 0.50 0.00 1.01 0.00 0.00 42.92 42.08 1x5x s ASP 63 CO 0.76 -1.72 1.41 0.18 0.21 0.00 0.00 175.17 176.00 1x5x n LEU 64 N -3.07 3.80 -3.70 1.23 4.77 -1.26 -4.69 117.00 114.08 1x5x n LEU 64 Ca 0.09 -3.28 -0.12 0.00 -0.03 0.00 0.00 56.01 52.67 1x5x n LEU 64 Cb 0.53 -0.56 -0.10 0.00 -2.33 0.00 0.00 43.42 40.96 1x5x n LEU 64 CO 0.52 0.87 0.12 0.00 -1.33 0.00 0.00 177.39 177.58 1x5x s ALA 65 N -2.98 -1.15 0.08 -1.18 0.00 -1.26 -1.98 121.76 113.29 1x5x s ALA 65 Ca 0.42 1.46 -0.12 0.00 0.00 0.00 0.00 51.96 53.72 1x5x s ALA 65 Cb 0.36 -0.87 0.01 0.00 0.00 0.00 0.00 23.12 22.62 1x5x s ALA 65 CO 0.05 -0.25 0.27 -0.47 0.00 0.00 0.00 175.76 175.37 1x5x s TYR 66 N 0.77 -0.01 -0.34 0.00 5.04 -1.24 -5.07 117.35 116.51 1x5x s TYR 66 Ca -0.04 -0.31 0.04 0.00 -2.44 0.00 0.00 57.07 54.32 1x5x s TYR 66 Cb -0.05 0.06 0.10 0.00 0.35 0.00 0.00 41.96 42.42 1x5x s TYR 66 CO -0.06 -0.57 0.04 0.99 -1.34 0.00 0.00 175.55 174.62 1x5x s THR 67 N -3.44 2.30 0.58 4.34 2.01 -1.26 -2.75 115.64 117.43 1x5x s THR 67 Ca 0.01 -2.30 -0.20 0.00 0.31 0.00 0.00 61.69 59.52 1x5x s THR 67 Cb 0.02 -2.68 -0.04 0.00 0.01 0.00 0.00 72.50 69.81 1x5x s THR 67 CO -0.09 -0.57 1.26 -0.69 -0.69 0.00 0.00 174.62 173.85 1x5x s VAL 68 N 0.92 2.39 0.22 3.82 1.01 -0.09 -4.82 120.40 123.86 1x5x s VAL 68 Ca 0.10 0.26 0.01 0.00 0.00 0.00 0.00 61.98 62.34 1x5x s VAL 68 Cb -0.19 -3.11 -0.05 0.00 0.00 0.00 0.00 36.38 33.03 1x5x s VAL 68 CO -0.08 -0.04 0.09 -0.54 0.00 0.00 0.00 175.10 174.53 1x5x s LYS 69 N -3.18 1.29 -0.60 2.72 1.02 -1.26 -2.20 119.74 117.53 1x5x s LYS 69 Ca 0.76 -1.68 -0.04 0.00 0.02 0.00 0.00 55.97 55.04 1x5x s LYS 69 Cb -0.34 -0.12 0.00 0.00 -0.52 0.00 0.00 37.83 36.85 1x5x s LYS 69 CO 0.38 -0.29 0.61 0.09 -0.92 0.00 0.00 175.35 175.22 1x5x n ASN 70 N -0.37 -7.28 -1.01 2.83 3.02 -1.04 -4.92 115.26 106.49 1x5x n ASN 70 Ca -0.01 0.08 0.00 0.00 -0.03 0.00 0.00 54.58 54.62 1x5x n ASN 70 Cb 0.66 -4.92 0.00 0.00 -0.61 0.00 0.00 39.78 34.90 1x5x n ASN 70 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1x5x n LEU 71 N -1.34 0.00 -4.33 3.41 4.77 -1.23 -5.01 117.00 113.27 1x5x n LEU 71 Ca 0.03 0.00 -0.27 0.00 -0.03 0.00 0.00 56.01 55.74 1x5x n LEU 71 Cb 0.48 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.44 1x5x n LEU 71 CO 0.47 0.00 -0.54 -0.13 -1.33 0.00 0.00 177.39 175.85 1x5x s ARG 72 N -0.93 1.30 0.52 3.23 0.52 -1.26 -4.78 118.95 117.55 1x5x s ARG 72 Ca 0.00 -1.23 -0.17 0.00 -0.52 0.00 0.00 55.73 53.81 1x5x s ARG 72 Cb 0.00 -1.65 -0.07 0.00 0.52 0.00 0.00 34.95 33.74 1x5x s ARG 72 CO 0.00 0.39 1.00 -0.98 0.02 0.00 0.00 175.30 175.73 1x5x s ARG 73 N -1.89 3.84 -1.15 3.54 1.70 -1.24 -4.04 118.95 119.71 1x5x s ARG 73 Ca 0.10 1.07 -0.29 0.00 -0.47 0.00 0.00 55.73 56.14 1x5x s ARG 73 Cb -0.10 -2.12 0.04 0.00 -0.57 0.00 0.00 34.95 32.20 1x5x s ARG 73 CO 0.05 -0.37 0.68 0.43 -1.08 0.00 0.00 175.30 175.01 1x5x n SER 74 N -1.49 -4.35 -4.15 -2.89 7.64 -0.95 -4.95 113.62 102.48 1x5x n SER 74 Ca 0.07 -1.23 -0.11 0.00 1.01 0.00 0.00 58.87 58.61 1x5x n SER 74 Cb 0.54 -1.78 -0.09 0.00 -1.01 0.00 0.00 64.21 61.87 1x5x n SER 74 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1x5x s THR 75 N -3.43 0.01 0.12 0.44 2.01 -1.26 -4.95 115.64 108.58 1x5x s THR 75 Ca 0.41 -1.87 0.08 0.00 0.31 0.00 0.00 61.69 60.63 1x5x s THR 75 Cb -0.22 -2.39 -0.04 0.00 0.01 0.00 0.00 72.50 69.85 1x5x s THR 75 CO 0.95 -0.04 -0.20 -1.59 -0.69 0.00 0.00 174.62 173.05 1x5x s LYS 76 N -4.12 1.18 -0.14 4.92 0.00 -1.26 -0.69 119.74 119.64 1x5x s LYS 76 Ca 0.34 -1.25 -0.18 0.00 0.00 0.00 0.00 55.97 54.88 1x5x s LYS 76 Cb 0.06 -1.40 0.05 0.00 0.00 0.00 0.00 37.83 36.54 1x5x s LYS 76 CO 0.10 0.31 0.48 0.71 0.00 0.00 0.00 175.35 176.96 1x5x s TYR 77 N -1.43 -0.50 0.13 1.78 2.02 -0.53 -4.86 117.35 113.96 1x5x s TYR 77 Ca 0.10 1.13 -0.06 0.00 -0.37 0.00 0.00 57.07 57.86 1x5x s TYR 77 Cb -0.09 0.20 -0.06 0.00 -0.40 0.00 0.00 41.96 41.61 1x5x s TYR 77 CO 0.05 -0.32 0.39 0.15 -1.57 0.00 0.00 175.55 174.25 1x5x s LYS 78 N -0.16 3.66 -0.01 -0.62 1.02 -1.21 -2.05 119.74 120.36 1x5x s LYS 78 Ca -0.03 -0.00 -0.03 0.00 0.02 0.00 0.00 55.97 55.92 1x5x s LYS 78 Cb -0.03 -2.87 -0.00 0.00 -0.52 0.00 0.00 37.83 34.40 1x5x s LYS 78 CO 0.02 0.48 0.07 -0.06 -0.92 0.00 0.00 175.35 174.94 1x5x s PHE 79 N -1.60 0.03 -0.08 3.18 0.40 -0.15 -2.77 117.98 116.99 1x5x s PHE 79 Ca 0.39 -0.06 -0.03 0.00 -0.60 0.00 0.00 56.93 56.63 1x5x s PHE 79 Cb -0.12 -0.04 0.04 0.00 0.51 0.00 0.00 43.02 43.40 1x5x s PHE 79 CO 0.22 -0.14 0.16 -1.59 0.70 0.00 0.00 175.22 174.57 1x5x s LYS 80 N -0.69 0.07 -0.11 0.44 -2.85 -0.95 -0.34 119.74 115.31 1x5x s LYS 80 Ca -0.08 0.47 -0.26 0.00 -1.00 0.00 0.00 55.97 55.10 1x5x s LYS 80 Cb -0.05 -0.21 -0.02 0.00 -2.06 0.00 0.00 37.83 35.49 1x5x s LYS 80 CO 0.00 -0.23 0.83 0.54 0.10 0.00 0.00 175.35 176.59 1x5x s VAL 81 N 1.67 4.92 -0.21 1.79 0.11 -1.26 -2.63 120.40 124.79 1x5x s VAL 81 Ca -0.04 1.68 0.00 0.00 -2.93 0.00 0.00 61.98 60.69 1x5x s VAL 81 Cb -0.12 -4.15 0.02 0.00 -1.53 0.00 0.00 36.38 30.60 1x5x s VAL 81 CO -0.06 0.11 -0.14 -0.63 -3.33 0.00 0.00 175.10 171.05 1x5x s ILE 82 N 1.57 2.39 -0.29 7.04 1.01 -0.92 -2.30 121.20 129.71 1x5x s ILE 82 Ca 0.41 -0.98 -0.15 0.00 0.00 0.00 0.00 60.65 59.93 1x5x s ILE 82 Cb -0.18 -2.11 -0.03 0.00 0.01 0.00 0.00 42.46 40.16 1x5x s ILE 82 CO 0.17 0.39 0.38 0.00 0.00 0.00 0.00 174.94 175.88 1x5x s ALA 83 N 1.30 3.55 0.23 9.38 0.00 -1.26 -0.32 121.76 134.63 1x5x s ALA 83 Ca 0.03 -0.89 0.07 0.00 0.00 0.00 0.00 51.96 51.16 1x5x s ALA 83 Cb -0.15 -2.75 -0.05 0.00 0.00 0.00 0.00 23.12 20.18 1x5x s ALA 83 CO -0.09 -0.76 -0.09 1.52 0.00 0.00 0.00 175.76 176.34 1x5x s TYR 84 N 2.08 1.74 0.13 0.00 -0.85 -0.82 -3.44 117.35 116.20 1x5x s TYR 84 Ca 0.15 -0.68 0.09 0.00 -0.52 0.00 0.00 57.07 56.11 1x5x s TYR 84 Cb -0.16 -0.91 -0.04 0.00 0.38 0.00 0.00 41.96 41.23 1x5x s TYR 84 CO 0.10 0.26 -0.22 1.21 -1.52 0.00 0.00 175.55 175.39 1x5x s ASN 85 N -3.35 2.81 0.63 -0.18 3.84 0.52 -3.43 114.94 115.78 1x5x s ASN 85 Ca 0.25 -0.75 0.24 0.00 0.21 0.00 0.00 52.86 52.81 1x5x s ASN 85 Cb 0.02 -0.17 1.21 0.00 -0.55 0.00 0.00 41.25 41.76 1x5x s ASN 85 CO 0.08 0.07 1.67 0.28 -2.79 0.00 0.00 177.10 176.41 1x5x h SER 86 N 3.77 0.00 0.06 -4.21 0.02 -1.99 0.46 113.55 111.66 1x5x h SER 86 Ca -0.46 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 60.40 1x5x h SER 86 Cb 1.19 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.74 1x5x h SER 86 CO 0.43 0.00 -0.36 -0.33 -1.14 0.00 0.00 176.83 175.43 1x5x h GLU 87 N 0.00 0.15 0.00 3.45 5.08 -2.02 -3.49 114.58 117.74 1x5x h GLU 87 Ca 0.16 -0.23 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1x5x h GLU 87 Cb 1.43 0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.76 1x5x h GLU 87 CO -0.00 1.08 0.00 0.41 -1.00 0.00 0.00 179.01 179.50 1x5x n GLY 88 N 1.54 2.14 0.03 -3.84 0.00 0.16 -5.08 105.19 100.14 1x5x n GLY 88 Ca -0.11 -0.85 -0.00 0.00 0.00 0.00 0.00 46.02 45.06 1x5x n GLY 88 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1x5x n LYS 89 N 0.00 1.79 -1.24 1.61 4.76 -1.26 0.20 118.16 124.01 1x5x n LYS 89 Ca 0.00 -0.03 0.00 0.00 -2.87 0.00 0.00 58.31 55.41 1x5x n LYS 89 Cb 0.00 0.01 0.00 0.00 -1.84 0.00 0.00 35.03 33.20 1x5x n LYS 89 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 1x5x n SER 90 N -1.41 0.00 -4.80 4.39 7.64 -1.22 -2.69 113.62 115.53 1x5x n SER 90 Ca -0.00 -0.77 -0.36 0.00 1.01 0.00 0.00 58.87 58.75 1x5x n SER 90 Cb 0.01 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.14 1x5x n SER 90 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1x5x s ASN 91 N -0.45 7.13 0.78 6.43 0.01 -1.26 -4.90 114.94 122.68 1x5x s ASN 91 Ca 0.00 1.64 -0.11 0.00 -0.71 0.00 0.00 52.86 53.68 1x5x s ASN 91 Cb 0.00 -2.51 0.06 0.00 0.41 0.00 0.00 41.25 39.21 1x5x s ASN 91 CO 0.00 -0.11 1.09 -2.16 -1.51 0.00 0.00 177.10 174.41 1x5x s PRO 92 N -2.35 2.24 0.39 -0.60 0.04 -1.26 -4.59 135.00 128.87 1x5x s PRO 92 Ca 0.51 0.69 0.03 0.00 0.04 0.00 0.00 61.00 62.27 1x5x s PRO 92 Cb -0.15 -1.93 -0.01 0.00 0.04 0.00 0.00 34.50 32.44 1x5x s PRO 92 CO 0.20 -1.52 0.57 0.45 0.04 0.00 0.00 177.00 176.74 1x5x s SER 93 N -3.89 5.96 -0.09 6.66 0.15 -0.97 -4.89 113.70 116.64 1x5x s SER 93 Ca 0.60 0.13 -0.39 0.00 0.70 0.00 0.00 55.95 57.00 1x5x s SER 93 Cb -0.14 -1.51 -0.17 0.00 -1.71 0.00 0.00 66.02 62.49 1x5x s SER 93 CO 0.54 -0.52 1.50 -0.62 1.20 0.00 0.00 173.24 175.34 1x5x n GLU 94 N -1.86 1.05 -2.16 5.44 1.02 -1.26 -4.59 120.64 118.29 1x5x n GLU 94 Ca -0.01 0.38 -0.42 0.00 -0.02 0.00 0.00 57.16 57.09 1x5x n GLU 94 Cb 0.58 -2.03 -0.03 0.00 -0.02 0.00 0.00 31.44 29.94 1x5x n GLU 94 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1x5x s VAL 95 N 1.79 3.58 0.31 2.62 1.01 -1.26 -4.61 120.40 123.84 1x5x s VAL 95 Ca 0.91 0.96 0.07 0.00 0.00 0.00 0.00 61.98 63.92 1x5x s VAL 95 Cb -1.04 -3.62 -0.02 0.00 0.00 0.00 0.00 36.38 31.70 1x5x s VAL 95 CO 0.56 -0.01 0.37 0.68 0.00 0.00 0.00 175.10 176.71 1x5x s VAL 96 N 2.54 4.14 0.03 2.92 -7.23 0.54 -4.90 120.40 118.45 1x5x s VAL 96 Ca 0.66 -1.15 0.07 0.00 -1.81 0.00 0.00 61.98 59.75 1x5x s VAL 96 Cb -0.33 -3.41 -0.02 0.00 0.56 0.00 0.00 36.38 33.18 1x5x s VAL 96 CO 0.27 -0.21 -0.19 -0.70 -0.31 0.00 0.00 175.10 173.96 1x5x s GLU 97 N -4.06 1.33 0.16 4.82 2.12 -1.26 -0.98 118.70 120.83 1x5x s GLU 97 Ca 0.41 -0.85 -0.08 0.00 0.36 0.00 0.00 54.97 54.81 1x5x s GLU 97 Cb -0.08 -1.39 -0.01 0.00 0.26 0.00 0.00 34.13 32.90 1x5x s GLU 97 CO 0.29 0.36 0.26 -0.06 -0.54 0.00 0.00 175.26 175.57 1x5x s PHE 98 N -0.73 0.44 0.11 5.30 0.08 -0.87 -5.01 117.98 117.30 1x5x s PHE 98 Ca 0.06 -0.80 0.05 0.00 0.12 0.00 0.00 56.93 56.36 1x5x s PHE 98 Cb -0.08 -0.10 -0.04 0.00 -0.57 0.00 0.00 43.02 42.23 1x5x s PHE 98 CO 0.01 -0.70 -0.12 0.99 -0.10 0.00 0.00 175.22 175.30 1x5x s THR 99 N -3.97 1.16 0.63 0.64 2.01 -1.26 -1.45 115.64 113.39 1x5x s THR 99 Ca 0.18 -1.72 0.06 0.00 0.31 0.00 0.00 61.69 60.51 1x5x s THR 99 Cb 0.04 -1.49 0.10 0.00 0.01 0.00 0.00 72.50 71.16 1x5x s THR 99 CO 0.00 -0.51 0.87 0.42 -0.69 0.00 0.00 174.62 174.71 1x5x s THR 100 N -2.38 2.16 0.34 -0.82 -4.23 0.14 -4.81 115.64 106.04 1x5x s THR 100 Ca 0.08 -0.84 0.07 0.00 -1.18 0.00 0.00 61.69 59.82 1x5x s THR 100 Cb -0.03 -2.32 -0.01 0.00 1.34 0.00 0.00 72.50 71.48 1x5x s THR 100 CO 0.02 0.00 0.45 0.00 -0.54 0.00 0.00 174.62 174.54 1x5x s PRO 102 N -4.16 4.55 -0.07 0.00 0.04 -1.26 -2.24 135.00 131.87 1x5x s PRO 102 Ca 0.45 1.74 -0.15 0.00 0.04 0.00 0.00 61.00 63.08 1x5x s PRO 102 Cb -0.09 -3.29 -0.11 0.00 0.04 0.00 0.00 34.50 31.06 1x5x s PRO 102 CO 0.30 -0.00 0.58 0.22 0.04 0.00 0.00 177.00 178.14 1x5x h ASP 103 N 5.41 -0.18 0.00 6.66 3.58 -1.93 -3.41 116.42 126.55 1x5x h ASP 103 Ca -0.44 -0.24 -0.10 0.00 0.42 0.00 0.00 57.03 56.67 1x5x h ASP 103 Cb 1.21 0.05 -0.01 0.00 1.72 0.00 0.00 39.33 42.30 1x5x h ASP 103 CO 0.74 0.38 -0.79 -1.28 -2.88 0.00 0.00 179.24 175.40 1x5x h SER 104 N -0.98 0.00 -3.82 2.28 0.87 -2.02 -3.51 113.55 106.37 1x5x h SER 104 Ca -0.02 -0.24 0.11 0.00 -1.23 0.00 0.00 61.79 60.41 1x5x h SER 104 Cb 0.42 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.34 1x5x h SER 104 CO 0.04 1.07 -0.22 0.61 -0.53 0.00 0.00 176.83 177.79 1x5x n GLY 105 N 1.55 -1.86 2.87 5.77 0.00 -1.26 -4.23 105.19 108.03 1x5x n GLY 105 Ca -0.18 -1.40 -0.41 0.00 0.00 0.00 0.00 46.02 44.03 1x5x n GLY 105 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1x5x n PRO 106 N -2.58 2.21 -3.17 1.61 -0.04 -1.26 -4.51 135.00 127.26 1x5x n PRO 106 Ca -0.01 -2.15 -0.20 0.00 -0.04 0.00 0.00 63.50 61.10 1x5x n PRO 106 Cb 0.20 -3.04 0.02 0.00 -0.04 0.00 0.00 33.50 30.64 1x5x n PRO 106 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1x5x n SER 107 N 6.50 -6.73 -4.76 3.54 2.88 -1.26 -4.87 113.62 108.91 1x5x n SER 107 Ca 0.52 0.30 -0.38 0.00 -1.33 0.00 0.00 58.87 57.98 1x5x n SER 107 Cb 0.37 -3.33 0.02 0.00 -0.75 0.00 0.00 64.21 60.53 1x5x n SER 107 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1x5x s SER 108 N -1.84 5.68 0.00 -3.46 0.15 -1.26 -5.25 113.70 107.72 1x5x s SER 108 Ca 0.26 2.60 0.00 0.00 0.70 0.00 0.00 55.95 59.51 1x5x s SER 108 Cb -0.04 -2.62 0.00 0.00 -1.71 0.00 0.00 66.02 61.64 1x5x s SER 108 CO 0.73 -1.28 0.00 0.61 1.20 0.00 0.00 173.24 174.51