#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x5f n SER 2 N 0.00 -3.54 -4.24 1.61 3.41 -1.26 -4.88 113.62 104.72 1x5f n SER 2 Ca 0.00 -0.98 -0.34 0.00 -0.26 0.00 0.00 58.87 57.29 1x5f n SER 2 Cb 0.00 -2.90 0.14 0.00 -0.26 0.00 0.00 64.21 61.18 1x5f n SER 2 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1x5f n SER 3 N -2.67 -2.59 -0.66 4.04 2.88 -1.26 -5.03 113.62 108.33 1x5f n SER 3 Ca 0.08 -0.02 0.00 0.00 -1.33 0.00 0.00 58.87 57.59 1x5f n SER 3 Cb 0.49 -0.92 0.00 0.00 -0.75 0.00 0.00 64.21 63.04 1x5f n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x5f n GLY 4 N 2.23 5.16 3.27 0.46 0.00 -1.26 -5.18 105.19 109.86 1x5f n GLY 4 Ca 0.01 -1.74 -0.09 0.00 0.00 0.00 0.00 46.02 44.19 1x5f n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1x5f s SER 5 N 0.04 0.00 0.29 1.61 0.15 -1.26 -5.18 113.70 109.34 1x5f s SER 5 Ca 0.00 -0.60 -0.09 0.00 0.70 0.00 0.00 55.95 55.96 1x5f s SER 5 Cb 0.00 0.40 0.00 0.00 -1.71 0.00 0.00 66.02 64.71 1x5f s SER 5 CO 0.00 -0.80 0.49 -0.94 1.20 0.00 0.00 173.24 173.19 1x5f s SER 6 N -2.87 0.24 -0.21 5.45 1.04 -1.26 -5.06 113.70 111.03 1x5f s SER 6 Ca 0.07 -1.14 -0.08 0.00 0.48 0.00 0.00 55.95 55.28 1x5f s SER 6 Cb 0.04 0.63 -0.10 0.00 0.10 0.00 0.00 66.02 66.68 1x5f s SER 6 CO -0.09 -1.23 -0.25 0.61 0.98 0.00 0.00 173.24 173.25 1x5f n GLY 7 N -0.45 -0.33 2.40 7.32 0.00 -1.26 -4.75 105.19 108.12 1x5f n GLY 7 Ca -0.01 -0.12 -0.17 0.00 0.00 0.00 0.00 46.02 45.72 1x5f n GLY 7 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1x5f n GLU 8 N -3.74 2.82 -2.85 1.61 4.71 -1.26 -4.93 120.64 116.99 1x5f n GLU 8 Ca -0.41 -3.98 -0.18 0.00 -0.01 0.00 0.00 57.16 52.58 1x5f n GLU 8 Cb 0.83 -1.98 0.00 0.00 -1.01 0.00 0.00 31.44 29.27 1x5f n GLU 8 CO 0.00 0.00 0.00 1.58 0.09 0.00 0.00 177.13 178.80 1x5f n HIS 9 N -0.54 -1.61 -1.22 -0.32 -0.00 -1.26 -4.83 115.22 105.43 1x5f n HIS 9 Ca 0.30 0.24 -0.41 0.00 -0.00 0.00 0.00 57.72 57.85 1x5f n HIS 9 Cb 0.84 -3.11 -0.01 0.00 -0.00 0.00 0.00 29.99 27.70 1x5f n HIS 9 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1x5f n ALA 10 N -2.87 -2.79 -1.61 1.57 0.00 -1.26 -4.88 120.51 108.67 1x5f n ALA 10 Ca -0.10 0.24 -0.34 0.00 0.00 0.00 0.00 53.44 53.24 1x5f n ALA 10 Cb 0.59 -1.40 0.03 0.00 0.00 0.00 0.00 19.45 18.67 1x5f n ALA 10 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1x5f s PRO 11 N -0.91 3.01 0.01 0.00 0.04 -1.26 -5.07 135.00 130.82 1x5f s PRO 11 Ca 0.56 1.48 0.00 0.00 0.04 0.00 0.00 61.00 63.07 1x5f s PRO 11 Cb -0.70 -1.97 -0.01 0.00 0.04 0.00 0.00 34.50 31.86 1x5f s PRO 11 CO 0.54 -1.10 -0.01 0.00 0.04 0.00 0.00 177.00 176.47 1x5f s ALA 12 N -2.12 0.05 -0.08 8.56 0.00 -1.26 -5.12 121.76 121.79 1x5f s ALA 12 Ca 0.69 -0.24 -0.30 0.00 0.00 0.00 0.00 51.96 52.11 1x5f s ALA 12 Cb -0.22 0.06 -0.04 0.00 0.00 0.00 0.00 23.12 22.92 1x5f s ALA 12 CO 0.36 -0.06 1.41 0.95 0.00 0.00 0.00 175.76 178.42 1x5f s THR 13 N -0.59 3.90 -0.02 0.00 -4.23 -1.26 -5.00 115.64 108.44 1x5f s THR 13 Ca -0.07 1.17 -0.14 0.00 -1.18 0.00 0.00 61.69 61.47 1x5f s THR 13 Cb -0.04 -3.75 0.02 0.00 1.34 0.00 0.00 72.50 70.07 1x5f s THR 13 CO -0.00 -0.07 0.29 0.28 -0.54 0.00 0.00 174.62 174.58 1x5f s THR 14 N 3.23 0.06 0.00 3.99 -1.32 -1.26 -5.17 115.64 115.16 1x5f s THR 14 Ca 0.63 -0.47 0.00 0.00 -1.21 0.00 0.00 61.69 60.63 1x5f s THR 14 Cb -0.28 -0.58 0.00 0.00 -1.51 0.00 0.00 72.50 70.12 1x5f s THR 14 CO 0.23 -0.26 0.00 0.61 -2.21 0.00 0.00 174.62 172.99 1x5f n GLY 15 N 1.38 -2.08 3.77 6.08 0.00 -1.26 -5.01 105.19 108.06 1x5f n GLY 15 Ca -0.21 -1.47 -0.32 0.00 0.00 0.00 0.00 46.02 44.02 1x5f n GLY 15 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x5f s PRO 16 N -1.71 2.45 0.15 1.61 0.04 -1.26 -5.07 135.00 131.21 1x5f s PRO 16 Ca 0.00 1.25 0.10 0.00 0.04 0.00 0.00 61.00 62.39 1x5f s PRO 16 Cb 0.00 -1.92 -0.04 0.00 0.04 0.00 0.00 34.50 32.58 1x5f s PRO 16 CO 0.00 -1.50 -0.23 -0.51 0.04 0.00 0.00 177.00 174.79 1x5f s LEU 17 N -5.54 2.37 0.00 -3.56 1.43 -1.26 -4.94 118.68 107.18 1x5f s LEU 17 Ca 0.63 -0.78 0.00 0.00 -1.03 0.00 0.00 54.13 52.95 1x5f s LEU 17 Cb -0.18 -1.06 0.00 0.00 0.03 0.00 0.00 46.19 44.98 1x5f s LEU 17 CO 0.51 0.10 0.00 -0.81 0.23 0.00 0.00 176.35 176.37 1x5f n PRO 18 N 0.68 -0.17 -4.24 1.29 -0.04 -1.26 -4.96 135.00 126.30 1x5f n PRO 18 Ca -0.16 0.00 -0.19 0.00 -0.04 0.00 0.00 63.50 63.11 1x5f n PRO 18 Cb 0.55 0.00 -0.16 0.00 -0.04 0.00 0.00 33.50 33.85 1x5f n PRO 18 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1x5f s SER 19 N -1.51 0.94 0.73 3.54 0.01 -1.26 -3.84 113.70 112.31 1x5f s SER 19 Ca 0.00 -0.14 -0.17 0.00 1.31 0.00 0.00 55.95 56.95 1x5f s SER 19 Cb 0.00 -0.32 -0.15 0.00 0.21 0.00 0.00 66.02 65.76 1x5f s SER 19 CO 0.00 0.01 -0.45 0.00 0.41 0.00 0.00 173.24 173.21 1x5f n ALA 20 N 3.55 -4.23 -1.17 1.44 0.00 -1.02 -4.57 120.51 114.52 1x5f n ALA 20 Ca -0.20 -0.35 -0.29 0.00 0.00 0.00 0.00 53.44 52.60 1x5f n ALA 20 Cb 0.53 -1.25 0.18 0.00 0.00 0.00 0.00 19.45 18.92 1x5f n ALA 20 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1x5f s PRO 21 N -1.46 0.35 0.53 0.00 0.04 -1.26 -4.54 135.00 128.65 1x5f s PRO 21 Ca 0.47 0.49 0.02 0.00 0.04 0.00 0.00 61.00 62.03 1x5f s PRO 21 Cb -0.33 -1.73 0.01 0.00 0.04 0.00 0.00 34.50 32.49 1x5f s PRO 21 CO 0.73 -2.78 0.15 1.03 0.04 0.00 0.00 177.00 176.17 1x5f s ARG 22 N -4.97 2.22 -1.47 4.56 1.81 -1.19 -4.72 118.95 115.19 1x5f s ARG 22 Ca 0.65 -2.28 -0.12 0.00 -1.72 0.00 0.00 55.73 52.26 1x5f s ARG 22 Cb -0.19 -1.74 0.09 0.00 -0.45 0.00 0.00 34.95 32.67 1x5f s ARG 22 CO 0.58 -0.48 0.73 -3.47 -0.68 0.00 0.00 175.30 171.98 1x5f n ASP 23 N -1.47 -4.23 -4.57 0.23 2.03 -1.26 -0.25 116.55 107.04 1x5f n ASP 23 Ca -0.13 -0.63 -0.40 0.00 0.52 0.00 0.00 54.79 54.15 1x5f n ASP 23 Cb 0.66 -3.43 -0.03 0.00 -0.72 0.00 0.00 41.12 37.60 1x5f n ASP 23 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1x5f s VAL 24 N -3.14 3.42 0.16 5.18 1.01 -1.26 -4.04 120.40 121.73 1x5f s VAL 24 Ca 0.55 0.32 -0.01 0.00 0.00 0.00 0.00 61.98 62.83 1x5f s VAL 24 Cb -0.28 -3.87 -0.04 0.00 0.00 0.00 0.00 36.38 32.19 1x5f s VAL 24 CO 0.68 -0.76 0.10 0.68 0.00 0.00 0.00 175.10 175.80 1x5f s VAL 25 N 8.34 0.06 -0.45 2.92 -7.23 -0.40 -4.99 120.40 118.65 1x5f s VAL 25 Ca 0.70 -1.92 -0.13 0.00 -1.81 0.00 0.00 61.98 58.82 1x5f s VAL 25 Cb -0.15 -2.22 0.07 0.00 0.56 0.00 0.00 36.38 34.65 1x5f s VAL 25 CO 0.25 -0.27 0.34 0.00 -0.31 0.00 0.00 175.10 175.11 1x5f s ALA 26 N -4.09 3.46 0.47 1.32 0.00 -1.26 0.41 121.76 122.07 1x5f s ALA 26 Ca 0.30 -2.11 0.17 0.00 0.00 0.00 0.00 51.96 50.32 1x5f s ALA 26 Cb 0.07 -2.91 1.16 0.00 0.00 0.00 0.00 23.12 21.43 1x5f s ALA 26 CO 0.06 -1.69 2.00 1.03 0.00 0.00 0.00 175.76 177.15 1x5f h SER 27 N 8.63 0.23 -5.01 0.00 0.87 -1.14 -3.43 113.55 113.69 1x5f h SER 27 Ca -0.26 0.01 -0.08 0.00 -1.23 0.00 0.00 61.79 60.22 1x5f h SER 27 Cb 1.10 -0.04 -0.18 0.00 -0.44 0.00 0.00 62.40 62.84 1x5f h SER 27 CO 0.83 0.14 -0.02 -0.22 -0.53 0.00 0.00 176.83 177.03 1x5f s LEU 28 N -9.15 0.06 -0.31 2.23 0.20 -1.06 -4.98 118.68 105.66 1x5f s LEU 28 Ca -0.07 0.29 0.01 0.00 0.69 0.00 0.00 54.13 55.06 1x5f s LEU 28 Cb 0.19 1.97 0.09 0.00 -0.43 0.00 0.00 46.19 48.02 1x5f s LEU 28 CO 0.74 -0.61 0.06 -0.69 -0.29 0.00 0.00 176.35 175.56 1x5f s VAL 29 N -1.77 1.56 0.58 1.68 1.01 -1.26 0.10 120.40 122.30 1x5f s VAL 29 Ca -0.09 -1.79 -0.05 0.00 0.00 0.00 0.00 61.98 60.05 1x5f s VAL 29 Cb -0.02 -2.13 0.01 0.00 0.00 0.00 0.00 36.38 34.25 1x5f s VAL 29 CO 0.03 -0.57 0.88 -0.55 0.00 0.00 0.00 175.10 174.89 1x5f s SER 30 N 1.28 5.62 0.43 3.32 0.15 0.23 -4.61 113.70 120.11 1x5f s SER 30 Ca 0.08 0.67 0.24 0.00 0.70 0.00 0.00 55.95 57.64 1x5f s SER 30 Cb -0.18 -1.69 0.61 0.00 -1.71 0.00 0.00 66.02 63.05 1x5f s SER 30 CO -0.15 -1.02 1.70 0.71 1.20 0.00 0.00 173.24 175.67 1x5f h THR 31 N -0.11 0.31 -0.00 6.45 1.35 -1.96 -3.23 112.91 115.72 1x5f h THR 31 Ca -0.45 -1.20 0.00 0.00 -0.55 0.00 0.00 66.41 64.21 1x5f h THR 31 Cb 1.26 1.95 0.00 0.00 -1.73 0.00 0.00 68.15 69.62 1x5f h THR 31 CO 0.60 0.16 -0.03 0.54 -0.25 0.00 0.00 175.52 176.54 1x5f n ARG 32 N -3.19 1.36 -3.81 4.72 1.74 -1.26 -1.96 116.66 114.26 1x5f n ARG 32 Ca 0.02 -0.46 -0.08 0.00 -0.77 0.00 0.00 57.85 56.56 1x5f n ARG 32 Cb 0.51 -0.92 0.03 0.00 -1.02 0.00 0.00 32.46 31.06 1x5f n ARG 32 CO 0.00 0.00 0.00 1.97 -1.52 0.00 0.00 177.63 178.08 1x5f n PHE 33 N -0.20 -2.23 -3.69 -1.55 1.16 -1.22 -0.55 117.46 109.18 1x5f n PHE 33 Ca 0.01 -1.78 -0.11 0.00 -1.87 0.00 0.00 57.45 53.70 1x5f n PHE 33 Cb 0.06 0.89 -0.11 0.00 -1.61 0.00 0.00 39.48 38.70 1x5f n PHE 33 CO 0.00 0.00 0.00 0.42 -1.87 0.00 0.00 176.76 175.31 1x5f s ILE 34 N -2.09 -0.20 -0.11 1.97 1.01 -1.02 0.75 121.20 121.51 1x5f s ILE 34 Ca 0.17 0.15 -0.26 0.00 0.00 0.00 0.00 60.65 60.71 1x5f s ILE 34 Cb -0.05 -0.54 -0.02 0.00 0.01 0.00 0.00 42.46 41.86 1x5f s ILE 34 CO 0.11 0.06 0.84 -0.75 0.00 0.00 0.00 174.94 175.20 1x5f s LYS 35 N 1.73 4.38 0.16 2.79 2.47 0.28 -2.22 119.74 129.35 1x5f s LYS 35 Ca -0.07 1.08 0.06 0.00 -1.56 0.00 0.00 55.97 55.48 1x5f s LYS 35 Cb -0.10 -3.52 -0.04 0.00 -1.46 0.00 0.00 37.83 32.71 1x5f s LYS 35 CO -0.11 -0.19 0.08 -0.51 0.16 0.00 0.00 175.35 174.78 1x5f s LEU 36 N 1.63 3.61 -0.25 5.43 2.01 0.77 -0.65 118.68 131.23 1x5f s LEU 36 Ca 0.41 -0.23 -0.10 0.00 0.01 0.00 0.00 54.13 54.22 1x5f s LEU 36 Cb -0.18 -2.24 0.10 0.00 0.01 0.00 0.00 46.19 43.88 1x5f s LEU 36 CO 0.17 0.08 0.56 0.42 1.01 0.00 0.00 176.35 178.59 1x5f s THR 37 N -1.72 -0.55 0.20 5.49 -4.23 0.16 -2.29 115.64 112.71 1x5f s THR 37 Ca 0.29 0.06 -0.01 0.00 -1.18 0.00 0.00 61.69 60.86 1x5f s THR 37 Cb -0.10 -0.85 -0.04 0.00 1.34 0.00 0.00 72.50 72.85 1x5f s THR 37 CO 0.21 0.02 0.12 -1.66 -0.54 0.00 0.00 174.62 172.78 1x5f s TRP 38 N 2.33 1.19 0.57 3.99 -2.14 -0.17 -1.28 118.94 123.44 1x5f s TRP 38 Ca -0.06 -1.35 0.08 0.00 2.66 0.00 0.00 56.10 57.43 1x5f s TRP 38 Cb -0.10 -0.60 0.07 0.00 -3.10 0.00 0.00 33.47 29.74 1x5f s TRP 38 CO -0.17 -0.60 0.64 -0.98 -2.66 0.00 0.00 176.95 173.19 1x5f s ARG 39 N -4.14 2.28 0.34 3.25 1.70 0.65 -4.70 118.95 118.33 1x5f s ARG 39 Ca 0.38 -1.80 -0.28 0.00 -0.47 0.00 0.00 55.73 53.56 1x5f s ARG 39 Cb 0.07 -2.43 -0.09 0.00 -0.57 0.00 0.00 34.95 31.93 1x5f s ARG 39 CO 0.12 -0.78 1.19 0.95 -1.08 0.00 0.00 175.30 175.70 1x5f s THR 40 N -2.72 3.12 0.72 4.99 -4.23 -1.26 -3.17 115.64 113.09 1x5f s THR 40 Ca 0.51 1.07 -0.13 0.00 -1.18 0.00 0.00 61.69 61.96 1x5f s THR 40 Cb -0.04 -3.66 0.03 0.00 1.34 0.00 0.00 72.50 70.17 1x5f s THR 40 CO 0.32 0.21 1.10 -2.16 -0.54 0.00 0.00 174.62 173.55 1x5f s PRO 41 N -1.84 2.53 0.28 3.99 0.04 -1.06 -4.30 135.00 134.64 1x5f s PRO 41 Ca 0.50 1.28 -0.02 0.00 0.04 0.00 0.00 61.00 62.81 1x5f s PRO 41 Cb -0.34 -1.92 0.44 0.00 0.04 0.00 0.00 34.50 32.71 1x5f s PRO 41 CO 0.44 -1.45 1.92 0.00 0.04 0.00 0.00 177.00 177.95 1x5f h ALA 42 N -0.54 1.43 -0.35 8.56 0.00 -1.80 -1.78 119.26 124.77 1x5f h ALA 42 Ca -0.45 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.33 1x5f h ALA 42 Cb 1.24 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 1x5f h ALA 42 CO 0.53 0.47 -0.17 0.66 0.00 0.00 0.00 179.25 180.74 1x5f h SER 43 N 1.14 0.64 -3.28 0.00 4.64 -1.92 -3.38 113.55 111.40 1x5f h SER 43 Ca 0.38 -0.20 -0.60 0.00 -0.47 0.00 0.00 61.79 60.90 1x5f h SER 43 Cb 0.06 -0.17 -0.40 0.00 -0.31 0.00 0.00 62.40 61.58 1x5f h SER 43 CO -0.12 0.82 -0.75 -1.81 -0.87 0.00 0.00 176.83 174.10 1x5f s ASP 44 N -6.75 4.14 0.04 4.97 1.11 -0.68 -4.97 116.67 114.54 1x5f s ASP 44 Ca -0.08 -1.81 0.16 0.00 0.18 0.00 0.00 52.55 50.99 1x5f s ASP 44 Cb 0.14 -1.02 0.67 0.00 1.07 0.00 0.00 42.92 43.78 1x5f s ASP 44 CO 0.81 -0.40 1.50 -0.81 1.18 0.00 0.00 175.17 177.45 1x5f n PRO 45 N 4.64 0.03 -0.02 8.23 -0.04 -1.16 -2.57 135.00 144.11 1x5f n PRO 45 Ca -0.00 0.28 -0.01 0.00 -0.04 0.00 0.00 63.50 63.74 1x5f n PRO 45 Cb 0.41 -1.56 -0.04 0.00 -0.04 0.00 0.00 33.50 32.27 1x5f n PRO 45 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 1x5f n HIS 46 N -1.62 0.00 -3.01 0.54 8.25 -1.26 -4.79 115.22 113.33 1x5f n HIS 46 Ca 0.03 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.29 1x5f n HIS 46 Cb 0.18 -0.22 -0.04 0.00 1.12 0.00 0.00 29.99 31.02 1x5f n HIS 46 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1x5f n GLY 47 N 2.47 -0.27 0.03 -1.41 0.00 -1.14 -4.68 105.19 100.20 1x5f n GLY 47 Ca -0.06 0.03 0.11 0.00 0.00 0.00 0.00 46.02 46.10 1x5f n GLY 47 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1x5f n ASP 48 N -1.17 0.49 -1.04 1.61 -0.08 -1.26 -3.83 116.55 111.28 1x5f n ASP 48 Ca 0.06 -0.20 0.08 0.00 -1.51 0.00 0.00 54.79 53.22 1x5f n ASP 48 Cb 0.29 1.19 0.25 0.00 2.34 0.00 0.00 41.12 45.19 1x5f n ASP 48 CO 0.00 0.00 0.00 -0.46 0.12 0.00 0.00 177.20 176.86 1x5f n ASN 49 N -2.07 3.64 -3.87 1.67 0.23 -1.26 -4.48 115.26 109.12 1x5f n ASN 49 Ca 0.00 -2.17 -0.17 0.00 -0.53 0.00 0.00 54.58 51.70 1x5f n ASN 49 Cb 0.48 -0.40 -0.16 0.00 -2.08 0.00 0.00 39.78 37.62 1x5f n ASN 49 CO 0.00 0.00 0.00 -1.48 -0.93 0.00 0.00 177.26 174.85 1x5f s LEU 50 N -1.32 1.44 0.71 -4.53 0.05 -1.26 -4.49 118.68 109.28 1x5f s LEU 50 Ca 0.37 -0.07 -0.11 0.00 0.05 0.00 0.00 54.13 54.37 1x5f s LEU 50 Cb 0.22 -0.28 0.02 0.00 -2.05 0.00 0.00 46.19 44.09 1x5f s LEU 50 CO 0.22 -0.05 1.08 -0.89 -0.55 0.00 0.00 176.35 176.16 1x5f s THR 51 N 0.69 3.72 -0.11 5.48 2.01 0.22 -3.60 115.64 124.04 1x5f s THR 51 Ca -0.08 0.56 0.03 0.00 0.31 0.00 0.00 61.69 62.51 1x5f s THR 51 Cb -0.11 -3.46 0.00 0.00 0.01 0.00 0.00 72.50 68.95 1x5f s THR 51 CO -0.01 -0.73 -0.22 -0.31 -0.69 0.00 0.00 174.62 172.66 1x5f s TYR 52 N -3.23 2.61 -0.11 4.92 2.02 -1.26 0.59 117.35 122.89 1x5f s TYR 52 Ca 0.58 -1.07 -0.01 0.00 -0.37 0.00 0.00 57.07 56.19 1x5f s TYR 52 Cb -0.12 -1.75 -0.03 0.00 -0.40 0.00 0.00 41.96 39.66 1x5f s TYR 52 CO 0.53 -0.44 -0.05 -1.12 -1.57 0.00 0.00 175.55 172.90 1x5f s SER 53 N 0.45 4.73 -0.20 2.29 0.01 0.78 -2.61 113.70 119.14 1x5f s SER 53 Ca -0.16 -0.07 -0.01 0.00 1.31 0.00 0.00 55.95 57.02 1x5f s SER 53 Cb -0.17 -1.50 0.01 0.00 0.21 0.00 0.00 66.02 64.57 1x5f s SER 53 CO 0.06 0.27 -0.13 -0.69 0.41 0.00 0.00 173.24 173.16 1x5f s VAL 54 N -0.23 2.58 -0.28 3.43 1.01 -1.14 -0.64 120.40 125.13 1x5f s VAL 54 Ca 0.04 -0.84 -0.08 0.00 0.00 0.00 0.00 61.98 61.09 1x5f s VAL 54 Cb -0.13 -2.17 -0.02 0.00 0.00 0.00 0.00 36.38 34.07 1x5f s VAL 54 CO 0.02 0.43 0.11 -0.36 0.00 0.00 0.00 175.10 175.31 1x5f s PHE 55 N 1.35 3.14 -0.05 5.22 0.40 0.09 -0.78 117.98 127.33 1x5f s PHE 55 Ca 0.04 -0.53 0.03 0.00 -0.60 0.00 0.00 56.93 55.87 1x5f s PHE 55 Cb -0.14 -2.30 -0.03 0.00 0.51 0.00 0.00 43.02 41.07 1x5f s PHE 55 CO -0.09 -0.42 -0.13 1.52 0.70 0.00 0.00 175.22 176.81 1x5f s TYR 56 N 1.61 2.75 -0.28 0.36 1.13 -0.86 -0.98 117.35 121.08 1x5f s TYR 56 Ca 0.05 -0.13 -0.15 0.00 -1.41 0.00 0.00 57.07 55.43 1x5f s TYR 56 Cb -0.16 -1.65 0.08 0.00 -1.10 0.00 0.00 41.96 39.13 1x5f s TYR 56 CO 0.05 0.21 0.67 -0.08 -2.51 0.00 0.00 175.55 173.89 1x5f s THR 57 N -0.73 -0.09 0.32 -3.49 -1.32 -1.08 -2.24 115.64 107.01 1x5f s THR 57 Ca 0.11 0.01 -0.27 0.00 -1.21 0.00 0.00 61.69 60.33 1x5f s THR 57 Cb -0.11 -0.98 -0.13 0.00 -1.51 0.00 0.00 72.50 69.77 1x5f s THR 57 CO 0.01 0.00 0.92 1.17 -2.21 0.00 0.00 174.62 174.51 1x5f n LYS 58 N 4.42 1.17 -1.71 7.08 4.81 -1.26 -1.21 118.16 131.45 1x5f n LYS 58 Ca -0.19 0.41 -0.58 0.00 -0.87 0.00 0.00 58.31 57.08 1x5f n LYS 58 Cb 0.58 -1.78 -0.07 0.00 0.02 0.00 0.00 35.03 33.77 1x5f n LYS 58 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 1x5f n GLU 59 N 0.62 1.11 0.00 1.64 2.13 -1.18 -0.51 120.64 124.45 1x5f n GLU 59 Ca 0.10 0.41 0.00 0.00 0.66 0.00 0.00 57.16 58.33 1x5f n GLU 59 Cb 0.34 -2.08 0.00 0.00 0.27 0.00 0.00 31.44 29.96 1x5f n GLU 59 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1x5f n GLY 60 N 4.19 3.07 3.77 8.31 0.00 -1.26 -5.04 105.19 118.23 1x5f n GLY 60 Ca 0.27 -0.86 -0.41 0.00 0.00 0.00 0.00 46.02 45.02 1x5f n GLY 60 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1x5f s ILE 61 N -0.69 2.47 -0.07 -0.61 -1.09 0.34 -4.93 121.20 116.61 1x5f s ILE 61 Ca 0.00 0.45 0.14 0.00 -2.23 0.00 0.00 60.65 59.01 1x5f s ILE 61 Cb 0.00 -3.29 -0.22 0.00 -1.58 0.00 0.00 42.46 37.38 1x5f s ILE 61 CO 0.00 0.10 0.64 0.00 -1.23 0.00 0.00 174.94 174.45 1x5f n ALA 62 N 1.05 1.58 -2.05 9.38 0.00 -1.26 -4.64 120.51 124.56 1x5f n ALA 62 Ca 0.02 -0.77 -0.42 0.00 0.00 0.00 0.00 53.44 52.27 1x5f n ALA 62 Cb 0.40 -0.82 -0.03 0.00 0.00 0.00 0.00 19.45 19.01 1x5f n ALA 62 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1x5f s ARG 63 N -2.65 3.27 0.09 0.00 3.52 -1.26 -4.98 118.95 116.94 1x5f s ARG 63 Ca -0.05 1.24 0.10 0.00 -0.13 0.00 0.00 55.73 56.89 1x5f s ARG 63 Cb 0.08 -4.20 -0.03 0.00 -1.56 0.00 0.00 34.95 29.24 1x5f s ARG 63 CO 0.82 -1.94 -0.25 -1.83 -0.81 0.00 0.00 175.30 171.29 1x5f s GLU 64 N 5.76 1.47 -0.08 5.12 1.03 -1.26 -4.68 118.70 126.05 1x5f s GLU 64 Ca 0.75 -1.20 0.01 0.00 0.03 0.00 0.00 54.97 54.56 1x5f s GLU 64 Cb -0.20 -1.78 -0.03 0.00 -0.80 0.00 0.00 34.13 31.32 1x5f s GLU 64 CO 0.32 0.44 -0.08 1.03 -1.33 0.00 0.00 175.26 175.64 1x5f s ARG 65 N -1.68 2.85 -0.03 -4.83 0.52 -0.95 -4.89 118.95 109.94 1x5f s ARG 65 Ca 0.11 -0.57 -0.11 0.00 -0.52 0.00 0.00 55.73 54.64 1x5f s ARG 65 Cb -0.10 -2.60 -0.05 0.00 0.52 0.00 0.00 34.95 32.72 1x5f s ARG 65 CO 0.04 0.59 0.31 0.54 0.02 0.00 0.00 175.30 176.80 1x5f s VAL 66 N -0.62 5.21 -0.29 3.52 0.11 -1.26 -2.04 120.40 125.04 1x5f s VAL 66 Ca 0.09 0.53 0.01 0.00 -2.93 0.00 0.00 61.98 59.69 1x5f s VAL 66 Cb -0.12 -3.59 0.08 0.00 -1.53 0.00 0.00 36.38 31.23 1x5f s VAL 66 CO 0.02 0.54 0.03 -0.70 -3.33 0.00 0.00 175.10 171.66 1x5f s GLU 67 N -1.21 1.28 -0.01 1.54 2.56 0.03 -4.91 118.70 117.98 1x5f s GLU 67 Ca 0.22 -1.28 -0.30 0.00 0.00 0.00 0.00 54.97 53.61 1x5f s GLU 67 Cb -0.15 -2.58 -0.05 0.00 2.00 0.00 0.00 34.13 33.35 1x5f s GLU 67 CO 0.11 -0.82 1.29 -0.80 -0.56 0.00 0.00 175.26 174.48 1x5f s ASN 68 N 1.32 6.96 -0.01 -1.70 0.02 -1.26 -2.90 114.94 117.37 1x5f s ASN 68 Ca 0.04 1.98 -0.37 0.00 -1.02 0.00 0.00 52.86 53.50 1x5f s ASN 68 Cb -0.18 -2.56 -0.15 0.00 0.02 0.00 0.00 41.25 38.37 1x5f s ASN 68 CO -0.13 -0.63 1.57 0.35 0.02 0.00 0.00 177.10 178.28 1x5f n THR 69 N 4.54 0.16 -0.48 1.60 -2.24 -1.07 -4.74 114.28 112.04 1x5f n THR 69 Ca 0.12 -0.03 0.41 0.00 -2.27 0.00 0.00 64.05 62.28 1x5f n THR 69 Cb 0.45 -1.23 0.63 0.00 -2.10 0.00 0.00 70.33 68.09 1x5f n THR 69 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1x5f n SER 70 N 4.00 0.00 -3.85 3.42 2.88 -1.26 -4.25 113.62 114.56 1x5f n SER 70 Ca 0.21 0.86 -0.12 0.00 -1.33 0.00 0.00 58.87 58.49 1x5f n SER 70 Cb 0.21 -0.38 -0.11 0.00 -0.75 0.00 0.00 64.21 63.18 1x5f n SER 70 CO 0.00 0.00 0.00 -1.00 -1.23 0.00 0.00 175.04 172.81 1x5f s HIS 71 N -4.59 -0.04 0.21 0.66 3.76 -1.26 -5.14 115.29 108.88 1x5f s HIS 71 Ca -0.04 0.10 -0.30 0.00 -0.15 0.00 0.00 55.06 54.67 1x5f s HIS 71 Cb 0.21 -0.01 -0.09 0.00 1.11 0.00 0.00 32.58 33.80 1x5f s HIS 71 CO 0.69 -0.17 1.29 -1.25 -0.85 0.00 0.00 174.74 174.44 1x5f s PRO 72 N -0.65 4.40 0.00 8.40 0.04 -1.26 -2.94 135.00 142.99 1x5f s PRO 72 Ca -0.07 2.05 0.00 0.00 0.04 0.00 0.00 61.00 63.01 1x5f s PRO 72 Cb -0.04 -3.19 0.00 0.00 0.04 0.00 0.00 34.50 31.31 1x5f s PRO 72 CO 0.01 -0.22 0.00 0.41 0.04 0.00 0.00 177.00 177.24 1x5f n GLY 73 N 2.16 2.76 3.56 0.56 0.00 -1.24 -4.94 105.19 108.06 1x5f n GLY 73 Ca 0.05 0.00 -0.48 0.00 0.00 0.00 0.00 46.02 45.59 1x5f n GLY 73 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1x5f n GLU 74 N -2.00 1.66 0.00 1.61 2.13 -1.15 -4.80 120.64 118.09 1x5f n GLU 74 Ca 0.00 0.51 0.05 0.00 0.66 0.00 0.00 57.16 58.38 1x5f n GLU 74 Cb 0.00 -2.73 0.27 0.00 0.27 0.00 0.00 31.44 29.25 1x5f n GLU 74 CO 0.00 0.00 0.00 -1.33 -0.41 0.00 0.00 177.13 175.39 1x5f n MET 75 N 7.85 0.93 -3.83 5.31 2.81 -1.26 -4.76 117.12 124.17 1x5f n MET 75 Ca 0.32 0.00 -0.12 0.00 -1.81 0.00 0.00 57.70 56.09 1x5f n MET 75 Cb 0.31 -1.15 -0.10 0.00 -0.71 0.00 0.00 33.22 31.57 1x5f n MET 75 CO 0.00 0.00 0.00 -0.65 1.51 0.00 0.00 175.97 176.83 1x5f s GLN 76 N -2.00 0.52 0.04 0.03 1.11 -1.26 -0.99 119.66 117.10 1x5f s GLN 76 Ca 0.14 -0.27 -0.17 0.00 0.01 0.00 0.00 55.36 55.07 1x5f s GLN 76 Cb 0.06 0.22 0.03 0.00 -1.01 0.00 0.00 33.01 32.32 1x5f s GLN 76 CO 0.10 -0.13 0.39 0.54 0.01 0.00 0.00 175.29 176.21 1x5f s VAL 77 N -1.22 0.06 -0.06 1.09 0.11 -0.97 -4.96 120.40 114.45 1x5f s VAL 77 Ca -0.13 -0.50 0.04 0.00 -2.93 0.00 0.00 61.98 58.46 1x5f s VAL 77 Cb -0.06 -0.94 -0.02 0.00 -1.53 0.00 0.00 36.38 33.83 1x5f s VAL 77 CO 0.02 -0.28 -0.18 -0.89 -3.33 0.00 0.00 175.10 170.45 1x5f s THR 78 N -2.46 2.74 -0.51 5.04 2.01 -1.26 -0.17 115.64 121.04 1x5f s THR 78 Ca -0.05 -0.83 -0.02 0.00 0.31 0.00 0.00 61.69 61.10 1x5f s THR 78 Cb -0.01 -2.06 0.13 0.00 0.01 0.00 0.00 72.50 70.57 1x5f s THR 78 CO -0.02 0.57 0.30 -0.63 -0.69 0.00 0.00 174.62 174.15 1x5f s ILE 79 N -0.42 3.30 0.81 1.82 -1.09 -0.94 -4.97 121.20 119.72 1x5f s ILE 79 Ca 0.05 -2.61 -0.07 0.00 -2.23 0.00 0.00 60.65 55.79 1x5f s ILE 79 Cb -0.12 -3.23 0.15 0.00 -1.58 0.00 0.00 42.46 37.68 1x5f s ILE 79 CO 0.02 -0.78 1.12 -1.10 -1.23 0.00 0.00 174.94 172.97 1x5f s GLN 80 N 0.45 1.33 -0.72 2.79 -0.21 -1.26 -2.44 119.66 119.59 1x5f s GLN 80 Ca 0.13 -0.76 -0.04 0.00 0.02 0.00 0.00 55.36 54.71 1x5f s GLN 80 Cb -0.22 -2.13 0.00 0.00 1.00 0.00 0.00 33.01 31.67 1x5f s GLN 80 CO -0.04 -1.80 0.63 0.09 -2.12 0.00 0.00 175.29 172.05 1x5f n ASN 81 N -3.20 -3.91 -4.72 5.90 4.13 -0.88 -4.92 115.26 107.67 1x5f n ASN 81 Ca 0.14 -0.30 -0.24 0.00 1.68 0.00 0.00 54.58 55.86 1x5f n ASN 81 Cb 0.60 -2.99 -0.07 0.00 -1.54 0.00 0.00 39.78 35.78 1x5f n ASN 81 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 1x5f s LEU 82 N -4.44 3.15 -0.14 3.41 1.43 0.29 -5.03 118.68 117.35 1x5f s LEU 82 Ca 0.26 -0.93 -0.07 0.00 -1.03 0.00 0.00 54.13 52.36 1x5f s LEU 82 Cb -0.11 -1.56 -0.04 0.00 0.03 0.00 0.00 46.19 44.51 1x5f s LEU 82 CO 0.40 -0.38 0.11 -0.32 0.23 0.00 0.00 176.35 176.38 1x5f s MET 83 N -3.85 3.61 0.65 1.70 -2.45 -1.26 -4.45 119.30 113.25 1x5f s MET 83 Ca 0.39 -0.22 -0.15 0.00 -1.25 0.00 0.00 55.69 54.45 1x5f s MET 83 Cb 0.00 -3.18 -0.00 0.00 1.25 0.00 0.00 34.83 32.90 1x5f s MET 83 CO 0.22 0.60 1.11 -1.25 1.05 0.00 0.00 175.02 176.75 1x5f s PRO 84 N -0.52 2.83 -1.62 4.11 0.04 -0.83 -3.52 135.00 135.49 1x5f s PRO 84 Ca 0.12 1.40 -0.16 0.00 0.04 0.00 0.00 61.00 62.40 1x5f s PRO 84 Cb -0.12 -1.95 0.12 0.00 0.04 0.00 0.00 34.50 32.59 1x5f s PRO 84 CO 0.02 -1.23 0.86 0.00 0.04 0.00 0.00 177.00 176.69 1x5f n ALA 85 N -2.36 -1.31 -3.71 8.56 0.00 -1.09 -4.87 120.51 115.74 1x5f n ALA 85 Ca 0.10 0.07 -0.20 0.00 0.00 0.00 0.00 53.44 53.41 1x5f n ALA 85 Cb 0.52 -3.82 -0.17 0.00 0.00 0.00 0.00 19.45 15.98 1x5f n ALA 85 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1x5f s THR 86 N -3.33 0.34 0.35 0.00 2.01 -1.23 -4.90 115.64 108.88 1x5f s THR 86 Ca 0.67 0.06 -0.28 0.00 0.31 0.00 0.00 61.69 62.45 1x5f s THR 86 Cb -0.35 -0.45 -0.10 0.00 0.01 0.00 0.00 72.50 71.61 1x5f s THR 86 CO 0.88 0.22 1.28 -0.69 -0.69 0.00 0.00 174.62 175.61 1x5f s VAL 87 N 1.44 2.80 -0.06 3.82 1.01 -1.26 -3.26 120.40 124.90 1x5f s VAL 87 Ca -0.03 0.78 -0.03 0.00 0.00 0.00 0.00 61.98 62.70 1x5f s VAL 87 Cb -0.13 -3.49 0.03 0.00 0.00 0.00 0.00 36.38 32.80 1x5f s VAL 87 CO -0.03 0.16 0.13 -0.31 0.00 0.00 0.00 175.10 175.06 1x5f s TYR 88 N -1.19 -0.14 -0.52 5.22 2.02 0.50 -3.13 117.35 120.11 1x5f s TYR 88 Ca 0.51 0.42 -0.21 0.00 -0.37 0.00 0.00 57.07 57.42 1x5f s TYR 88 Cb -0.38 -0.07 0.05 0.00 -0.40 0.00 0.00 41.96 41.16 1x5f s TYR 88 CO 0.50 -0.14 0.74 0.42 -1.57 0.00 0.00 175.55 175.50 1x5f s ILE 89 N 0.96 4.70 -0.15 2.71 -1.09 -0.35 -1.66 121.20 126.32 1x5f s ILE 89 Ca -0.07 -0.21 -0.16 0.00 -2.23 0.00 0.00 60.65 57.98 1x5f s ILE 89 Cb -0.10 -4.38 -0.04 0.00 -1.58 0.00 0.00 42.46 36.36 1x5f s ILE 89 CO -0.05 -0.91 0.37 -0.36 -1.23 0.00 0.00 174.94 172.76 1x5f s PHE 90 N 3.10 3.48 -0.14 3.97 0.40 -0.42 -2.65 117.98 125.72 1x5f s PHE 90 Ca 0.21 0.71 -0.00 0.00 -0.60 0.00 0.00 56.93 57.24 1x5f s PHE 90 Cb -0.17 -2.43 0.03 0.00 0.51 0.00 0.00 43.02 40.96 1x5f s PHE 90 CO 0.15 0.20 -0.08 1.03 0.70 0.00 0.00 175.22 177.21 1x5f s ARG 91 N 0.56 1.69 -0.02 0.44 0.52 -0.15 -1.35 118.95 120.64 1x5f s ARG 91 Ca 0.20 -0.42 -0.11 0.00 -0.52 0.00 0.00 55.73 54.88 1x5f s ARG 91 Cb -0.14 -1.86 -0.05 0.00 0.52 0.00 0.00 34.95 33.42 1x5f s ARG 91 CO 0.06 -0.31 0.32 0.08 0.02 0.00 0.00 175.30 175.46 1x5f s VAL 92 N 1.62 5.21 0.01 3.52 1.01 -1.26 -0.73 120.40 129.77 1x5f s VAL 92 Ca 0.03 0.51 -0.07 0.00 0.00 0.00 0.00 61.98 62.45 1x5f s VAL 92 Cb -0.14 -3.60 -0.00 0.00 0.00 0.00 0.00 36.38 32.65 1x5f s VAL 92 CO -0.09 0.51 0.12 -0.32 0.00 0.00 0.00 175.10 175.33 1x5f s MET 93 N -1.31 0.48 0.18 2.72 0.00 0.19 0.46 119.30 122.01 1x5f s MET 93 Ca 0.24 -0.44 -0.01 0.00 0.00 0.00 0.00 55.69 55.48 1x5f s MET 93 Cb -0.14 0.20 -0.04 0.00 0.00 0.00 0.00 34.83 34.84 1x5f s MET 93 CO 0.12 -0.11 0.36 0.00 0.00 0.00 0.00 175.02 175.39 1x5f s ALA 94 N -1.48 3.85 -0.08 4.11 0.00 -1.26 -0.15 121.76 126.75 1x5f s ALA 94 Ca -0.14 -0.81 -0.03 0.00 0.00 0.00 0.00 51.96 50.97 1x5f s ALA 94 Cb -0.07 -1.98 0.04 0.00 0.00 0.00 0.00 23.12 21.11 1x5f s ALA 94 CO 0.01 0.51 0.16 -0.65 0.00 0.00 0.00 175.76 175.79 1x5f s GLN 95 N -3.15 0.08 0.25 0.00 -0.21 0.20 -2.88 119.66 113.94 1x5f s GLN 95 Ca 0.38 0.48 0.01 0.00 0.02 0.00 0.00 55.36 56.25 1x5f s GLN 95 Cb -0.11 -0.21 -0.00 0.00 1.00 0.00 0.00 33.01 33.69 1x5f s GLN 95 CO 0.28 -0.23 0.03 0.27 -2.12 0.00 0.00 175.29 173.52 1x5f n ASN 96 N 4.72 2.19 -0.60 5.90 0.23 -1.11 0.70 115.26 127.28 1x5f n ASN 96 Ca -0.17 -2.15 0.47 0.00 -0.53 0.00 0.00 54.58 52.21 1x5f n ASN 96 Cb 0.51 0.30 0.72 0.00 -2.08 0.00 0.00 39.78 39.23 1x5f n ASN 96 CO 0.00 0.00 0.00 2.29 -0.93 0.00 0.00 177.26 178.62 1x5f n LYS 97 N -0.60 0.00 0.00 -3.83 2.85 -1.26 -1.16 118.16 114.16 1x5f n LYS 97 Ca -0.08 1.04 0.00 0.00 -1.05 0.00 0.00 58.31 58.22 1x5f n LYS 97 Cb 0.33 -2.44 0.00 0.00 -0.65 0.00 0.00 35.03 32.27 1x5f n LYS 97 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 1x5f n HIS 98 N -3.72 0.00 0.00 5.58 8.25 -1.26 -5.09 115.22 118.97 1x5f n HIS 98 Ca 0.39 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.85 1x5f n HIS 98 Cb 1.87 -0.49 0.00 0.00 1.12 0.00 0.00 29.99 32.50 1x5f n HIS 98 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1x5f n GLY 99 N 1.25 -0.60 3.63 -1.41 0.00 -0.31 -5.10 105.19 102.65 1x5f n GLY 99 Ca 0.00 -0.45 -0.43 0.00 0.00 0.00 0.00 46.02 45.14 1x5f n GLY 99 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1x5f s SER 100 N -4.00 6.84 0.00 1.61 1.04 -1.26 -2.76 113.70 115.17 1x5f s SER 100 Ca 0.00 0.93 0.00 0.00 0.48 0.00 0.00 55.95 57.36 1x5f s SER 100 Cb 0.00 -2.49 0.00 0.00 0.10 0.00 0.00 66.02 63.63 1x5f s SER 100 CO 0.00 -0.76 0.00 0.61 0.98 0.00 0.00 173.24 174.07 1x5f n GLY 101 N 3.95 1.75 3.40 7.32 0.00 -1.14 -4.96 105.19 115.51 1x5f n GLY 101 Ca 0.09 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.79 1x5f n GLY 101 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1x5f s GLU 102 N 0.15 2.48 -0.26 1.61 2.12 -1.25 -4.96 118.70 118.58 1x5f s GLU 102 Ca 0.00 -0.78 -0.26 0.00 0.36 0.00 0.00 54.97 54.28 1x5f s GLU 102 Cb 0.00 -2.28 0.00 0.00 0.26 0.00 0.00 34.13 32.11 1x5f s GLU 102 CO 0.00 0.54 0.93 -1.54 -0.54 0.00 0.00 175.26 174.65 1x5f s SER 103 N -0.53 6.90 1.07 -1.70 1.04 -1.26 -2.43 113.70 116.79 1x5f s SER 103 Ca 0.07 1.07 -0.20 0.00 0.48 0.00 0.00 55.95 57.38 1x5f s SER 103 Cb -0.11 -2.48 0.05 0.00 0.10 0.00 0.00 66.02 63.57 1x5f s SER 103 CO 0.01 -0.65 -0.31 -1.54 0.98 0.00 0.00 173.24 171.74 1x5f n SER 104 N 6.30 -2.61 -4.76 7.02 3.41 0.17 -4.89 113.62 118.26 1x5f n SER 104 Ca 0.08 -0.15 -0.37 0.00 -0.26 0.00 0.00 58.87 58.18 1x5f n SER 104 Cb 0.47 -0.81 0.02 0.00 -0.26 0.00 0.00 64.21 63.63 1x5f n SER 104 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1x5f s ALA 105 N -2.15 2.76 -0.20 7.33 0.00 -1.26 -4.62 121.76 123.62 1x5f s ALA 105 Ca 0.47 1.04 -0.29 0.00 0.00 0.00 0.00 51.96 53.18 1x5f s ALA 105 Cb -0.05 -3.45 -0.03 0.00 0.00 0.00 0.00 23.12 19.59 1x5f s ALA 105 CO 0.59 -1.01 1.59 -1.25 0.00 0.00 0.00 175.76 175.69 1x5f s PRO 106 N -3.03 3.88 -0.24 0.00 0.04 -1.26 -4.65 135.00 129.74 1x5f s PRO 106 Ca 0.71 1.73 -0.14 0.00 0.04 0.00 0.00 61.00 63.34 1x5f s PRO 106 Cb -0.31 -4.01 -0.04 0.00 0.04 0.00 0.00 34.50 30.18 1x5f s PRO 106 CO 0.36 -1.19 0.32 -1.17 0.04 0.00 0.00 177.00 175.36 1x5f s LEU 107 N 4.92 4.09 -0.56 -3.56 2.96 -0.46 -4.92 118.68 121.15 1x5f s LEU 107 Ca 0.70 0.30 -0.24 0.00 -0.22 0.00 0.00 54.13 54.68 1x5f s LEU 107 Cb -0.26 -2.37 0.05 0.00 0.50 0.00 0.00 46.19 44.11 1x5f s LEU 107 CO 0.28 -0.09 0.93 -0.60 -1.32 0.00 0.00 176.35 175.55 1x5f s ARG 108 N 1.59 3.29 -0.13 1.98 3.52 -1.26 -1.30 118.95 126.64 1x5f s ARG 108 Ca 0.14 -0.36 0.01 0.00 -0.13 0.00 0.00 55.73 55.39 1x5f s ARG 108 Cb -0.15 -4.07 -0.00 0.00 -1.56 0.00 0.00 34.95 29.16 1x5f s ARG 108 CO 0.08 -1.51 -0.17 0.08 -0.81 0.00 0.00 175.30 172.97 1x5f s VAL 109 N 3.90 2.59 -0.21 7.11 1.01 -0.67 -4.96 120.40 129.17 1x5f s VAL 109 Ca 0.29 -0.81 -0.03 0.00 0.00 0.00 0.00 61.98 61.42 1x5f s VAL 109 Cb -0.13 -2.07 -0.01 0.00 0.00 0.00 0.00 36.38 34.18 1x5f s VAL 109 CO 0.18 0.53 -0.07 -0.70 0.00 0.00 0.00 175.10 175.04 1x5f s GLU 110 N 0.56 3.33 1.31 2.72 2.12 -1.26 -0.37 118.70 127.11 1x5f s GLU 110 Ca -0.10 -0.66 -0.22 0.00 0.36 0.00 0.00 54.97 54.35 1x5f s GLU 110 Cb -0.16 -2.91 0.34 0.00 0.26 0.00 0.00 34.13 31.65 1x5f s GLU 110 CO 0.04 -0.16 0.92 0.25 -0.54 0.00 0.00 175.26 175.77 1x5f n THR 111 N 4.64 0.00 -4.15 -1.70 -2.24 -1.20 -4.91 114.28 104.72 1x5f n THR 111 Ca -0.19 -0.19 -0.32 0.00 -2.27 0.00 0.00 64.05 61.09 1x5f n THR 111 Cb 0.51 -1.06 -0.08 0.00 -2.10 0.00 0.00 70.33 67.60 1x5f n THR 111 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1x5f s GLN 112 N -5.15 2.83 -0.64 -0.78 -0.21 -1.26 -3.72 119.66 110.73 1x5f s GLN 112 Ca 0.66 -0.65 -0.26 0.00 0.02 0.00 0.00 55.36 55.12 1x5f s GLN 112 Cb -0.09 -2.70 -0.02 0.00 1.00 0.00 0.00 33.01 31.19 1x5f s GLN 112 CO 0.53 0.60 1.87 -1.25 -2.12 0.00 0.00 175.29 174.92 1x5f s PRO 113 N -1.96 2.61 0.99 2.91 0.04 -1.26 -2.65 135.00 135.67 1x5f s PRO 113 Ca 0.24 0.52 -0.17 0.00 0.04 0.00 0.00 61.00 61.63 1x5f s PRO 113 Cb -0.12 -4.46 -0.15 0.00 0.04 0.00 0.00 34.50 29.81 1x5f s PRO 113 CO 0.16 -2.80 -0.85 0.39 0.04 0.00 0.00 177.00 173.94 1x5f n GLU 114 N 9.16 0.00 0.06 4.56 1.02 -1.26 -4.82 120.64 129.36 1x5f n GLU 114 Ca 0.22 0.00 0.01 0.00 -0.02 0.00 0.00 57.16 57.37 1x5f n GLU 114 Cb 0.52 -0.99 0.32 0.00 -0.02 0.00 0.00 31.44 31.27 1x5f n GLU 114 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1x5f h SER 115 N -0.99 0.35 -2.20 1.62 0.87 -1.96 -3.49 113.55 107.75 1x5f h SER 115 Ca -0.43 -0.08 0.00 0.00 -1.23 0.00 0.00 61.79 60.05 1x5f h SER 115 Cb 1.29 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 63.16 1x5f h SER 115 CO 0.23 0.50 0.00 0.61 -0.53 0.00 0.00 176.83 177.64 1x5f n GLY 116 N -0.76 -0.37 0.06 5.77 0.00 -1.26 -4.77 105.19 103.85 1x5f n GLY 116 Ca 0.00 -2.21 -0.13 0.00 0.00 0.00 0.00 46.02 43.68 1x5f n GLY 116 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1x5f h PRO 117 N 2.58 0.01 -5.59 1.61 0.13 -2.04 -3.43 132.00 125.26 1x5f h PRO 117 Ca 0.00 -0.00 -0.58 0.00 -0.87 0.00 0.00 66.00 64.54 1x5f h PRO 117 Cb 0.00 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.09 1x5f h PRO 117 CO 0.00 0.49 1.57 0.43 -0.23 0.00 0.00 178.00 180.26 1x5f n SER 118 N -4.85 1.39 0.03 1.44 7.64 -1.26 -4.80 113.62 113.20 1x5f n SER 118 Ca -0.08 0.17 -0.11 0.00 1.01 0.00 0.00 58.87 59.86 1x5f n SER 118 Cb 0.25 -1.17 -0.06 0.00 -1.01 0.00 0.00 64.21 62.22 1x5f n SER 118 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 1x5f h SER 119 N 13.40 -0.11 0.00 6.43 0.02 -1.98 -3.49 113.55 127.82 1x5f h SER 119 Ca -0.17 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.80 1x5f h SER 119 Cb 1.32 0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.92 1x5f h SER 119 CO 1.18 -0.05 0.00 0.61 -1.14 0.00 0.00 176.83 177.43