#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1run h THR 10 N 0.00 0.15 -0.65 0.52 1.35 -2.02 0.86 112.91 113.13 1run h THR 10 Ca 0.00 -0.05 0.06 0.00 -0.55 0.00 0.00 66.41 65.87 1run h THR 10 Cb 0.00 -0.01 -0.06 0.00 -1.73 0.00 0.00 68.15 66.36 1run h THR 10 CO 0.00 0.03 0.35 -0.07 -0.25 0.00 0.00 175.52 175.57 1run h LEU 11 N 0.15 0.50 -1.84 3.87 3.38 -1.97 -2.08 115.31 117.31 1run h LEU 11 Ca 0.80 0.04 -0.03 0.00 0.09 0.00 0.00 57.88 58.77 1run h LEU 11 Cb 2.15 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 42.83 1run h LEU 11 CO -0.59 0.32 -0.14 -0.33 0.09 0.00 0.00 178.44 177.79 1run h GLU 12 N 0.64 0.00 -0.50 1.13 3.07 -1.05 0.40 114.58 118.27 1run h GLU 12 Ca 0.29 0.00 -0.04 0.00 -0.50 0.00 0.00 59.36 59.11 1run h GLU 12 Cb 0.21 0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 28.10 1run h GLU 12 CO -0.19 0.14 0.15 2.35 -1.40 0.00 0.00 179.01 180.06 1run h TRP 13 N 0.00 0.80 0.38 4.33 7.01 -1.43 -3.20 115.95 123.84 1run h TRP 13 Ca -0.00 -0.08 -0.02 0.00 2.11 0.00 0.00 58.89 60.90 1run h TRP 13 Cb 0.33 -0.23 0.00 0.00 -2.10 0.00 0.00 29.16 27.17 1run h TRP 13 CO 0.00 0.70 -0.18 0.35 -2.79 0.00 0.00 178.44 176.52 1run h PHE 14 N 0.67 -0.48 -0.49 2.65 3.57 -1.31 -3.34 116.94 118.22 1run h PHE 14 Ca 0.16 -0.01 -0.20 0.00 3.53 0.00 0.00 57.97 61.45 1run h PHE 14 Cb 0.28 0.16 -0.03 0.00 2.79 0.00 0.00 35.95 39.15 1run h PHE 14 CO 0.02 -0.23 0.56 -1.17 -2.23 0.00 0.00 178.31 175.25 1run s LEU 15 N -9.14 2.96 0.00 0.59 2.96 0.13 0.64 118.68 116.82 1run s LEU 15 Ca -0.09 -0.79 0.00 0.00 -0.22 0.00 0.00 54.13 53.02 1run s LEU 15 Cb 0.01 -2.57 0.00 0.00 0.50 0.00 0.00 46.19 44.13 1run s LEU 15 CO 0.30 -3.37 0.00 -1.54 -1.32 0.00 0.00 176.35 170.42 1run n SER 16 N 15.94 0.00 0.09 3.68 3.41 -1.24 -4.50 113.62 130.99 1run n SER 16 Ca 0.43 0.00 -0.04 0.00 -0.26 0.00 0.00 58.87 59.00 1run n SER 16 Cb 0.46 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.34 1run n SER 16 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 175.04 175.33 1run h HIS 17 N 0.00 0.00 -3.60 7.33 3.86 0.09 -3.44 115.15 119.39 1run h HIS 17 Ca 0.00 0.00 -0.63 0.00 -1.16 0.00 0.00 60.37 58.58 1run h HIS 17 Cb 0.00 0.00 -0.13 0.00 1.06 0.00 0.00 27.41 28.34 1run h HIS 17 CO 0.00 0.82 0.27 0.00 0.86 0.00 0.00 177.93 179.88 1run s HIS 19 N 3.07 2.21 0.24 0.00 3.76 -0.56 -4.20 115.29 119.81 1run s HIS 19 Ca 0.28 0.59 -0.30 0.00 -0.15 0.00 0.00 55.06 55.47 1run s HIS 19 Cb -0.13 -4.31 -0.10 0.00 1.11 0.00 0.00 32.58 29.16 1run s HIS 19 CO 0.20 -2.13 1.41 0.42 -0.85 0.00 0.00 174.74 173.80 1run s ILE 20 N 6.23 2.75 0.01 0.60 1.09 -1.26 -1.39 121.20 129.24 1run s ILE 20 Ca 0.60 0.63 0.01 0.00 -1.10 0.00 0.00 60.65 60.79 1run s ILE 20 Cb -0.13 -3.40 -0.01 0.00 -1.06 0.00 0.00 42.46 37.85 1run s ILE 20 CO 0.28 0.10 -0.03 -1.00 -0.10 0.00 0.00 174.94 174.20 1run s HIS 21 N -0.03 0.25 -0.03 3.97 3.76 -1.22 -4.89 115.29 117.11 1run s HIS 21 Ca 0.59 -0.25 -0.27 0.00 -0.15 0.00 0.00 55.06 54.98 1run s HIS 21 Cb -0.41 -0.16 -0.03 0.00 1.11 0.00 0.00 32.58 33.08 1run s HIS 21 CO 0.43 -0.07 0.84 0.21 -0.85 0.00 0.00 174.74 175.29 1run s LYS 22 N -0.69 4.50 -0.08 1.40 2.47 -1.26 -1.64 119.74 124.44 1run s LYS 22 Ca -0.06 1.15 0.00 0.00 -1.56 0.00 0.00 55.97 55.50 1run s LYS 22 Cb -0.05 -3.45 0.02 0.00 -1.46 0.00 0.00 37.83 32.90 1run s LYS 22 CO -0.00 0.03 -0.07 0.71 0.16 0.00 0.00 175.35 176.18 1run s TYR 23 N 0.83 1.20 0.79 4.03 1.51 -0.79 -4.97 117.35 119.94 1run s TYR 23 Ca 0.44 -0.49 -0.11 0.00 -1.01 0.00 0.00 57.07 55.90 1run s TYR 23 Cb -0.19 -1.01 0.06 0.00 -0.11 0.00 0.00 41.96 40.70 1run s TYR 23 CO 0.23 -0.37 1.09 -2.14 -1.11 0.00 0.00 175.55 173.26 1run s PRO 24 N 1.36 2.18 0.50 -1.71 0.02 -1.26 -1.98 135.00 134.11 1run s PRO 24 Ca -0.03 0.72 -0.22 0.00 0.02 0.00 0.00 61.00 61.50 1run s PRO 24 Cb -0.14 -1.92 -0.08 0.00 0.02 0.00 0.00 34.50 32.38 1run s PRO 24 CO -0.03 -1.58 1.03 0.43 -0.33 0.00 0.00 177.00 176.52 1run n SER 25 N -3.42 1.24 0.00 2.53 7.64 -1.26 -1.91 113.62 118.44 1run n SER 25 Ca 0.07 0.95 0.00 0.00 1.01 0.00 0.00 58.87 60.90 1run n SER 25 Cb 0.56 -1.39 0.00 0.00 -1.01 0.00 0.00 64.21 62.36 1run n SER 25 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1run n LYS 26 N -0.36 0.00 -0.34 1.43 4.76 -1.12 -4.91 118.16 117.63 1run n LYS 26 Ca 0.11 0.00 -0.03 0.00 -2.87 0.00 0.00 58.31 55.51 1run n LYS 26 Cb 0.43 -3.27 -0.05 0.00 -1.84 0.00 0.00 35.03 30.30 1run n LYS 26 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 1run n SER 27 N 0.00 2.15 -2.29 4.39 7.64 -0.80 -4.66 113.62 120.05 1run n SER 27 Ca 0.00 -1.80 -0.04 0.00 1.01 0.00 0.00 58.87 58.04 1run n SER 27 Cb 0.00 -0.54 -0.01 0.00 -1.01 0.00 0.00 64.21 62.65 1run n SER 27 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1run n THR 28 N 2.48 -0.06 -0.06 0.44 -2.24 -1.26 -4.62 114.28 108.95 1run n THR 28 Ca 0.12 -0.03 0.02 0.00 -2.27 0.00 0.00 64.05 61.89 1run n THR 28 Cb 0.32 -0.08 0.05 0.00 -2.10 0.00 0.00 70.33 68.51 1run n THR 28 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1run n LEU 29 N -1.16 -0.04 -4.04 3.22 7.99 -0.80 -4.37 117.00 117.81 1run n LEU 29 Ca -0.01 0.32 -0.09 0.00 -0.01 0.00 0.00 56.01 56.21 1run n LEU 29 Cb 0.06 -0.11 -0.11 0.00 -0.11 0.00 0.00 43.42 43.16 1run n LEU 29 CO 0.10 -0.31 -0.37 -0.63 -1.51 0.00 0.00 177.39 174.67 1run s ILE 30 N -5.01 0.23 0.01 -0.08 1.01 0.49 -4.99 121.20 112.85 1run s ILE 30 Ca -0.03 -1.29 0.07 0.00 0.00 0.00 0.00 60.65 59.41 1run s ILE 30 Cb 0.05 -0.80 -0.02 0.00 0.01 0.00 0.00 42.46 41.70 1run s ILE 30 CO 0.14 -0.68 -0.22 -1.00 0.00 0.00 0.00 174.94 173.19 1run s HIS 31 N -2.40 1.91 0.53 3.97 3.76 -1.26 -2.29 115.29 119.51 1run s HIS 31 Ca -0.06 -0.37 -0.21 0.00 -0.15 0.00 0.00 55.06 54.27 1run s HIS 31 Cb -0.03 -1.18 -0.05 0.00 1.11 0.00 0.00 32.58 32.42 1run s HIS 31 CO -0.04 0.03 1.26 -1.14 -0.85 0.00 0.00 174.74 174.00 1run s GLN 32 N -0.84 3.27 0.00 1.40 0.74 -1.24 -3.74 119.66 119.25 1run s GLN 32 Ca 0.08 2.00 0.00 0.00 0.05 0.00 0.00 55.36 57.49 1run s GLN 32 Cb -0.09 -2.21 0.00 0.00 1.10 0.00 0.00 33.01 31.81 1run s GLN 32 CO 0.00 -1.01 0.00 0.41 -0.55 0.00 0.00 175.29 174.14 1run n GLY 33 N 0.60 2.81 2.85 2.59 0.00 -0.89 -4.88 105.19 108.26 1run n GLY 33 Ca 0.10 -0.44 -0.17 0.00 0.00 0.00 0.00 46.02 45.51 1run n GLY 33 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1run n GLU 34 N 0.00 -2.05 -4.88 1.61 1.02 -1.25 -4.10 120.64 110.99 1run n GLU 34 Ca 0.00 -0.83 -0.33 0.00 -0.02 0.00 0.00 57.16 55.99 1run n GLU 34 Cb 0.00 -1.46 -0.14 0.00 -0.02 0.00 0.00 31.44 29.82 1run n GLU 34 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1run s LYS 35 N -3.73 2.91 -0.96 3.49 3.01 -1.26 -0.86 119.74 122.34 1run s LYS 35 Ca 0.38 -0.72 -0.17 0.00 -1.01 0.00 0.00 55.97 54.46 1run s LYS 35 Cb -0.07 -2.47 -0.28 0.00 -1.01 0.00 0.00 37.83 34.00 1run s LYS 35 CO 0.32 0.41 2.33 0.00 0.51 0.00 0.00 175.35 178.92 1run n ALA 36 N 2.94 0.84 -0.12 5.17 0.00 -0.81 -4.80 120.51 123.73 1run n ALA 36 Ca -0.18 -0.73 0.00 0.00 0.00 0.00 0.00 53.44 52.53 1run n ALA 36 Cb 0.52 -2.47 0.00 0.00 0.00 0.00 0.00 19.45 17.51 1run n ALA 36 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1run n GLU 37 N 6.69 0.00 -1.71 0.00 0.00 -1.26 -4.91 120.64 119.45 1run n GLU 37 Ca 0.65 0.14 -0.01 0.00 0.00 0.00 0.00 57.16 57.94 1run n GLU 37 Cb 0.15 -0.59 -0.00 0.00 0.00 0.00 0.00 31.44 31.00 1run n GLU 37 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.13 179.54 1run n THR 38 N -2.20 0.00 -4.24 3.84 -1.04 -1.26 -3.25 114.28 106.12 1run n THR 38 Ca 0.00 -0.04 -0.21 0.00 -2.04 0.00 0.00 64.05 61.76 1run n THR 38 Cb 0.00 -0.33 -0.16 0.00 -1.82 0.00 0.00 70.33 68.02 1run n THR 38 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 1run s LEU 39 N 0.00 1.39 0.11 -4.42 1.98 -0.36 -4.67 118.68 112.70 1run s LEU 39 Ca 0.00 -0.16 0.08 0.00 -2.89 0.00 0.00 54.13 51.17 1run s LEU 39 Cb -0.00 -0.52 -0.04 0.00 0.66 0.00 0.00 46.19 46.29 1run s LEU 39 CO 0.00 -0.04 -0.16 -0.31 -1.89 0.00 0.00 176.35 173.96 1run s TYR 40 N 0.87 2.59 -0.10 5.38 1.51 -1.06 -2.25 117.35 124.29 1run s TYR 40 Ca -0.12 -0.23 -0.04 0.00 -1.01 0.00 0.00 57.07 55.67 1run s TYR 40 Cb -0.15 -1.38 0.05 0.00 -0.11 0.00 0.00 41.96 40.38 1run s TYR 40 CO 0.01 0.39 0.21 -0.47 -1.11 0.00 0.00 175.55 174.57 1run s TYR 41 N -1.14 -0.29 -0.82 2.71 6.14 -0.14 -0.27 117.35 123.54 1run s TYR 41 Ca 0.19 0.76 -0.25 0.00 0.64 0.00 0.00 57.07 58.40 1run s TYR 41 Cb -0.11 -0.13 0.01 0.00 0.42 0.00 0.00 41.96 42.16 1run s TYR 41 CO 0.11 -0.29 1.57 0.42 0.64 0.00 0.00 175.55 178.00 1run s ILE 42 N 2.13 3.65 -2.01 3.14 1.01 -1.16 -0.71 121.20 127.26 1run s ILE 42 Ca -0.00 -0.10 0.05 0.00 0.00 0.00 0.00 60.65 60.60 1run s ILE 42 Cb -0.12 -4.59 0.14 0.00 0.01 0.00 0.00 42.46 37.90 1run s ILE 42 CO -0.07 -1.52 1.15 0.52 0.00 0.00 0.00 174.94 175.02 1run n VAL 43 N 6.96 0.11 0.00 2.92 0.31 0.21 -1.76 118.33 127.08 1run n VAL 43 Ca 0.22 -0.12 0.00 0.00 -0.01 0.00 0.00 64.34 64.43 1run n VAL 43 Cb 0.50 0.03 0.00 0.00 -0.91 0.00 0.00 33.84 33.46 1run n VAL 43 CO 0.00 0.00 0.00 1.17 -1.32 0.00 0.00 176.83 176.68 1run n LYS 44 N -0.28 0.00 0.00 5.55 0.00 -1.20 -4.86 118.16 117.37 1run n LYS 44 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.36 1run n LYS 44 Cb 0.08 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.11 1run n LYS 44 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1run n GLY 45 N -0.39 -1.80 3.37 3.14 0.00 -1.26 0.16 105.19 108.41 1run n GLY 45 Ca 0.00 -1.90 -0.10 0.00 0.00 0.00 0.00 46.02 44.03 1run n GLY 45 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1run s SER 46 N -4.00 0.00 0.02 1.61 1.04 -1.26 -2.18 113.70 108.93 1run s SER 46 Ca 0.00 -0.85 -0.05 0.00 0.48 0.00 0.00 55.95 55.53 1run s SER 46 Cb 0.00 0.46 -0.01 0.00 0.10 0.00 0.00 66.02 66.57 1run s SER 46 CO 0.00 -0.93 0.07 0.54 0.98 0.00 0.00 173.24 173.91 1run s VAL 47 N -3.97 0.11 0.18 5.02 0.11 -0.54 -2.08 120.40 119.23 1run s VAL 47 Ca 0.17 -0.89 0.10 0.00 -2.93 0.00 0.00 61.98 58.44 1run s VAL 47 Cb 0.03 -0.53 -0.04 0.00 -1.53 0.00 0.00 36.38 34.30 1run s VAL 47 CO 0.01 -0.49 -0.17 0.00 -3.33 0.00 0.00 175.10 171.12 1run s ALA 48 N -1.79 2.73 -0.01 1.54 0.00 -0.39 -2.22 121.76 121.62 1run s ALA 48 Ca -0.12 -1.53 -0.00 0.00 0.00 0.00 0.00 51.96 50.31 1run s ALA 48 Cb -0.06 -0.55 0.02 0.00 0.00 0.00 0.00 23.12 22.52 1run s ALA 48 CO -0.01 0.47 0.02 0.08 0.00 0.00 0.00 175.76 176.32 1run s VAL 49 N -1.61 -0.03 0.06 0.00 1.01 -0.98 -0.62 120.40 118.23 1run s VAL 49 Ca 0.22 0.13 -0.24 0.00 0.00 0.00 0.00 61.98 62.09 1run s VAL 49 Cb -0.09 -0.06 0.06 0.00 0.00 0.00 0.00 36.38 36.30 1run s VAL 49 CO 0.12 0.05 0.56 -1.48 0.00 0.00 0.00 175.10 174.36 1run s LEU 50 N 0.62 -0.29 0.51 3.92 2.34 0.21 -1.73 118.68 124.26 1run s LEU 50 Ca -0.05 0.21 0.01 0.00 0.06 0.00 0.00 54.13 54.36 1run s LEU 50 Cb -0.07 2.31 -0.01 0.00 -0.56 0.00 0.00 46.19 47.86 1run s LEU 50 CO -0.02 -0.77 0.01 0.27 -1.06 0.00 0.00 176.35 174.79 1run s ILE 51 N -2.61 1.06 0.04 1.48 -4.36 -1.08 -0.95 121.20 114.79 1run s ILE 51 Ca -0.04 -2.00 -0.08 0.00 -0.26 0.00 0.00 60.65 58.27 1run s ILE 51 Cb -0.01 -2.14 -0.00 0.00 1.25 0.00 0.00 42.46 41.56 1run s ILE 51 CO -0.03 0.00 0.15 -0.54 0.24 0.00 0.00 174.94 174.76 1run s LYS 52 N -3.87 0.64 0.00 0.37 1.02 -1.26 -1.01 119.74 115.63 1run s LYS 52 Ca 0.06 -0.68 0.00 0.00 0.02 0.00 0.00 55.97 55.37 1run s LYS 52 Cb 0.01 0.26 0.00 0.00 -0.52 0.00 0.00 37.83 37.58 1run s LYS 52 CO 0.03 -0.17 0.00 -0.40 -0.92 0.00 0.00 175.35 173.89 1run n ASP 53 N 0.74 0.00 -0.63 2.83 3.85 -0.58 -4.86 116.55 117.91 1run n ASP 53 Ca -0.19 0.00 0.49 0.00 -0.71 0.00 0.00 54.79 54.38 1run n ASP 53 Cb 0.59 0.00 0.76 0.00 -1.35 0.00 0.00 41.12 41.12 1run n ASP 53 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 1run n GLU 54 N 0.00 -0.01 0.00 0.11 4.71 -1.26 -4.30 120.64 119.88 1run n GLU 54 Ca 0.00 1.10 0.00 0.00 -0.01 0.00 0.00 57.16 58.25 1run n GLU 54 Cb 0.00 -2.43 0.00 0.00 -1.01 0.00 0.00 31.44 28.00 1run n GLU 54 CO 0.00 0.00 0.00 -1.91 0.09 0.00 0.00 177.13 175.31 1run n GLU 55 N -4.10 0.00 0.00 3.49 4.07 -1.26 -5.14 120.64 117.70 1run n GLU 55 Ca 0.42 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.52 1run n GLU 55 Cb 1.85 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 33.23 1run n GLU 55 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1run n GLY 56 N 0.00 1.05 3.69 8.31 0.00 -1.26 -5.11 105.19 111.87 1run n GLY 56 Ca 0.00 -0.44 -0.45 0.00 0.00 0.00 0.00 46.02 45.13 1run n GLY 56 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1run n LYS 57 N 0.00 2.33 -3.61 1.61 4.81 -1.26 -4.68 118.16 117.36 1run n LYS 57 Ca 0.00 0.84 -0.30 0.00 -0.87 0.00 0.00 58.31 57.98 1run n LYS 57 Cb 0.00 -2.62 -0.04 0.00 0.02 0.00 0.00 35.03 32.39 1run n LYS 57 CO 0.00 0.00 0.00 -1.83 1.17 0.00 0.00 177.40 176.74 1run s GLU 58 N 0.81 3.61 -0.06 1.64 -1.05 -1.26 -1.52 118.70 120.86 1run s GLU 58 Ca 0.76 -0.11 -0.01 0.00 -0.15 0.00 0.00 54.97 55.46 1run s GLU 58 Cb -0.62 -2.80 0.03 0.00 -0.44 0.00 0.00 34.13 30.29 1run s GLU 58 CO 0.38 0.41 0.01 1.41 0.95 0.00 0.00 175.26 178.41 1run s MET 59 N -2.95 0.48 0.52 -4.83 1.75 -0.18 -4.86 119.30 109.24 1run s MET 59 Ca 0.41 0.15 -0.20 0.00 -1.25 0.00 0.00 55.69 54.80 1run s MET 59 Cb -0.12 -0.87 -0.06 0.00 2.84 0.00 0.00 34.83 36.63 1run s MET 59 CO 0.26 -0.29 1.16 0.42 -0.65 0.00 0.00 175.02 175.92 1run s ILE 60 N 1.94 3.03 0.00 10.11 1.01 -0.81 -2.62 121.20 133.86 1run s ILE 60 Ca 0.04 0.68 0.00 0.00 0.00 0.00 0.00 60.65 61.37 1run s ILE 60 Cb -0.12 -3.30 0.00 0.00 0.01 0.00 0.00 42.46 39.05 1run s ILE 60 CO -0.05 -0.10 0.00 0.18 0.00 0.00 0.00 174.94 174.98 1run n LEU 61 N -1.08 0.00 -3.60 2.97 4.77 -0.70 -4.63 117.00 114.72 1run n LEU 61 Ca 0.11 0.00 -0.03 0.00 -0.03 0.00 0.00 56.01 56.05 1run n LEU 61 Cb 0.50 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.57 1run n LEU 61 CO 0.45 0.00 0.95 -0.44 -1.33 0.00 0.00 177.39 177.02 1run s SER 62 N -1.85 -0.15 0.31 -1.43 0.01 -1.22 -4.96 113.70 104.40 1run s SER 62 Ca 0.00 -0.07 0.01 0.00 1.31 0.00 0.00 55.95 57.21 1run s SER 62 Cb 0.00 0.21 0.01 0.00 0.21 0.00 0.00 66.02 66.46 1run s SER 62 CO 0.00 -0.36 0.12 -1.22 0.41 0.00 0.00 173.24 172.19 1run n TYR 63 N -0.25 -0.18 -3.54 2.43 0.53 -1.26 -2.31 117.16 112.58 1run n TYR 63 Ca -0.04 -1.41 -0.16 0.00 -1.02 0.00 0.00 57.90 55.27 1run n TYR 63 Cb 0.60 -0.23 -0.06 0.00 -1.03 0.00 0.00 39.34 38.62 1run n TYR 63 CO 0.00 0.00 0.00 -0.51 -1.02 0.00 0.00 176.86 175.33 1run s LEU 64 N 0.00 -0.61 0.35 7.72 1.02 -0.94 -4.91 118.68 121.30 1run s LEU 64 Ca 0.09 0.75 0.07 0.00 0.02 0.00 0.00 54.13 55.06 1run s LEU 64 Cb -0.01 2.40 -0.03 0.00 0.02 0.00 0.00 46.19 48.57 1run s LEU 64 CO 0.06 -0.51 0.26 0.20 0.02 0.00 0.00 176.35 176.38 1run s ASN 65 N -0.97 1.89 0.01 2.29 -0.87 -1.26 -1.47 114.94 114.56 1run s ASN 65 Ca -0.08 -1.77 -0.17 0.00 -1.57 0.00 0.00 52.86 49.27 1run s ASN 65 Cb -0.01 0.57 -0.09 0.00 -0.02 0.00 0.00 41.25 41.71 1run s ASN 65 CO 0.07 -1.06 0.44 0.00 -2.57 0.00 0.00 177.10 173.99 1run n GLN 66 N -0.68 0.00 -0.43 -0.60 6.02 -0.93 -1.79 117.38 118.98 1run n GLN 66 Ca 0.06 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.05 1run n GLN 66 Cb 0.62 -0.63 0.00 0.00 1.02 0.00 0.00 30.24 31.25 1run n GLN 66 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1run n GLY 67 N 0.67 1.08 3.98 1.08 0.00 -0.72 -5.04 105.19 106.23 1run n GLY 67 Ca 0.09 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.86 1run n GLY 67 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1run s ASP 68 N -3.05 4.23 -0.16 1.61 1.11 -0.74 -4.92 116.67 114.75 1run s ASP 68 Ca 0.00 -0.18 0.01 0.00 0.18 0.00 0.00 52.55 52.56 1run s ASP 68 Cb 0.00 -0.20 0.02 0.00 1.07 0.00 0.00 42.92 43.81 1run s ASP 68 CO 0.00 -1.95 -0.17 -0.36 1.18 0.00 0.00 175.17 173.88 1run s PHE 69 N -3.25 2.39 0.38 4.23 0.08 -1.26 -2.96 117.98 117.59 1run s PHE 69 Ca 0.67 -1.36 -0.07 0.00 0.12 0.00 0.00 56.93 56.28 1run s PHE 69 Cb -0.06 -1.71 -0.05 0.00 -0.57 0.00 0.00 43.02 40.63 1run s PHE 69 CO 0.45 -0.71 0.69 0.42 -0.10 0.00 0.00 175.22 175.98 1run s ILE 70 N 1.37 4.90 -0.41 0.64 1.01 0.62 -4.73 121.20 124.61 1run s ILE 70 Ca 0.04 0.30 -0.35 0.00 0.00 0.00 0.00 60.65 60.64 1run s ILE 70 Cb -0.13 -3.76 0.05 0.00 0.01 0.00 0.00 42.46 38.63 1run s ILE 70 CO -0.11 -0.52 0.60 0.61 0.00 0.00 0.00 174.94 175.53 1run n GLY 71 N -1.38 0.13 0.00 6.18 0.00 -1.26 -2.57 105.19 106.29 1run n GLY 71 Ca 0.00 1.06 0.00 0.00 0.00 0.00 0.00 46.02 47.08 1run n GLY 71 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1run n GLU 72 N -0.04 4.55 0.00 1.61 0.00 -1.26 -4.22 120.64 121.28 1run n GLU 72 Ca -0.08 -0.01 0.01 0.00 0.00 0.00 0.00 57.16 57.08 1run n GLU 72 Cb 0.66 -0.36 0.07 0.00 0.00 0.00 0.00 31.44 31.82 1run n GLU 72 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 1run n LEU 73 N -0.65 0.00 -0.10 -1.84 4.32 -1.26 -2.22 117.00 115.25 1run n LEU 73 Ca 0.00 0.00 -0.14 0.00 -0.02 0.00 0.00 56.01 55.85 1run n LEU 73 Cb 0.00 0.00 -0.05 0.00 -1.62 0.00 0.00 43.42 41.76 1run n LEU 73 CO 0.00 0.00 -0.86 0.61 -1.22 0.00 0.00 177.39 175.92 1run n GLY 74 N -0.04 -0.51 0.00 -0.72 0.00 -1.26 -4.82 105.19 97.83 1run n GLY 74 Ca 0.02 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.76 1run n GLY 74 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1run n LEU 75 N -4.40 0.00 -0.33 0.99 7.94 -0.94 -1.61 117.00 118.64 1run n LEU 75 Ca -0.24 0.00 0.12 0.00 -1.11 0.00 0.00 56.01 54.78 1run n LEU 75 Cb 0.60 0.00 0.14 0.00 0.53 0.00 0.00 43.42 44.69 1run n LEU 75 CO 0.17 0.00 0.41 0.49 -1.11 0.00 0.00 177.39 177.34 1run n PHE 76 N -1.61 0.00 -4.15 1.96 3.72 -1.26 -4.93 117.46 111.19 1run n PHE 76 Ca 0.00 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.27 1run n PHE 76 Cb 0.00 -0.06 -0.05 0.00 -0.94 0.00 0.00 39.48 38.43 1run n PHE 76 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 1run n GLU 77 N -0.46 0.34 -4.41 -1.08 4.07 -0.63 -5.18 120.64 113.28 1run n GLU 77 Ca 0.10 -2.34 -0.21 0.00 -0.06 0.00 0.00 57.16 54.64 1run n GLU 77 Cb 0.41 1.98 -0.16 0.00 -0.06 0.00 0.00 31.44 33.61 1run n GLU 77 CO 0.00 0.00 0.00 -1.21 -0.06 0.00 0.00 177.13 175.86 1run s GLU 78 N -2.90 1.11 0.00 5.31 2.02 -1.26 -4.80 118.70 118.17 1run s GLU 78 Ca 0.27 -0.31 0.00 0.00 0.02 0.00 0.00 54.97 54.96 1run s GLU 78 Cb 0.01 -1.01 0.00 0.00 0.10 0.00 0.00 34.13 33.23 1run s GLU 78 CO 0.19 0.07 0.00 0.41 0.02 0.00 0.00 175.26 175.96 1run n GLY 79 N 3.49 1.36 3.78 -1.39 0.00 -1.26 -5.07 105.19 106.10 1run n GLY 79 Ca -0.20 -0.30 -0.39 0.00 0.00 0.00 0.00 46.02 45.13 1run n GLY 79 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1run s GLN 80 N -1.99 4.40 0.56 1.61 -1.52 -1.26 -4.97 119.66 116.49 1run s GLN 80 Ca 0.00 0.95 -0.07 0.00 -1.95 0.00 0.00 55.36 54.30 1run s GLN 80 Cb 0.00 -3.28 -0.02 0.00 -0.22 0.00 0.00 33.01 29.49 1run s GLN 80 CO 0.00 0.53 0.88 -1.21 -0.25 0.00 0.00 175.29 175.24 1run s GLU 81 N -0.86 3.28 0.25 2.91 2.02 -1.26 -1.92 118.70 123.12 1run s GLU 81 Ca 0.33 0.22 -0.30 0.00 0.02 0.00 0.00 54.97 55.24 1run s GLU 81 Cb -0.21 -2.27 -0.10 0.00 0.10 0.00 0.00 34.13 31.65 1run s GLU 81 CO 0.22 -0.49 1.50 0.50 0.02 0.00 0.00 175.26 177.01 1run s ARG 82 N -4.94 4.22 0.15 1.61 6.06 -0.04 -4.82 118.95 121.20 1run s ARG 82 Ca 0.52 2.38 -0.13 0.00 -2.50 0.00 0.00 55.73 56.00 1run s ARG 82 Cb -0.11 -3.09 0.02 0.00 0.06 0.00 0.00 34.95 31.84 1run s ARG 82 CO 0.47 -0.50 1.64 0.66 -2.50 0.00 0.00 175.30 175.07 1run h SER 83 N 5.20 0.78 -5.24 -2.12 4.64 -1.92 -2.37 113.55 112.52 1run h SER 83 Ca -0.46 -0.26 0.09 0.00 -0.47 0.00 0.00 61.79 60.70 1run h SER 83 Cb 1.22 -0.21 -0.02 0.00 -0.31 0.00 0.00 62.40 63.08 1run h SER 83 CO 0.80 0.84 0.45 0.00 -0.87 0.00 0.00 176.83 178.05 1run s ALA 84 N -5.21 -1.26 0.27 5.18 0.00 -1.26 -4.88 121.76 114.60 1run s ALA 84 Ca -0.13 -0.48 -0.28 0.00 0.00 0.00 0.00 51.96 51.07 1run s ALA 84 Cb 0.11 0.72 -0.09 0.00 0.00 0.00 0.00 23.12 23.87 1run s ALA 84 CO 0.80 -1.03 0.93 -1.58 0.00 0.00 0.00 175.76 174.88 1run s TRP 85 N -2.31 3.87 -0.19 0.00 0.51 -0.12 -3.69 118.94 117.02 1run s TRP 85 Ca 0.19 1.85 -0.02 0.00 -2.12 0.00 0.00 56.10 55.99 1run s TRP 85 Cb -0.04 -2.95 0.06 0.00 -0.81 0.00 0.00 33.47 29.74 1run s TRP 85 CO 0.08 0.37 0.03 0.08 -0.51 0.00 0.00 176.95 176.99 1run s VAL 86 N -1.34 0.59 -0.16 4.03 1.01 -0.97 -0.62 120.40 122.94 1run s VAL 86 Ca 0.44 -0.54 0.02 0.00 0.00 0.00 0.00 61.98 61.89 1run s VAL 86 Cb -0.23 -1.04 0.01 0.00 0.00 0.00 0.00 36.38 35.12 1run s VAL 86 CO 0.29 -0.16 -0.21 -0.60 0.00 0.00 0.00 175.10 174.42 1run s ARG 87 N 1.83 3.03 0.24 2.72 3.52 0.21 -0.38 118.95 130.12 1run s ARG 87 Ca -0.01 -0.83 -0.30 0.00 -0.13 0.00 0.00 55.73 54.45 1run s ARG 87 Cb -0.17 -2.50 -0.14 0.00 -1.56 0.00 0.00 34.95 30.57 1run s ARG 87 CO -0.08 -0.08 1.15 0.00 -0.81 0.00 0.00 175.30 175.48 1run n ALA 88 N 4.26 -0.17 -1.53 6.12 0.00 -1.26 -1.26 120.51 126.66 1run n ALA 88 Ca -0.20 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.66 1run n ALA 88 Cb 0.51 -2.07 0.00 0.00 0.00 0.00 0.00 19.45 17.89 1run n ALA 88 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1run n LYS 89 N 1.35 0.00 -1.04 0.00 4.81 -0.88 -2.77 118.16 119.62 1run n LYS 89 Ca 0.12 0.00 -0.29 0.00 -0.87 0.00 0.00 58.31 57.27 1run n LYS 89 Cb 0.29 0.00 0.18 0.00 0.02 0.00 0.00 35.03 35.52 1run n LYS 89 CO 0.00 0.00 0.00 0.99 1.17 0.00 0.00 177.40 179.56 1run s THR 90 N 0.42 2.21 0.50 3.15 2.01 -1.26 -3.15 115.64 119.51 1run s THR 90 Ca 0.00 0.07 -0.22 0.00 0.31 0.00 0.00 61.69 61.85 1run s THR 90 Cb 0.00 -2.46 -0.06 0.00 0.01 0.00 0.00 72.50 69.99 1run s THR 90 CO 0.00 -0.09 1.21 0.00 -0.69 0.00 0.00 174.62 175.06 1run s ALA 91 N -2.85 2.88 0.31 7.40 0.00 -1.26 -4.39 121.76 123.85 1run s ALA 91 Ca 0.65 1.03 -0.08 0.00 0.00 0.00 0.00 51.96 53.57 1run s ALA 91 Cb -0.20 -3.43 0.00 0.00 0.00 0.00 0.00 23.12 19.49 1run s ALA 91 CO 0.59 -0.88 0.50 0.00 0.00 0.00 0.00 175.76 175.97 1run s GLU 93 N -3.38 1.78 -0.47 0.00 -1.05 0.12 -1.89 118.70 113.82 1run s GLU 93 Ca 0.26 -0.98 -0.08 0.00 -0.15 0.00 0.00 54.97 54.01 1run s GLU 93 Cb -0.01 -2.57 0.12 0.00 -0.44 0.00 0.00 34.13 31.23 1run s GLU 93 CO 0.15 -0.55 0.33 0.08 0.95 0.00 0.00 175.26 176.22 1run s VAL 94 N 1.37 4.07 0.72 1.83 1.01 -0.65 0.67 120.40 129.42 1run s VAL 94 Ca -0.05 -1.88 -0.11 0.00 0.00 0.00 0.00 61.98 59.94 1run s VAL 94 Cb -0.18 -3.69 0.02 0.00 0.00 0.00 0.00 36.38 32.53 1run s VAL 94 CO -0.07 -0.77 1.08 0.00 0.00 0.00 0.00 175.10 175.35 1run s ALA 95 N 1.26 2.70 0.11 5.51 0.00 0.11 -3.40 121.76 128.07 1run s ALA 95 Ca 0.07 -0.22 -0.25 0.00 0.00 0.00 0.00 51.96 51.56 1run s ALA 95 Cb -0.25 -3.07 0.08 0.00 0.00 0.00 0.00 23.12 19.87 1run s ALA 95 CO -0.02 -1.27 0.69 -1.83 0.00 0.00 0.00 175.76 173.34 1run s GLU 96 N -5.24 1.14 0.08 0.00 -1.05 -0.48 -0.96 118.70 112.19 1run s GLU 96 Ca 0.59 -0.42 0.03 0.00 -0.15 0.00 0.00 54.97 55.01 1run s GLU 96 Cb -0.12 0.53 -0.03 0.00 -0.44 0.00 0.00 34.13 34.06 1run s GLU 96 CO 0.53 -0.50 -0.09 0.96 0.95 0.00 0.00 175.26 177.11 1run s ILE 97 N -3.56 0.80 0.20 1.83 -5.25 -0.95 -1.49 121.20 112.77 1run s ILE 97 Ca 0.02 -1.45 -0.30 0.00 -0.99 0.00 0.00 60.65 57.93 1run s ILE 97 Cb -0.01 -1.12 -0.08 0.00 2.95 0.00 0.00 42.46 44.20 1run s ILE 97 CO -0.12 -0.50 1.09 -0.44 -1.79 0.00 0.00 174.94 173.18 1run s SER 98 N -2.15 7.29 0.12 4.36 0.01 -1.26 -1.23 113.70 120.85 1run s SER 98 Ca 0.00 2.11 -0.24 0.00 1.31 0.00 0.00 55.95 59.14 1run s SER 98 Cb -0.05 -2.61 -0.05 0.00 0.21 0.00 0.00 66.02 63.52 1run s SER 98 CO -0.00 -0.18 1.19 -1.22 0.41 0.00 0.00 173.24 173.44 1run n TYR 99 N 2.08 -0.33 -0.25 2.43 4.02 -1.20 -0.97 117.16 122.94 1run n TYR 99 Ca 0.02 0.95 0.05 0.00 -0.01 0.00 0.00 57.90 58.91 1run n TYR 99 Cb 0.46 -0.56 0.17 0.00 -0.02 0.00 0.00 39.34 39.39 1run n TYR 99 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 176.86 176.72 1run h LYS 100 N 0.00 0.20 0.00 -0.72 1.57 -1.92 0.21 116.57 115.90 1run h LYS 100 Ca 0.12 -0.01 -0.09 0.00 -1.87 0.00 0.00 60.65 58.80 1run h LYS 100 Cb 0.31 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.56 1run h LYS 100 CO -0.71 0.13 -0.43 -0.22 -0.57 0.00 0.00 179.45 177.65 1run h LYS 101 N 0.20 0.00 0.03 3.15 3.64 -1.43 -3.02 116.57 119.14 1run h LYS 101 Ca 0.41 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.79 1run h LYS 101 Cb 0.72 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.54 1run h LYS 101 CO -0.56 0.43 -0.01 0.35 -2.27 0.00 0.00 179.45 177.38 1run h PHE 102 N 0.00 -0.03 -0.10 1.91 3.57 0.36 -0.61 116.94 122.04 1run h PHE 102 Ca -0.00 -0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.54 1run h PHE 102 Cb 0.99 0.01 -0.05 0.00 2.79 0.00 0.00 35.95 39.69 1run h PHE 102 CO 0.00 0.02 -0.24 0.00 -2.23 0.00 0.00 178.31 175.85 1run h ARG 103 N -0.08 -0.32 -0.89 1.11 3.08 -1.34 0.31 114.38 116.25 1run h ARG 103 Ca -0.00 0.02 0.06 0.00 0.07 0.00 0.00 59.98 60.13 1run h ARG 103 Cb 0.07 0.07 -0.06 0.00 0.08 0.00 0.00 29.97 30.13 1run h ARG 103 CO 0.01 -0.21 0.56 1.96 -1.07 0.00 0.00 179.97 181.22 1run h GLN 104 N -0.33 1.00 0.03 0.04 4.20 -1.47 0.37 115.11 118.95 1run h GLN 104 Ca 0.09 -0.06 -0.00 0.00 0.06 0.00 0.00 58.65 58.74 1run h GLN 104 Cb 0.46 -0.23 0.00 0.00 0.30 0.00 0.00 27.48 28.01 1run h GLN 104 CO -0.28 0.66 -0.01 -0.07 -0.67 0.00 0.00 178.83 178.46 1run h LEU 105 N 1.03 -0.03 -0.94 1.46 4.07 0.56 -2.78 115.31 118.68 1run h LEU 105 Ca 0.38 -0.04 0.29 0.00 0.08 0.00 0.00 57.88 58.59 1run h LEU 105 Cb 0.15 0.01 -0.15 0.00 1.08 0.00 0.00 40.66 41.74 1run h LEU 105 CO -0.17 0.02 0.34 0.40 -1.08 0.00 0.00 178.44 177.96 1run h ILE 106 N -0.08 0.24 -0.10 1.22 2.04 0.18 0.47 117.51 121.47 1run h ILE 106 Ca -0.00 -0.07 -0.14 0.00 1.00 0.00 0.00 64.86 65.65 1run h ILE 106 Cb 0.07 0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.16 1run h ILE 106 CO 0.01 0.04 -0.56 1.56 0.00 0.00 0.00 178.15 179.20 1run h GLN 107 N 0.20 0.30 0.00 2.37 1.08 -1.19 -0.92 115.11 116.95 1run h GLN 107 Ca 0.65 -0.19 0.00 0.00 -1.45 0.00 0.00 58.65 57.65 1run h GLN 107 Cb 1.42 0.02 0.00 0.00 -0.05 0.00 0.00 27.48 28.87 1run h GLN 107 CO -0.69 0.78 0.00 0.28 -0.95 0.00 0.00 178.83 178.25 1run n VAL 108 N -3.92 0.27 -3.15 -0.54 0.31 0.16 -4.44 118.33 107.01 1run n VAL 108 Ca -0.02 0.07 0.05 0.00 -0.01 0.00 0.00 64.34 64.43 1run n VAL 108 Cb 0.59 -0.65 -0.01 0.00 -0.91 0.00 0.00 33.84 32.85 1run n VAL 108 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 1run s ASN 109 N -2.79 -0.37 0.00 4.52 2.47 -0.93 -5.05 114.94 112.79 1run s ASN 109 Ca 0.18 0.19 0.27 0.00 0.42 0.00 0.00 52.86 53.91 1run s ASN 109 Cb 0.16 1.29 0.82 0.00 -1.45 0.00 0.00 41.25 42.08 1run s ASN 109 CO 0.41 -0.07 1.61 -0.81 -3.72 0.00 0.00 177.10 174.53 1run n PRO 110 N 5.40 1.68 0.00 0.43 -0.04 -0.36 -4.13 135.00 137.97 1run n PRO 110 Ca -0.04 -1.09 0.00 0.00 -0.04 0.00 0.00 63.50 62.33 1run n PRO 110 Cb 0.55 -1.48 0.00 0.00 -0.04 0.00 0.00 33.50 32.53 1run n PRO 110 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1run n ASP 111 N 0.29 0.34 -0.09 3.54 10.43 -1.26 -2.15 116.55 127.64 1run n ASP 111 Ca 0.17 -1.98 -0.10 0.00 2.57 0.00 0.00 54.79 55.46 1run n ASP 111 Cb 0.40 -0.17 -0.15 0.00 1.84 0.00 0.00 41.12 43.05 1run n ASP 111 CO 0.00 0.00 0.00 2.30 -1.07 0.00 0.00 177.20 178.43 1run n ILE 112 N -0.33 1.29 0.03 0.53 -5.35 -1.26 -3.49 119.36 110.79 1run n ILE 112 Ca 0.00 -0.78 0.01 0.00 -0.27 0.00 0.00 62.75 61.70 1run n ILE 112 Cb 0.08 -0.54 0.33 0.00 -1.74 0.00 0.00 39.64 37.77 1run n ILE 112 CO 0.00 0.00 0.00 0.25 -1.76 0.00 0.00 176.55 175.04 1run h LEU 113 N 0.00 0.42 0.51 7.28 5.85 -1.70 0.39 115.31 128.07 1run h LEU 113 Ca -0.51 -0.07 -0.03 0.00 0.84 0.00 0.00 57.88 58.11 1run h LEU 113 Cb 2.14 -0.11 0.01 0.00 0.37 0.00 0.00 40.66 43.07 1run h LEU 113 CO 0.02 0.50 -0.25 -0.03 -0.34 0.00 0.00 178.44 178.34 1run h MET 114 N 0.43 -0.66 -0.09 1.25 4.05 -1.62 -2.86 114.93 115.44 1run h MET 114 Ca 0.09 0.05 -0.01 0.00 -0.28 0.00 0.00 59.70 59.55 1run h MET 114 Cb 0.31 0.15 -0.01 0.00 -0.80 0.00 0.00 31.60 31.26 1run h MET 114 CO 0.01 -0.42 0.02 -0.09 0.23 0.00 0.00 176.91 176.66 1run h ARG 115 N -0.73 0.11 0.72 0.39 2.43 -1.25 -2.52 114.38 113.53 1run h ARG 115 Ca -0.07 -0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.05 1run h ARG 115 Cb 0.55 -0.02 0.01 0.00 -0.42 0.00 0.00 29.97 30.08 1run h ARG 115 CO 0.12 0.11 -0.35 1.25 -1.51 0.00 0.00 179.97 179.59 1run h LEU 116 N 0.12 -0.82 -1.92 3.80 5.85 -0.90 -3.14 115.31 118.30 1run h LEU 116 Ca 0.03 0.01 0.40 0.00 0.84 0.00 0.00 57.88 59.17 1run h LEU 116 Cb 0.05 0.21 -0.06 0.00 0.37 0.00 0.00 40.66 41.23 1run h LEU 116 CO -0.00 -0.45 1.05 0.28 -0.34 0.00 0.00 178.44 178.98 1run h SER 117 N -1.22 0.00 0.23 1.25 0.02 -1.22 0.53 113.55 113.13 1run h SER 117 Ca -0.10 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.84 1run h SER 117 Cb 0.75 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.29 1run h SER 117 CO 0.16 0.00 -0.11 0.00 -1.14 0.00 0.00 176.83 175.74 1run h ALA 118 N 1.21 -0.31 0.10 3.77 0.00 -1.47 0.82 119.26 123.38 1run h ALA 118 Ca 0.66 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.49 1run h ALA 118 Cb 2.76 0.12 0.00 0.00 0.00 0.00 0.00 17.79 20.67 1run h ALA 118 CO -0.01 -0.65 -0.05 1.96 0.00 0.00 0.00 179.25 180.50 1run h GLN 119 N -0.35 -0.13 0.00 0.00 4.20 -0.06 0.20 115.11 118.98 1run h GLN 119 Ca -0.03 0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.69 1run h GLN 119 Cb 0.27 0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.08 1run h GLN 119 CO 0.05 0.13 0.04 0.52 -0.67 0.00 0.00 178.83 178.91 1run h MET 120 N -0.38 0.00 0.05 1.46 2.86 -1.19 -0.56 114.93 117.18 1run h MET 120 Ca -0.01 0.00 -0.35 0.00 -2.06 0.00 0.00 59.70 57.27 1run h MET 120 Cb 0.32 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 31.94 1run h MET 120 CO 0.02 0.00 -1.99 0.00 1.06 0.00 0.00 176.91 176.00 1run n ALA 121 N -1.78 1.01 -0.05 6.32 0.00 0.27 -4.30 120.51 121.99 1run n ALA 121 Ca -0.01 -0.74 -0.14 0.00 0.00 0.00 0.00 53.44 52.54 1run n ALA 121 Cb 0.08 -0.43 -0.03 0.00 0.00 0.00 0.00 19.45 19.07 1run n ALA 121 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 1run h ARG 122 N -0.35 0.79 -0.27 0.00 9.65 0.06 -2.78 114.38 121.47 1run h ARG 122 Ca -0.48 -0.54 0.08 0.00 -1.10 0.00 0.00 59.98 57.94 1run h ARG 122 Cb 1.77 0.08 -0.01 0.00 -1.39 0.00 0.00 29.97 30.42 1run h ARG 122 CO -0.09 1.16 0.23 0.00 2.80 0.00 0.00 179.97 184.08 1run h ARG 123 N 0.59 0.00 0.00 0.20 3.08 -1.37 0.42 114.38 117.29 1run h ARG 123 Ca -0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 1run h ARG 123 Cb 1.22 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 31.26 1run h ARG 123 CO 0.13 0.00 -0.37 1.25 -1.07 0.00 0.00 179.97 179.91 1run h LEU 124 N 0.00 0.00 0.16 3.04 6.46 -1.68 -0.52 115.31 122.77 1run h LEU 124 Ca 0.13 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.88 1run h LEU 124 Cb 0.60 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.53 1run h LEU 124 CO -0.00 0.03 -0.08 -0.61 -0.62 0.00 0.00 178.44 177.16 1run h GLN 125 N 0.00 -0.21 -0.16 1.25 -0.00 -0.14 -0.55 115.11 115.30 1run h GLN 125 Ca -0.00 0.01 0.04 0.00 -0.00 0.00 0.00 58.65 58.70 1run h GLN 125 Cb 1.02 0.05 -0.05 0.00 0.00 0.00 0.00 27.48 28.50 1run h GLN 125 CO 0.00 0.18 -0.13 0.28 0.00 0.00 0.00 178.83 179.17 1run h VAL 126 N -0.66 0.63 -0.35 2.39 2.07 -1.37 -0.48 116.25 118.48 1run h VAL 126 Ca -0.02 0.00 -0.06 0.00 0.82 0.00 0.00 66.70 67.44 1run h VAL 126 Cb 0.48 0.63 -0.02 0.00 -1.52 0.00 0.00 31.29 30.87 1run h VAL 126 CO 0.04 0.00 -0.03 0.74 0.02 0.00 0.00 177.57 178.34 1run h THR 127 N -0.14 1.21 0.00 2.57 2.02 -1.11 -0.93 112.91 116.53 1run h THR 127 Ca 0.10 -0.88 -0.07 0.00 0.77 0.00 0.00 66.41 66.33 1run h THR 127 Cb 0.29 0.98 -0.01 0.00 -1.74 0.00 0.00 68.15 67.66 1run h THR 127 CO -0.24 0.30 -0.35 0.28 0.37 0.00 0.00 175.52 175.87 1run h SER 128 N 0.54 0.00 -0.45 4.18 0.02 -0.29 -2.27 113.55 115.27 1run h SER 128 Ca 0.11 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 61.01 1run h SER 128 Cb 0.39 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.91 1run h SER 128 CO 0.02 0.35 0.07 -0.08 -1.14 0.00 0.00 176.83 176.05 1run h GLU 129 N 0.00 0.75 -0.63 3.45 4.81 0.24 -2.41 114.58 120.78 1run h GLU 129 Ca -0.00 -0.20 0.06 0.00 -0.13 0.00 0.00 59.36 59.08 1run h GLU 129 Cb 0.87 -0.09 -0.05 0.00 0.63 0.00 0.00 28.75 30.11 1run h GLU 129 CO 0.05 0.77 0.35 -0.22 -0.73 0.00 0.00 179.01 179.22 1run h LYS 130 N 0.61 0.63 -0.90 1.92 1.63 -0.82 1.04 116.57 120.68 1run h LYS 130 Ca 0.14 -0.04 0.05 0.00 -0.85 0.00 0.00 60.65 59.95 1run h LYS 130 Cb 0.38 -0.14 -0.06 0.00 -0.60 0.00 0.00 32.23 31.81 1run h LYS 130 CO 0.01 0.41 0.58 0.28 -3.45 0.00 0.00 179.45 177.28 1run h VAL 131 N 0.65 1.09 0.28 2.00 2.07 -1.30 -1.65 116.25 119.39 1run h VAL 131 Ca 0.28 -0.37 -0.00 0.00 0.82 0.00 0.00 66.70 67.43 1run h VAL 131 Cb 0.17 -0.08 -0.03 0.00 -1.52 0.00 0.00 31.29 29.84 1run h VAL 131 CO -0.18 0.20 -0.47 1.23 0.02 0.00 0.00 177.57 178.37 1run h GLY 132 N 1.08 -1.19 0.77 2.17 0.00 0.15 -1.35 103.07 104.69 1run h GLY 132 Ca 0.38 0.60 0.17 0.00 0.00 0.00 0.00 47.33 48.48 1run h GLY 132 CO -0.15 -0.33 0.45 3.43 0.00 0.00 0.00 176.54 179.94 1run h ASN 133 N -0.79 0.11 -0.31 0.19 2.35 -0.22 0.36 115.58 117.27 1run h ASN 133 Ca -0.03 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.73 1run h ASN 133 Cb 0.74 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 39.09 1run h ASN 133 CO -0.16 0.06 0.00 0.18 -1.65 0.00 0.00 177.43 175.86 1run n LEU 134 N -4.39 2.31 0.00 1.61 4.77 -0.56 -3.16 117.00 117.58 1run n LEU 134 Ca 0.12 -1.04 0.00 0.00 -0.03 0.00 0.00 56.01 55.06 1run n LEU 134 Cb 0.63 -0.20 0.00 0.00 -2.33 0.00 0.00 43.42 41.52 1run n LEU 134 CO 0.36 0.52 -0.43 0.00 -1.33 0.00 0.00 177.39 176.51 1run n ALA 135 N 0.74 1.97 -0.01 -1.18 0.00 -0.25 -4.85 120.51 116.94 1run n ALA 135 Ca 0.17 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.71 1run n ALA 135 Cb 0.41 0.39 -0.16 0.00 0.00 0.00 0.00 19.45 20.09 1run n ALA 135 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1run n PHE 136 N -2.24 0.07 -3.26 0.00 3.72 -0.05 -5.02 117.46 110.69 1run n PHE 136 Ca 0.00 0.02 -0.11 0.00 -0.05 0.00 0.00 57.45 57.31 1run n PHE 136 Cb 0.43 -0.56 0.02 0.00 -0.94 0.00 0.00 39.48 38.44 1run n PHE 136 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1run n LEU 137 N -2.31 0.00 -4.39 4.37 4.32 -1.19 -5.05 117.00 112.75 1run n LEU 137 Ca -0.05 -1.35 -0.19 0.00 -0.02 0.00 0.00 56.01 54.39 1run n LEU 137 Cb 0.59 -0.15 -0.10 0.00 -1.62 0.00 0.00 43.42 42.14 1run n LEU 137 CO 0.45 -0.54 -0.35 1.51 -1.22 0.00 0.00 177.39 177.24 1run s ASP 138 N -2.78 2.36 0.31 -1.43 1.47 -1.26 -4.91 116.67 110.42 1run s ASP 138 Ca 0.26 -1.21 0.07 0.00 1.18 0.00 0.00 52.55 52.85 1run s ASP 138 Cb -0.02 -0.09 0.80 0.00 -0.34 0.00 0.00 42.92 43.26 1run s ASP 138 CO 0.16 -0.42 1.75 1.62 0.68 0.00 0.00 175.17 178.96 1run h VAL 139 N 2.35 0.62 -0.49 2.11 3.04 -1.94 0.44 116.25 122.38 1run h VAL 139 Ca -0.39 -0.23 0.03 0.00 -1.01 0.00 0.00 66.70 65.09 1run h VAL 139 Cb 1.23 -0.10 -0.03 0.00 -2.01 0.00 0.00 31.29 30.37 1run h VAL 139 CO 0.66 0.12 0.29 0.74 -1.01 0.00 0.00 177.57 178.37 1run h THR 140 N 0.67 1.04 0.43 3.17 2.02 -1.97 0.19 112.91 118.46 1run h THR 140 Ca 0.60 -0.20 -0.01 0.00 0.77 0.00 0.00 66.41 67.58 1run h THR 140 Cb 1.04 0.41 -0.01 0.00 -1.74 0.00 0.00 68.15 67.85 1run h THR 140 CO -0.43 0.10 -0.34 1.23 0.37 0.00 0.00 175.52 176.45 1run h GLY 141 N 0.57 -0.85 0.37 2.16 0.00 -0.56 -1.06 103.07 103.70 1run h GLY 141 Ca 0.20 0.39 0.06 0.00 0.00 0.00 0.00 47.33 47.98 1run h GLY 141 CO -0.10 -0.31 -0.09 3.21 0.00 0.00 0.00 176.54 179.25 1run h ARG 142 N -0.77 -0.03 -0.15 4.80 3.08 -1.06 -0.99 114.38 119.26 1run h ARG 142 Ca -0.04 0.00 0.04 0.00 0.07 0.00 0.00 59.98 60.06 1run h ARG 142 Cb 0.67 0.01 -0.05 0.00 0.08 0.00 0.00 29.97 30.67 1run h ARG 142 CO -0.01 -0.02 -0.16 0.82 -1.07 0.00 0.00 179.97 179.54 1run h ILE 143 N -0.03 0.58 -0.40 2.04 2.04 -0.67 0.22 117.51 121.29 1run h ILE 143 Ca 0.14 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.05 1run h ILE 143 Cb 0.25 0.58 -0.04 0.00 -0.74 0.00 0.00 36.82 36.86 1run h ILE 143 CO -0.32 0.00 0.14 0.00 0.00 0.00 0.00 178.15 177.97 1run h ALA 144 N 0.89 0.47 -0.29 1.87 0.00 -0.89 -1.09 119.26 120.22 1run h ALA 144 Ca 0.10 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 1run h ALA 144 Cb 0.33 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 1run h ALA 144 CO -0.26 -0.25 0.14 1.96 0.00 0.00 0.00 179.25 180.84 1run h GLN 145 N 0.30 0.41 -0.84 0.00 1.08 -0.41 -2.93 115.11 112.71 1run h GLN 145 Ca 0.18 -0.05 0.02 0.00 -1.45 0.00 0.00 58.65 57.35 1run h GLN 145 Cb 0.17 -0.08 -0.05 0.00 -0.05 0.00 0.00 27.48 27.48 1run h GLN 145 CO -0.19 0.38 0.55 1.15 -0.95 0.00 0.00 178.83 179.77 1run h THR 146 N 0.33 1.18 -0.94 -0.54 2.02 0.39 -0.79 112.91 114.56 1run h THR 146 Ca 0.10 -0.38 0.04 0.00 0.77 0.00 0.00 66.41 66.94 1run h THR 146 Cb 0.10 -0.02 -0.05 0.00 -1.74 0.00 0.00 68.15 66.43 1run h THR 146 CO -0.01 0.20 0.61 -0.07 0.37 0.00 0.00 175.52 176.62 1run h LEU 147 N 1.10 1.00 0.00 2.58 3.38 -1.06 0.77 115.31 123.08 1run h LEU 147 Ca 0.32 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.28 1run h LEU 147 Cb -0.06 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.46 1run h LEU 147 CO -0.09 0.68 -0.00 -0.07 0.09 0.00 0.00 178.44 179.05 1run h LEU 148 N 1.16 -0.00 -0.19 1.67 -0.00 -1.04 -1.06 115.31 115.86 1run h LEU 148 Ca 0.38 -0.11 0.04 0.00 -0.00 0.00 0.00 57.88 58.18 1run h LEU 148 Cb 0.04 0.00 -0.07 0.00 -0.00 0.00 0.00 40.66 40.63 1run h LEU 148 CO -0.12 0.11 -0.51 0.78 -0.00 0.00 0.00 178.44 178.70 1run h ASN 149 N -0.12 -1.63 -0.02 -0.43 2.35 -0.45 -0.94 115.58 114.34 1run h ASN 149 Ca -0.00 0.20 0.01 0.00 -0.55 0.00 0.00 56.30 55.96 1run h ASN 149 Cb 0.12 0.65 -0.00 0.00 0.05 0.00 0.00 38.32 39.14 1run h ASN 149 CO 0.00 -0.46 0.03 -0.07 -1.65 0.00 0.00 177.43 175.28 1run h LEU 150 N -0.52 0.00 -0.86 1.61 3.38 -0.69 1.01 115.31 119.23 1run h LEU 150 Ca 0.06 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.94 1run h LEU 150 Cb 0.66 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.39 1run h LEU 150 CO -0.46 0.00 -0.14 0.00 0.09 0.00 0.00 178.44 177.94 1run h ALA 151 N 1.97 1.04 -0.19 1.53 0.00 0.17 -2.30 119.26 121.49 1run h ALA 151 Ca 0.01 -0.32 -0.13 0.00 0.00 0.00 0.00 54.91 54.47 1run h ALA 151 Cb 0.06 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1run h ALA 151 CO -0.00 0.58 -0.45 0.87 0.00 0.00 0.00 179.25 180.25 1run h LYS 152 N 0.63 0.46 -6.55 0.00 1.57 0.15 -3.44 116.57 109.39 1run h LYS 152 Ca 0.11 -0.25 -0.59 0.00 -1.87 0.00 0.00 60.65 58.05 1run h LYS 152 Cb 0.59 0.01 0.08 0.00 0.08 0.00 0.00 32.23 32.99 1run h LYS 152 CO 0.04 0.82 0.56 0.94 -0.57 0.00 0.00 179.45 181.24 1run n GLN 153 N -4.00 1.90 0.22 3.15 0.00 -0.46 -4.86 117.38 113.33 1run n GLN 153 Ca -0.02 0.67 0.18 0.00 -0.00 0.00 0.00 57.00 57.83 1run n GLN 153 Cb 0.53 -2.31 0.79 0.00 0.00 0.00 0.00 30.24 29.25 1run n GLN 153 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.06 175.71 1run h PRO 154 N 4.07 0.00 -0.98 3.69 0.11 -1.88 -1.86 132.00 135.16 1run h PRO 154 Ca -0.45 0.00 0.15 0.00 0.11 0.00 0.00 66.00 65.81 1run h PRO 154 Cb 1.29 0.00 -0.09 0.00 0.11 0.00 0.00 31.00 32.31 1run h PRO 154 CO 0.75 0.00 0.62 -0.44 -0.21 0.00 0.00 178.00 178.71 1run h ASP 155 N 0.00 0.81 -3.32 -2.05 3.32 -1.89 -3.45 116.42 109.85 1run h ASP 155 Ca 0.09 0.06 -0.57 0.00 0.02 0.00 0.00 57.03 56.63 1run h ASP 155 Cb 0.84 -0.09 0.13 0.00 0.22 0.00 0.00 39.33 40.42 1run h ASP 155 CO -0.00 0.38 0.34 0.00 -1.72 0.00 0.00 179.24 178.23 1run n ALA 156 N -2.37 0.76 -2.83 3.45 0.00 -0.70 -4.98 120.51 113.85 1run n ALA 156 Ca 0.20 0.24 -0.32 0.00 0.00 0.00 0.00 53.44 53.56 1run n ALA 156 Cb 0.46 -2.18 -0.15 0.00 0.00 0.00 0.00 19.45 17.58 1run n ALA 156 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1run s MET 157 N -2.14 2.82 0.66 0.00 -1.94 -0.57 -4.95 119.30 113.18 1run s MET 157 Ca 0.62 -0.80 -0.14 0.00 -1.71 0.00 0.00 55.69 53.66 1run s MET 157 Cb -0.53 -2.35 -0.00 0.00 2.01 0.00 0.00 34.83 33.96 1run s MET 157 CO 0.57 0.36 1.09 0.95 -0.01 0.00 0.00 175.02 177.98 1run s THR 158 N -0.09 3.52 -0.01 2.05 -4.23 -1.26 -0.47 115.64 115.15 1run s THR 158 Ca -0.04 0.65 0.00 0.00 -1.18 0.00 0.00 61.69 61.12 1run s THR 158 Cb -0.14 -3.19 0.01 0.00 1.34 0.00 0.00 72.50 70.52 1run s THR 158 CO 0.04 -0.49 0.01 -2.28 -0.54 0.00 0.00 174.62 171.36 1run s HIS 159 N -2.54 0.06 -0.98 3.99 5.04 -0.90 -4.75 115.29 115.20 1run s HIS 159 Ca 0.64 0.05 0.00 0.00 -1.54 0.00 0.00 55.06 54.21 1run s HIS 159 Cb -0.18 -0.15 0.00 0.00 0.04 0.00 0.00 32.58 32.30 1run s HIS 159 CO 0.44 -0.05 0.20 -0.35 -2.34 0.00 0.00 174.74 172.64 1run n PRO 160 N 3.63 0.00 -2.91 2.88 -0.04 -1.26 -2.16 135.00 135.14 1run n PRO 160 Ca -0.20 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.16 1run n PRO 160 Cb 0.55 -1.41 -0.01 0.00 -0.04 0.00 0.00 33.50 32.59 1run n PRO 160 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1run n ASP 161 N -0.65 -2.61 0.00 3.54 5.75 -1.26 -5.10 116.55 116.21 1run n ASP 161 Ca 0.00 -2.86 0.00 0.00 -0.01 0.00 0.00 54.79 51.92 1run n ASP 161 Cb 0.00 1.19 0.00 0.00 -1.03 0.00 0.00 41.12 41.28 1run n ASP 161 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1run n GLY 162 N 2.65 1.61 3.69 6.12 0.00 -0.92 -4.37 105.19 113.98 1run n GLY 162 Ca 0.19 -1.83 -0.42 0.00 0.00 0.00 0.00 46.02 43.96 1run n GLY 162 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1run s MET 163 N -3.07 4.29 0.12 1.61 -1.94 -1.17 -2.12 119.30 117.02 1run s MET 163 Ca 0.00 1.94 -0.07 0.00 -1.71 0.00 0.00 55.69 55.85 1run s MET 163 Cb 0.00 -3.56 -0.06 0.00 2.01 0.00 0.00 34.83 33.23 1run s MET 163 CO 0.00 -0.55 0.40 -1.14 -0.01 0.00 0.00 175.02 173.72 1run s GLN 164 N 2.32 3.69 -0.07 2.03 0.74 0.38 -3.12 119.66 125.63 1run s GLN 164 Ca 0.63 0.06 -0.10 0.00 0.05 0.00 0.00 55.36 56.00 1run s GLN 164 Cb -0.31 -2.89 0.02 0.00 1.10 0.00 0.00 33.01 30.93 1run s GLN 164 CO 0.26 0.49 0.25 0.96 -0.55 0.00 0.00 175.29 176.70 1run s ILE 165 N -1.56 0.02 -0.56 -2.34 -4.36 -0.37 -1.51 121.20 110.53 1run s ILE 165 Ca 0.38 -0.21 0.04 0.00 -0.26 0.00 0.00 60.65 60.61 1run s ILE 165 Cb -0.13 -0.43 0.14 0.00 1.25 0.00 0.00 42.46 43.30 1run s ILE 165 CO 0.21 -0.11 0.31 -0.54 0.24 0.00 0.00 174.94 175.05 1run s LYS 166 N -0.40 2.08 0.00 0.37 1.02 -1.26 0.06 119.74 121.61 1run s LYS 166 Ca -0.05 -2.78 0.00 0.00 0.02 0.00 0.00 55.97 53.16 1run s LYS 166 Cb -0.03 -3.34 0.00 0.00 -0.52 0.00 0.00 37.83 33.94 1run s LYS 166 CO 0.01 -1.15 0.00 1.51 -0.92 0.00 0.00 175.35 174.80 1run n ILE 167 N 2.86 0.00 -3.98 2.17 3.06 -1.24 -5.00 119.36 117.23 1run n ILE 167 Ca 0.08 0.00 -0.08 0.00 -2.50 0.00 0.00 62.75 60.25 1run n ILE 167 Cb 0.33 0.00 -0.09 0.00 0.54 0.00 0.00 39.64 40.42 1run n ILE 167 CO 0.00 0.00 0.00 0.28 -2.50 0.00 0.00 176.55 174.33 1run s THR 168 N -0.77 0.18 0.26 9.51 -1.32 -1.26 -4.80 115.64 117.45 1run s THR 168 Ca 0.00 -1.49 -0.04 0.00 -1.21 0.00 0.00 61.69 58.95 1run s THR 168 Cb 0.00 -1.39 0.20 0.00 -1.51 0.00 0.00 72.50 69.80 1run s THR 168 CO 0.00 -0.82 1.87 0.03 -2.21 0.00 0.00 174.62 173.49 1run h ARG 169 N 3.02 1.09 -0.20 7.08 2.47 -1.96 -1.01 114.38 124.88 1run h ARG 169 Ca -0.34 -0.14 0.04 0.00 -1.26 0.00 0.00 59.98 58.28 1run h ARG 169 Cb 1.17 -0.21 -0.04 0.00 -1.65 0.00 0.00 29.97 29.25 1run h ARG 169 CO 0.61 0.82 -0.03 0.37 0.56 0.00 0.00 179.97 182.30 1run h GLN 170 N 1.09 0.02 -0.61 0.04 4.15 -1.96 0.17 115.11 118.01 1run h GLN 170 Ca 0.27 -0.00 -0.07 0.00 0.77 0.00 0.00 58.65 59.62 1run h GLN 170 Cb 0.07 -0.00 -0.03 0.00 0.21 0.00 0.00 27.48 27.73 1run h GLN 170 CO -0.04 0.01 0.09 0.93 -1.93 0.00 0.00 178.83 177.90 1run h GLU 171 N 0.02 0.99 -0.30 1.69 5.08 -1.64 -2.60 114.58 117.82 1run h GLU 171 Ca 0.09 -0.25 -0.03 0.00 -1.00 0.00 0.00 59.36 58.17 1run h GLU 171 Cb 0.14 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 1run h GLU 171 CO -0.19 0.92 0.07 0.82 -1.00 0.00 0.00 179.01 179.63 1run h ILE 172 N 0.93 1.22 -0.47 3.13 2.04 0.17 -1.58 117.51 122.95 1run h ILE 172 Ca 0.19 -0.73 0.14 0.00 1.00 0.00 0.00 64.86 65.45 1run h ILE 172 Cb 0.41 1.12 -0.02 0.00 -0.74 0.00 0.00 36.82 37.60 1run h ILE 172 CO 0.01 0.24 0.34 1.23 0.00 0.00 0.00 178.15 179.97 1run h GLY 173 N 0.33 0.01 1.71 5.37 0.00 -0.53 -0.17 103.07 109.79 1run h GLY 173 Ca 0.09 -0.00 -0.18 0.00 0.00 0.00 0.00 47.33 47.24 1run h GLY 173 CO 0.00 0.00 -0.78 -1.61 0.00 0.00 0.00 176.54 174.15 1run h GLN 174 N 0.01 0.28 0.16 4.80 4.15 -0.94 0.46 115.11 124.02 1run h GLN 174 Ca 0.22 -0.25 -0.32 0.00 0.77 0.00 0.00 58.65 59.07 1run h GLN 174 Cb 0.89 0.06 0.00 0.00 0.21 0.00 0.00 27.48 28.65 1run h GLN 174 CO -0.00 0.93 -1.58 0.82 -1.93 0.00 0.00 178.83 177.07 1run h ILE 175 N 0.18 1.12 0.00 2.39 2.04 -0.42 -2.16 117.51 120.67 1run h ILE 175 Ca -0.04 -2.71 -0.02 0.00 1.00 0.00 0.00 64.86 63.09 1run h ILE 175 Cb 1.37 2.81 -0.00 0.00 -0.74 0.00 0.00 36.82 40.25 1run h ILE 175 CO 0.12 0.83 -0.18 0.58 0.00 0.00 0.00 178.15 179.51 1run h VAL 176 N 0.09 0.14 -4.24 1.67 2.07 -1.08 -3.46 116.25 111.43 1run h VAL 176 Ca -0.27 -1.20 -0.09 0.00 0.82 0.00 0.00 66.70 65.96 1run h VAL 176 Cb 2.06 2.02 0.07 0.00 -1.52 0.00 0.00 31.29 33.92 1run h VAL 176 CO 0.18 0.08 -0.30 0.61 0.02 0.00 0.00 177.57 178.17 1run n GLY 177 N 1.13 -0.35 3.58 2.17 0.00 0.14 -4.96 105.19 106.90 1run n GLY 177 Ca 0.03 0.16 -0.10 0.00 0.00 0.00 0.00 46.02 46.11 1run n GLY 177 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1run n SER 179 N 0.82 3.57 0.00 0.00 3.41 -1.26 -4.39 113.62 115.76 1run n SER 179 Ca -0.10 1.08 0.00 0.00 -0.26 0.00 0.00 58.87 59.60 1run n SER 179 Cb 0.58 -1.51 0.00 0.00 -0.26 0.00 0.00 64.21 63.01 1run n SER 179 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 1run n ARG 180 N 3.41 0.00 0.02 4.33 -4.01 -1.26 -0.74 116.66 118.40 1run n ARG 180 Ca 0.15 0.19 -0.12 0.00 -1.04 0.00 0.00 57.85 57.03 1run n ARG 180 Cb 0.33 -1.61 -0.09 0.00 -3.04 0.00 0.00 32.46 28.04 1run n ARG 180 CO 0.00 0.00 0.00 0.93 -3.04 0.00 0.00 177.63 175.52 1run h GLU 181 N 0.00 -0.11 -0.07 2.89 4.39 -1.96 -1.89 114.58 117.83 1run h GLU 181 Ca 0.00 0.01 0.02 0.00 0.34 0.00 0.00 59.36 59.73 1run h GLU 181 Cb 0.22 0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 28.89 1run h GLU 181 CO 0.00 0.41 0.07 1.15 -1.16 0.00 0.00 179.01 179.48 1run h THR 182 N -0.75 0.70 0.08 1.13 2.02 -1.29 0.33 112.91 115.14 1run h THR 182 Ca -0.01 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.16 1run h THR 182 Cb 0.58 0.95 0.00 0.00 -1.74 0.00 0.00 68.15 67.94 1run h THR 182 CO 0.02 0.00 -0.04 0.58 0.37 0.00 0.00 175.52 176.45 1run h VAL 183 N 0.00 1.15 -0.42 3.16 2.07 -1.61 -1.35 116.25 119.25 1run h VAL 183 Ca 0.04 -0.87 0.08 0.00 0.82 0.00 0.00 66.70 66.77 1run h VAL 183 Cb 0.17 1.70 -0.09 0.00 -1.52 0.00 0.00 31.29 31.55 1run h VAL 183 CO -0.00 0.21 -0.28 1.23 0.02 0.00 0.00 177.57 178.75 1run h GLY 184 N -0.50 -0.12 1.99 2.17 0.00 0.43 0.41 103.07 107.44 1run h GLY 184 Ca -0.01 0.36 -0.11 0.00 0.00 0.00 0.00 47.33 47.58 1run h GLY 184 CO 0.02 -0.21 -0.50 0.07 0.00 0.00 0.00 176.54 175.92 1run h ARG 185 N -0.21 0.01 0.24 4.80 0.11 -1.06 -2.58 114.38 115.69 1run h ARG 185 Ca 0.19 -0.01 -0.33 0.00 0.10 0.00 0.00 59.98 59.93 1run h ARG 185 Cb 0.51 0.00 0.04 0.00 1.11 0.00 0.00 29.97 31.63 1run h ARG 185 CO -0.54 0.51 -1.45 0.82 0.10 0.00 0.00 179.97 179.41 1run h ILE 186 N 0.01 1.29 0.00 0.08 2.04 -0.46 -1.73 117.51 118.73 1run h ILE 186 Ca -0.00 -2.67 -0.01 0.00 1.00 0.00 0.00 64.86 63.17 1run h ILE 186 Cb 0.89 3.02 -0.00 0.00 -0.74 0.00 0.00 36.82 39.98 1run h ILE 186 CO 0.07 0.80 -0.06 0.25 0.00 0.00 0.00 178.15 179.20 1run h LEU 187 N 0.15 0.00 0.14 1.44 5.85 -0.95 0.37 115.31 122.31 1run h LEU 187 Ca -0.25 0.00 -0.26 0.00 0.84 0.00 0.00 57.88 58.21 1run h LEU 187 Cb 2.14 0.00 0.03 0.00 0.37 0.00 0.00 40.66 43.20 1run h LEU 187 CO 0.27 0.06 -1.09 0.50 -0.34 0.00 0.00 178.44 177.85 1run h LYS 188 N 0.00 0.48 0.31 1.25 3.64 -1.37 -3.25 116.57 117.63 1run h LYS 188 Ca -0.00 -0.71 -0.01 0.00 -1.27 0.00 0.00 60.65 58.66 1run h LYS 188 Cb 0.29 0.25 -0.00 0.00 -0.41 0.00 0.00 32.23 32.36 1run h LYS 188 CO 0.01 1.32 -0.17 1.98 -2.27 0.00 0.00 179.45 180.32 1run h MET 189 N 0.00 -0.43 0.00 1.90 4.05 0.51 -1.34 114.93 119.63 1run h MET 189 Ca -0.18 0.03 0.00 0.00 -0.28 0.00 0.00 59.70 59.27 1run h MET 189 Cb 1.81 0.10 0.00 0.00 -0.80 0.00 0.00 31.60 32.71 1run h MET 189 CO 0.21 -0.28 0.00 1.28 0.23 0.00 0.00 176.91 178.34 1run n LEU 190 N -5.29 0.00 0.01 3.39 4.77 0.54 -1.80 117.00 118.62 1run n LEU 190 Ca -0.10 0.28 -0.21 0.00 -0.03 0.00 0.00 56.01 55.95 1run n LEU 190 Cb 0.20 -0.28 -0.14 0.00 -2.33 0.00 0.00 43.42 40.87 1run n LEU 190 CO 0.35 -0.15 -0.80 1.21 -1.33 0.00 0.00 177.39 176.66 1run n GLU 191 N -1.28 0.76 -0.82 3.23 2.13 -0.60 -1.88 120.64 122.18 1run n GLU 191 Ca 0.07 0.26 -0.08 0.00 0.66 0.00 0.00 57.16 58.07 1run n GLU 191 Cb 0.11 -1.71 -0.08 0.00 0.27 0.00 0.00 31.44 30.03 1run n GLU 191 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 1run n ASP 192 N -3.47 5.46 0.00 4.31 10.43 -0.66 -1.65 116.55 130.97 1run n ASP 192 Ca -0.31 -2.55 0.00 0.00 2.57 0.00 0.00 54.79 54.50 1run n ASP 192 Cb 1.05 -1.26 0.00 0.00 1.84 0.00 0.00 41.12 42.75 1run n ASP 192 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1run n GLN 193 N 1.81 0.98 -0.93 -1.24 6.02 -1.25 -5.03 117.38 117.73 1run n GLN 193 Ca 0.24 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.23 1run n GLN 193 Cb 0.69 -0.08 0.00 0.00 1.02 0.00 0.00 30.24 31.87 1run n GLN 193 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1run n ASN 194 N 0.00 -2.80 0.18 1.08 3.02 -0.66 -4.94 115.26 111.14 1run n ASN 194 Ca 0.00 0.00 0.06 0.00 -0.03 0.00 0.00 54.58 54.61 1run n ASN 194 Cb 0.00 -0.47 0.25 0.00 -0.61 0.00 0.00 39.78 38.96 1run n ASN 194 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1run h LEU 195 N 0.00 0.00 -7.84 3.41 3.38 -1.67 -3.46 115.31 109.13 1run h LEU 195 Ca 0.00 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.68 1run h LEU 195 Cb 0.00 0.00 -0.28 0.00 0.09 0.00 0.00 40.66 40.47 1run h LEU 195 CO 0.00 0.35 -0.74 -0.63 0.09 0.00 0.00 178.44 177.51 1run s ILE 196 N -3.35 0.27 -0.16 1.22 1.01 -0.79 -2.63 121.20 116.76 1run s ILE 196 Ca 0.02 -0.14 -0.03 0.00 0.00 0.00 0.00 60.65 60.50 1run s ILE 196 Cb 0.09 -0.23 -0.02 0.00 0.01 0.00 0.00 42.46 42.31 1run s ILE 196 CO 0.69 0.08 -0.06 -0.44 0.00 0.00 0.00 174.94 175.20 1run s SER 197 N -0.06 4.49 -0.24 3.58 0.01 -0.70 -4.41 113.70 116.36 1run s SER 197 Ca 0.01 -0.24 -0.02 0.00 1.31 0.00 0.00 55.95 57.01 1run s SER 197 Cb -0.01 -1.73 0.12 0.00 0.21 0.00 0.00 66.02 64.60 1run s SER 197 CO -0.00 0.13 0.29 0.00 0.41 0.00 0.00 173.24 174.07 1run s ALA 198 N 0.60 -0.60 -0.45 1.44 0.00 -1.26 -1.34 121.76 120.15 1run s ALA 198 Ca -0.04 0.31 0.03 0.00 0.00 0.00 0.00 51.96 52.26 1run s ALA 198 Cb -0.15 -1.58 0.16 0.00 0.00 0.00 0.00 23.12 21.56 1run s ALA 198 CO 0.03 -1.37 0.34 -1.58 0.00 0.00 0.00 175.76 173.17 1run s HIS 199 N 2.41 1.45 0.00 0.00 5.65 -1.26 -4.95 115.29 118.59 1run s HIS 199 Ca 0.09 -2.38 0.00 0.00 0.25 0.00 0.00 55.06 53.02 1run s HIS 199 Cb -0.15 -1.23 0.00 0.00 -1.18 0.00 0.00 32.58 30.02 1run s HIS 199 CO -0.19 -0.79 0.00 0.41 -0.65 0.00 0.00 174.74 173.52 1run n GLY 200 N 2.93 0.63 3.64 1.59 0.00 -1.26 -4.63 105.19 108.08 1run n GLY 200 Ca 0.25 -0.01 -0.43 0.00 0.00 0.00 0.00 46.02 45.83 1run n GLY 200 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1run s LYS 201 N 0.00 4.10 0.08 1.61 2.36 -1.26 -3.73 119.74 122.90 1run s LYS 201 Ca 0.00 1.10 0.04 0.00 -2.55 0.00 0.00 55.97 54.56 1run s LYS 201 Cb 0.00 -3.72 -0.04 0.00 -1.05 0.00 0.00 37.83 33.02 1run s LYS 201 CO 0.00 -0.83 0.02 0.99 1.55 0.00 0.00 175.35 177.08 1run s THR 202 N 3.51 4.13 -0.14 3.43 2.01 0.11 -4.58 115.64 124.12 1run s THR 202 Ca 0.44 -0.91 -0.03 0.00 0.31 0.00 0.00 61.69 61.50 1run s THR 202 Cb -0.13 -2.96 0.05 0.00 0.01 0.00 0.00 72.50 69.46 1run s THR 202 CO 0.13 0.14 0.04 -0.63 -0.69 0.00 0.00 174.62 173.62 1run s ILE 203 N -1.31 0.26 -0.34 1.82 1.09 -0.45 -1.24 121.20 121.03 1run s ILE 203 Ca 0.26 -0.16 -0.18 0.00 -1.10 0.00 0.00 60.65 59.47 1run s ILE 203 Cb -0.12 -0.68 -0.01 0.00 -1.06 0.00 0.00 42.46 40.60 1run s ILE 203 CO 0.18 -0.05 0.50 0.54 -0.10 0.00 0.00 174.94 176.01 1run s VAL 204 N 2.00 5.04 -0.38 2.92 0.11 -1.18 -1.72 120.40 127.18 1run s VAL 204 Ca 0.02 0.39 -0.15 0.00 -2.93 0.00 0.00 61.98 59.31 1run s VAL 204 Cb -0.15 -3.93 0.00 0.00 -1.53 0.00 0.00 36.38 30.77 1run s VAL 204 CO -0.07 -0.16 0.35 0.54 -3.33 0.00 0.00 175.10 172.43 1run s VAL 205 N 2.35 5.18 -0.41 2.04 0.11 -1.08 -3.05 120.40 125.55 1run s VAL 205 Ca 0.18 -0.27 0.11 0.00 -2.93 0.00 0.00 61.98 59.07 1run s VAL 205 Cb -0.16 -3.89 0.29 0.00 -1.53 0.00 0.00 36.38 31.09 1run s VAL 205 CO 0.13 -0.23 1.22 0.00 -3.33 0.00 0.00 175.10 172.89 1run n TYR 206 N 5.35 0.41 0.00 1.54 0.18 -1.26 -4.83 117.16 118.54 1run n TYR 206 Ca -0.10 -0.66 0.00 0.00 1.88 0.00 0.00 57.90 59.02 1run n TYR 206 Cb 0.48 -0.12 0.00 0.00 -0.38 0.00 0.00 39.34 39.32 1run n TYR 206 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 1run n GLY 207 N -0.25 1.54 0.00 -7.48 0.00 -1.26 -4.73 105.19 93.02 1run n GLY 207 Ca 0.12 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.72 1run n GLY 207 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1run n THR 208 N 0.00 0.00 -0.74 2.61 -2.24 -1.26 -3.94 114.28 108.71 1run n THR 208 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1run n THR 208 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 1run n THR 208 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04