#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1x5f s SER 2 N 0.00 -0.32 -0.30 1.61 0.15 -1.26 -5.17 113.70 108.41 1x5f s SER 2 Ca 0.00 -0.17 -0.16 0.00 0.70 0.00 0.00 55.95 56.31 1x5f s SER 2 Cb 0.00 0.46 0.18 0.00 -1.71 0.00 0.00 66.02 64.95 1x5f s SER 2 CO 0.00 -0.80 1.13 -0.94 1.20 0.00 0.00 173.24 173.83 1x5f s SER 3 N -2.70 -0.29 0.00 5.45 1.04 -1.26 -5.16 113.70 110.78 1x5f s SER 3 Ca 0.07 0.44 0.00 0.00 0.48 0.00 0.00 55.95 56.95 1x5f s SER 3 Cb -0.01 1.19 0.00 0.00 0.10 0.00 0.00 66.02 67.30 1x5f s SER 3 CO -0.05 -0.07 0.00 0.61 0.98 0.00 0.00 173.24 174.72 1x5f n GLY 4 N 3.80 2.67 3.63 7.32 0.00 -1.26 -5.16 105.19 116.18 1x5f n GLY 4 Ca -0.15 -1.61 -0.03 0.00 0.00 0.00 0.00 46.02 44.23 1x5f n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1x5f s SER 5 N 0.00 -0.17 0.32 1.61 1.04 -1.26 -5.19 113.70 110.05 1x5f s SER 5 Ca 0.00 -0.15 0.03 0.00 0.48 0.00 0.00 55.95 56.30 1x5f s SER 5 Cb 0.00 0.29 -0.02 0.00 0.10 0.00 0.00 66.02 66.39 1x5f s SER 5 CO 0.00 -0.52 0.33 -0.94 0.98 0.00 0.00 173.24 173.09 1x5f s SER 6 N -2.70 1.22 0.00 7.02 1.04 -1.26 -5.13 113.70 113.89 1x5f s SER 6 Ca 0.11 -1.61 0.00 0.00 0.48 0.00 0.00 55.95 54.93 1x5f s SER 6 Cb 0.01 0.57 0.00 0.00 0.10 0.00 0.00 66.02 66.70 1x5f s SER 6 CO -0.03 -1.11 0.00 0.61 0.98 0.00 0.00 173.24 173.68 1x5f n GLY 7 N -0.56 2.13 3.53 7.32 0.00 -1.26 -5.15 105.19 111.21 1x5f n GLY 7 Ca 0.05 -0.92 0.00 0.00 0.00 0.00 0.00 46.02 45.15 1x5f n GLY 7 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1x5f s GLU 8 N -2.59 0.54 0.80 1.61 2.12 -1.26 -5.17 118.70 114.76 1x5f s GLU 8 Ca 0.00 1.29 -0.12 0.00 0.36 0.00 0.00 54.97 56.50 1x5f s GLU 8 Cb 0.00 0.77 0.08 0.00 0.26 0.00 0.00 34.13 35.23 1x5f s GLU 8 CO 0.00 -0.26 1.17 -3.38 -0.54 0.00 0.00 175.26 172.26 1x5f s HIS 9 N 2.84 2.96 -0.07 5.30 -3.43 -1.26 -5.10 115.29 116.54 1x5f s HIS 9 Ca -0.01 0.75 -0.11 0.00 -0.80 0.00 0.00 55.06 54.89 1x5f s HIS 9 Cb -0.12 -3.48 0.02 0.00 -1.43 0.00 0.00 32.58 27.58 1x5f s HIS 9 CO -0.19 -1.75 0.28 0.00 -2.00 0.00 0.00 174.74 171.08 1x5f s ALA 10 N -3.56 -0.70 0.87 -1.38 0.00 -1.26 -5.17 121.76 110.56 1x5f s ALA 10 Ca 0.62 0.55 -0.11 0.00 0.00 0.00 0.00 51.96 53.02 1x5f s ALA 10 Cb -0.11 -0.23 0.12 0.00 0.00 0.00 0.00 23.12 22.89 1x5f s ALA 10 CO 0.49 -0.19 1.09 -1.25 0.00 0.00 0.00 175.76 175.90 1x5f s PRO 11 N -0.52 1.44 -0.14 0.00 0.04 -1.26 -5.02 135.00 129.55 1x5f s PRO 11 Ca -0.06 0.88 -0.03 0.00 0.04 0.00 0.00 61.00 61.83 1x5f s PRO 11 Cb -0.04 -1.83 -0.07 0.00 0.04 0.00 0.00 34.50 32.60 1x5f s PRO 11 CO 0.02 -2.13 -0.15 0.00 0.04 0.00 0.00 177.00 174.78 1x5f n ALA 12 N -3.81 1.90 -2.58 8.56 0.00 -1.26 -5.02 120.51 118.30 1x5f n ALA 12 Ca 0.07 -0.56 -0.33 0.00 0.00 0.00 0.00 53.44 52.63 1x5f n ALA 12 Cb 0.55 0.26 -0.05 0.00 0.00 0.00 0.00 19.45 20.20 1x5f n ALA 12 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1x5f s THR 13 N -2.26 5.09 -0.20 0.00 -1.32 -1.26 -5.09 115.64 110.60 1x5f s THR 13 Ca -0.19 0.27 -0.04 0.00 -1.21 0.00 0.00 61.69 60.52 1x5f s THR 13 Cb 0.06 -3.63 0.07 0.00 -1.51 0.00 0.00 72.50 67.49 1x5f s THR 13 CO 0.28 0.10 0.09 0.42 -2.21 0.00 0.00 174.62 173.29 1x5f s THR 14 N -1.61 0.05 0.00 5.08 -4.23 -1.26 -5.05 115.64 108.62 1x5f s THR 14 Ca 0.40 -0.38 0.00 0.00 -1.18 0.00 0.00 61.69 60.53 1x5f s THR 14 Cb -0.13 -0.76 0.00 0.00 1.34 0.00 0.00 72.50 72.95 1x5f s THR 14 CO 0.22 -0.36 0.00 0.61 -0.54 0.00 0.00 174.62 174.54 1x5f n GLY 15 N 5.22 5.11 3.77 3.99 0.00 -1.26 -5.16 105.19 116.86 1x5f n GLY 15 Ca -0.07 -1.36 -0.32 0.00 0.00 0.00 0.00 46.02 44.28 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 1.11 2.40 0.10 1.61 0.04 -1.26 -5.07 135.00 133.93 1x5f s PRO 16 Ca 0.00 1.22 0.08 0.00 0.04 0.00 0.00 61.00 62.35 1x5f s PRO 16 Cb 0.00 -1.91 -0.04 0.00 0.04 0.00 0.00 34.50 32.59 1x5f s PRO 16 CO 0.00 -1.54 -0.18 -0.51 0.04 0.00 0.00 177.00 174.81 1x5f s LEU 17 N -5.65 2.68 1.11 -3.56 1.43 -1.26 -4.97 118.68 108.45 1x5f s LEU 17 Ca 0.63 -0.52 -0.16 0.00 -1.03 0.00 0.00 54.13 53.04 1x5f s LEU 17 Cb -0.18 -1.54 0.24 0.00 0.03 0.00 0.00 46.19 44.74 1x5f s LEU 17 CO 0.52 0.20 1.10 -2.16 0.23 0.00 0.00 176.35 176.24 1x5f s PRO 18 N -1.96 -0.44 -0.06 1.29 0.04 -1.26 -4.90 135.00 127.71 1x5f s PRO 18 Ca 0.17 0.21 0.02 0.00 0.04 0.00 0.00 61.00 61.45 1x5f s PRO 18 Cb -0.11 -1.66 -0.03 0.00 0.04 0.00 0.00 34.50 32.74 1x5f s PRO 18 CO 0.09 -3.25 -0.10 0.45 0.04 0.00 0.00 177.00 174.23 1x5f s SER 19 N -3.67 4.39 0.66 6.66 0.15 -1.26 -2.79 113.70 117.84 1x5f s SER 19 Ca 0.68 -0.09 -0.17 0.00 0.70 0.00 0.00 55.95 57.07 1x5f s SER 19 Cb -0.14 -1.04 -0.09 0.00 -1.71 0.00 0.00 66.02 63.04 1x5f s SER 19 CO 0.57 0.36 0.22 0.00 1.20 0.00 0.00 173.24 175.58 1x5f n ALA 20 N 2.26 -2.26 -1.24 5.45 0.00 -1.06 -4.63 120.51 119.03 1x5f n ALA 20 Ca -0.18 -0.19 -0.31 0.00 0.00 0.00 0.00 53.44 52.77 1x5f n ALA 20 Cb 0.53 -1.66 0.11 0.00 0.00 0.00 0.00 19.45 18.43 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 -2.08 1.87 0.46 0.00 0.04 -1.26 -4.63 135.00 129.40 1x5f s PRO 21 Ca 0.61 1.03 0.03 0.00 0.04 0.00 0.00 61.00 62.72 1x5f s PRO 21 Cb -0.39 -1.86 0.03 0.00 0.04 0.00 0.00 34.50 32.32 1x5f s PRO 21 CO 0.62 -1.87 0.26 0.54 0.04 0.00 0.00 177.00 176.58 1x5f n ARG 22 N -3.66 0.84 -3.26 4.56 1.74 -1.24 -4.69 116.66 110.95 1x5f n ARG 22 Ca 0.08 -2.99 -0.22 0.00 -0.77 0.00 0.00 57.85 53.95 1x5f n ARG 22 Cb 0.54 0.45 0.00 0.00 -1.02 0.00 0.00 32.46 32.43 1x5f n ARG 22 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1x5f n ASP 23 N -1.70 -4.03 -4.55 0.55 9.92 -1.26 -1.21 116.55 114.27 1x5f n ASP 23 Ca -0.06 -0.34 -0.39 0.00 -0.53 0.00 0.00 54.79 53.47 1x5f n ASP 23 Cb 0.54 -3.32 -0.03 0.00 -0.64 0.00 0.00 41.12 37.66 1x5f n ASP 23 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1x5f s VAL 24 N -2.94 3.34 0.34 2.53 1.01 -1.26 -4.11 120.40 119.31 1x5f s VAL 24 Ca 0.36 0.22 0.04 0.00 0.00 0.00 0.00 61.98 62.60 1x5f s VAL 24 Cb -0.19 -3.84 -0.03 0.00 0.00 0.00 0.00 36.38 32.32 1x5f s VAL 24 CO 0.44 -0.79 0.16 0.68 0.00 0.00 0.00 175.10 175.59 1x5f s VAL 25 N 9.10 0.42 -0.40 2.92 -7.23 0.01 -4.99 120.40 120.23 1x5f s VAL 25 Ca 0.71 -2.00 -0.06 0.00 -1.81 0.00 0.00 61.98 58.82 1x5f s VAL 25 Cb -0.14 -2.47 0.09 0.00 0.56 0.00 0.00 36.38 34.42 1x5f s VAL 25 CO 0.22 0.00 0.20 0.00 -0.31 0.00 0.00 175.10 175.21 1x5f s ALA 26 N -3.44 3.17 0.65 1.32 0.00 -1.26 0.07 121.76 122.27 1x5f s ALA 26 Ca 0.32 -2.23 0.33 0.00 0.00 0.00 0.00 51.96 50.38 1x5f s ALA 26 Cb 0.04 -2.45 1.81 0.00 0.00 0.00 0.00 23.12 22.52 1x5f s ALA 26 CO 0.18 -1.65 2.05 1.03 0.00 0.00 0.00 175.76 177.37 1x5f h SER 27 N 8.21 0.00 -4.26 0.00 0.87 -1.11 -3.43 113.55 113.83 1x5f h SER 27 Ca -0.19 0.00 0.09 0.00 -1.23 0.00 0.00 61.79 60.46 1x5f h SER 27 Cb 1.07 0.00 -0.21 0.00 -0.44 0.00 0.00 62.40 62.82 1x5f h SER 27 CO 0.70 0.00 0.53 -0.22 -0.53 0.00 0.00 176.83 177.32 1x5f s LEU 28 N -6.25 -0.37 -0.32 2.23 0.20 -1.10 -4.96 118.68 108.10 1x5f s LEU 28 Ca -0.04 0.31 0.02 0.00 0.69 0.00 0.00 54.13 55.11 1x5f s LEU 28 Cb 0.11 1.90 0.10 0.00 -0.43 0.00 0.00 46.19 47.87 1x5f s LEU 28 CO 0.37 -0.40 0.07 -0.69 -0.29 0.00 0.00 176.35 175.40 1x5f s VAL 29 N -1.58 1.61 0.57 1.68 1.01 -1.26 0.99 120.40 123.42 1x5f s VAL 29 Ca -0.00 -1.89 -0.06 0.00 0.00 0.00 0.00 61.98 60.03 1x5f s VAL 29 Cb -0.01 -2.20 -0.00 0.00 0.00 0.00 0.00 36.38 34.17 1x5f s VAL 29 CO -0.01 -0.63 0.88 -0.55 0.00 0.00 0.00 175.10 174.79 1x5f s SER 30 N 1.24 5.72 0.36 3.32 0.15 0.20 -4.57 113.70 120.12 1x5f s SER 30 Ca 0.10 0.75 0.19 0.00 0.70 0.00 0.00 55.95 57.69 1x5f s SER 30 Cb -0.18 -1.80 0.49 0.00 -1.71 0.00 0.00 66.02 62.81 1x5f s SER 30 CO -0.16 -0.97 1.64 0.71 1.20 0.00 0.00 173.24 175.66 1x5f h THR 31 N -0.09 0.75 -0.01 6.45 1.35 -1.95 -3.23 112.91 116.18 1x5f h THR 31 Ca -0.46 -1.67 0.00 0.00 -0.55 0.00 0.00 66.41 63.73 1x5f h THR 31 Cb 1.25 2.09 0.00 0.00 -1.73 0.00 0.00 68.15 69.75 1x5f h THR 31 CO 0.61 0.36 -0.05 0.54 -0.25 0.00 0.00 175.52 176.73 1x5f n ARG 32 N -3.35 1.02 -3.74 4.72 1.74 -1.26 -1.88 116.66 113.91 1x5f n ARG 32 Ca 0.01 -0.65 -0.08 0.00 -0.77 0.00 0.00 57.85 56.36 1x5f n ARG 32 Cb 0.58 -1.03 0.03 0.00 -1.02 0.00 0.00 32.46 31.02 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 -0.00 -2.19 -3.69 -1.55 1.16 -1.22 -0.50 117.46 109.47 1x5f n PHE 33 Ca 0.03 -1.74 -0.10 0.00 -1.87 0.00 0.00 57.45 53.77 1x5f n PHE 33 Cb 0.13 0.87 -0.11 0.00 -1.61 0.00 0.00 39.48 38.75 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 -2.11 -0.18 -0.11 1.97 1.01 -0.95 0.62 121.20 121.46 1x5f s ILE 34 Ca 0.17 0.13 -0.26 0.00 0.00 0.00 0.00 60.65 60.68 1x5f s ILE 34 Cb -0.05 -0.59 -0.02 0.00 0.01 0.00 0.00 42.46 41.82 1x5f s ILE 34 CO 0.11 0.05 0.85 -0.75 0.00 0.00 0.00 174.94 175.20 1x5f s LYS 35 N 1.70 4.39 0.12 2.79 2.47 0.28 -2.47 119.74 129.02 1x5f s LYS 35 Ca -0.07 1.10 0.07 0.00 -1.56 0.00 0.00 55.97 55.51 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 -0.12 -0.18 -0.05 -0.51 0.16 0.00 0.00 175.35 174.65 1x5f s LEU 36 N 1.61 3.22 -0.20 5.43 2.01 -0.34 -0.60 118.68 129.81 1x5f s LEU 36 Ca 0.42 -0.34 -0.13 0.00 0.01 0.00 0.00 54.13 54.08 1x5f s LEU 36 Cb -0.18 -1.96 0.06 0.00 0.01 0.00 0.00 46.19 44.13 1x5f s LEU 36 CO 0.17 0.15 0.50 0.42 1.01 0.00 0.00 176.35 178.60 1x5f s THR 37 N -1.40 -0.01 0.23 5.49 -4.23 0.11 -2.29 115.64 113.54 1x5f s THR 37 Ca 0.24 0.05 -0.06 0.00 -1.18 0.00 0.00 61.69 60.74 1x5f s THR 37 Cb -0.11 -0.73 -0.02 0.00 1.34 0.00 0.00 72.50 72.98 1x5f s THR 37 CO 0.16 0.02 0.30 -1.66 -0.54 0.00 0.00 174.62 172.90 1x5f s TRP 38 N 1.13 0.82 0.55 3.99 -2.14 -0.76 -0.81 118.94 121.72 1x5f s TRP 38 Ca -0.07 -1.10 0.09 0.00 2.66 0.00 0.00 56.10 57.68 1x5f s TRP 38 Cb -0.06 -0.22 0.07 0.00 -3.10 0.00 0.00 33.47 30.16 1x5f s TRP 38 CO -0.11 -0.82 0.69 -0.98 -2.66 0.00 0.00 176.95 173.08 1x5f s ARG 39 N -4.04 2.34 0.40 3.25 1.70 -0.35 -4.71 118.95 117.54 1x5f s ARG 39 Ca 0.32 -1.68 -0.25 0.00 -0.47 0.00 0.00 55.73 53.64 1x5f s ARG 39 Cb 0.03 -2.55 -0.08 0.00 -0.57 0.00 0.00 34.95 31.78 1x5f s ARG 39 CO 0.11 -0.76 1.15 0.95 -1.08 0.00 0.00 175.30 175.68 1x5f s THR 40 N -2.66 3.24 0.46 4.99 -4.23 -1.26 -3.71 115.64 112.47 1x5f s THR 40 Ca 0.56 1.02 -0.23 0.00 -1.18 0.00 0.00 61.69 61.86 1x5f s THR 40 Cb -0.05 -3.56 -0.07 0.00 1.34 0.00 0.00 72.50 70.15 1x5f s THR 40 CO 0.35 0.08 1.16 -2.16 -0.54 0.00 0.00 174.62 173.51 1x5f s PRO 41 N -2.34 3.74 0.40 3.99 0.04 -1.12 -4.46 135.00 135.25 1x5f s PRO 41 Ca 0.57 1.77 0.17 0.00 0.04 0.00 0.00 61.00 63.55 1x5f s PRO 41 Cb -0.29 -2.39 1.07 0.00 0.04 0.00 0.00 34.50 32.94 1x5f s PRO 41 CO 0.37 -0.57 1.81 0.00 0.04 0.00 0.00 177.00 178.65 1x5f h ALA 42 N 2.00 2.20 -0.35 8.56 0.00 -1.82 0.40 119.26 130.25 1x5f h ALA 42 Ca -0.49 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.38 1x5f h ALA 42 Cb 1.25 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 1x5f h ALA 42 CO 0.60 -0.54 -0.08 1.03 0.00 0.00 0.00 179.25 180.26 1x5f h SER 43 N 0.42 0.67 -3.70 0.00 0.87 -1.91 -3.40 113.55 106.51 1x5f h SER 43 Ca 0.54 -0.36 -0.65 0.00 -1.23 0.00 0.00 61.79 60.09 1x5f h SER 43 Cb 1.33 -0.18 -0.39 0.00 -0.44 0.00 0.00 62.40 62.72 1x5f h SER 43 CO -0.24 0.88 -0.76 -1.81 -0.53 0.00 0.00 176.83 174.36 1x5f s ASP 44 N -6.27 4.47 0.53 6.23 1.11 0.13 -4.97 116.67 117.90 1x5f s ASP 44 Ca -0.13 -1.72 0.33 0.00 0.18 0.00 0.00 52.55 51.21 1x5f s ASP 44 Cb 0.09 -1.48 1.37 0.00 1.07 0.00 0.00 42.92 43.98 1x5f s ASP 44 CO 0.80 -0.30 1.97 1.55 1.18 0.00 0.00 175.17 180.37 1x5f h PRO 45 N 7.75 0.00 0.00 8.23 0.13 -1.77 -2.94 132.00 143.39 1x5f h PRO 45 Ca -0.12 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.87 1x5f h PRO 45 Cb 1.03 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.14 1x5f h PRO 45 CO 0.48 0.00 -1.78 0.72 -0.23 0.00 0.00 178.00 177.19 1x5f n HIS 46 N -3.00 0.00 -2.74 1.56 8.25 -1.26 -4.80 115.22 113.23 1x5f n HIS 46 Ca 0.01 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.32 1x5f n HIS 46 Cb 0.29 -0.51 -0.03 0.00 1.12 0.00 0.00 29.99 30.86 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 2.03 -0.30 0.01 -1.41 0.00 -1.18 -4.67 105.19 99.67 1x5f n GLY 47 Ca -0.14 0.02 0.11 0.00 0.00 0.00 0.00 46.02 46.02 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 -1.22 0.80 -1.00 1.61 2.03 -1.26 -3.91 116.55 113.60 1x5f n ASP 48 Ca 0.04 -0.68 0.08 0.00 0.52 0.00 0.00 54.79 54.75 1x5f n ASP 48 Cb 0.32 0.66 0.26 0.00 -0.72 0.00 0.00 41.12 41.64 1x5f n ASP 48 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1x5f n ASN 49 N -1.47 3.93 -3.79 1.67 3.02 -1.26 -4.65 115.26 112.70 1x5f n ASN 49 Ca 0.05 -2.69 -0.13 0.00 -0.03 0.00 0.00 54.58 51.78 1x5f n ASN 49 Cb 0.33 -0.48 -0.13 0.00 -0.61 0.00 0.00 39.78 38.89 1x5f n ASN 49 CO 0.00 0.00 0.00 -1.48 -2.62 0.00 0.00 177.26 173.16 1x5f s LEU 50 N -2.26 1.13 0.99 3.41 0.05 -1.26 -4.41 118.68 116.34 1x5f s LEU 50 Ca 0.40 0.37 -0.16 0.00 0.05 0.00 0.00 54.13 54.79 1x5f s LEU 50 Cb 0.29 0.59 0.21 0.00 -2.05 0.00 0.00 46.19 45.24 1x5f s LEU 50 CO 0.13 -0.09 1.29 -0.89 -0.55 0.00 0.00 176.35 176.25 1x5f s THR 51 N 0.37 1.95 -0.05 5.48 2.01 0.12 -2.18 115.64 123.34 1x5f s THR 51 Ca -0.02 0.00 -0.01 0.00 0.31 0.00 0.00 61.69 61.97 1x5f s THR 51 Cb -0.04 -2.94 0.03 0.00 0.01 0.00 0.00 72.50 69.57 1x5f s THR 51 CO -0.02 0.00 0.01 -0.31 -0.69 0.00 0.00 174.62 173.62 1x5f s TYR 52 N -3.77 0.40 0.03 4.92 2.02 -1.26 -0.96 117.35 118.73 1x5f s TYR 52 Ca 0.73 -0.01 0.00 0.00 -0.37 0.00 0.00 57.07 57.43 1x5f s TYR 52 Cb -0.05 -0.57 -0.04 0.00 -0.40 0.00 0.00 41.96 40.91 1x5f s TYR 52 CO 0.53 -0.21 0.13 -1.12 -1.57 0.00 0.00 175.55 173.31 1x5f s SER 53 N 1.58 5.93 -0.17 2.29 0.01 0.01 -2.75 113.70 120.59 1x5f s SER 53 Ca -0.02 0.18 -0.01 0.00 1.31 0.00 0.00 55.95 57.41 1x5f s SER 53 Cb -0.13 -1.74 0.04 0.00 0.21 0.00 0.00 66.02 64.40 1x5f s SER 53 CO -0.03 0.22 -0.05 -0.69 0.41 0.00 0.00 173.24 173.11 1x5f s VAL 54 N -1.34 1.10 -0.30 3.43 1.01 -1.18 -0.74 120.40 122.39 1x5f s VAL 54 Ca 0.28 -0.66 -0.11 0.00 0.00 0.00 0.00 61.98 61.49 1x5f s VAL 54 Cb -0.12 -1.30 -0.04 0.00 0.00 0.00 0.00 36.38 34.92 1x5f s VAL 54 CO 0.20 0.10 0.19 -0.36 0.00 0.00 0.00 175.10 175.23 1x5f s PHE 55 N 1.63 3.21 0.09 5.22 0.40 0.60 -1.75 117.98 127.37 1x5f s PHE 55 Ca 0.00 -0.06 0.10 0.00 -0.60 0.00 0.00 56.93 56.37 1x5f s PHE 55 Cb -0.16 -2.39 -0.03 0.00 0.51 0.00 0.00 43.02 40.95 1x5f s PHE 55 CO -0.08 -0.25 -0.27 1.52 0.70 0.00 0.00 175.22 176.85 1x5f s TYR 56 N 1.73 2.31 -0.02 0.36 1.13 -1.02 -0.06 117.35 121.78 1x5f s TYR 56 Ca 0.07 -0.40 -0.29 0.00 -1.41 0.00 0.00 57.07 55.04 1x5f s TYR 56 Cb -0.16 -1.32 0.11 0.00 -1.10 0.00 0.00 41.96 39.48 1x5f s TYR 56 CO 0.10 0.24 0.91 -0.08 -2.51 0.00 0.00 175.55 174.21 1x5f s THR 57 N -0.94 0.00 0.35 -3.49 -1.32 -1.19 -2.50 115.64 106.56 1x5f s THR 57 Ca 0.13 0.00 -0.27 0.00 -1.21 0.00 0.00 61.69 60.34 1x5f s THR 57 Cb -0.10 -1.00 -0.09 0.00 -1.51 0.00 0.00 72.50 69.80 1x5f s THR 57 CO 0.04 0.00 1.13 -0.54 -2.21 0.00 0.00 174.62 173.04 1x5f s LYS 58 N -3.00 4.30 0.30 7.08 1.02 -1.26 -0.79 119.74 127.39 1x5f s LYS 58 Ca 0.05 1.79 0.17 0.00 0.02 0.00 0.00 55.97 58.00 1x5f s LYS 58 Cb -0.01 -2.85 0.93 0.00 -0.52 0.00 0.00 37.83 35.38 1x5f s LYS 58 CO -0.08 -0.09 1.48 -0.85 -0.92 0.00 0.00 175.35 174.88 1x5f n GLU 59 N 0.47 0.11 -0.05 1.68 0.28 -1.25 -1.94 120.64 119.93 1x5f n GLU 59 Ca 0.02 0.60 -0.07 0.00 -0.16 0.00 0.00 57.16 57.55 1x5f n GLU 59 Cb 0.46 -1.98 -0.06 0.00 1.43 0.00 0.00 31.44 31.28 1x5f n GLU 59 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1x5f n GLY 60 N -1.30 -0.31 3.74 -1.84 0.00 -1.26 -5.00 105.19 99.23 1x5f n GLY 60 Ca -0.01 -0.12 -0.41 0.00 0.00 0.00 0.00 46.02 45.49 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 -2.24 3.87 -0.58 -0.61 -1.09 -0.82 -4.94 121.20 114.80 1x5f s ILE 61 Ca -0.11 1.71 0.10 0.00 -2.23 0.00 0.00 60.65 60.12 1x5f s ILE 61 Cb 0.04 -4.09 0.57 0.00 -1.58 0.00 0.00 42.46 37.40 1x5f s ILE 61 CO 0.33 0.34 1.38 0.00 -1.23 0.00 0.00 174.94 175.76 1x5f n ALA 62 N 1.98 3.41 -3.60 9.38 0.00 -1.26 -4.19 120.51 126.23 1x5f n ALA 62 Ca 0.01 -1.32 -0.35 0.00 0.00 0.00 0.00 53.44 51.78 1x5f n ALA 62 Cb 0.46 -1.08 -0.14 0.00 0.00 0.00 0.00 19.45 18.69 1x5f n ALA 62 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1x5f s ARG 63 N -2.18 3.06 0.13 0.00 0.52 -1.26 -5.10 118.95 114.12 1x5f s ARG 63 Ca 0.38 -0.83 0.09 0.00 -0.52 0.00 0.00 55.73 54.85 1x5f s ARG 63 Cb 0.29 -3.02 -0.04 0.00 0.52 0.00 0.00 34.95 32.70 1x5f s ARG 63 CO 0.12 -0.33 -0.21 -1.83 0.02 0.00 0.00 175.30 173.07 1x5f s GLU 64 N 1.40 1.24 0.07 3.54 1.03 -1.26 -4.48 118.70 120.24 1x5f s GLU 64 Ca 0.03 -1.29 0.07 0.00 0.03 0.00 0.00 54.97 53.81 1x5f s GLU 64 Cb -0.16 -1.49 -0.03 0.00 -0.80 0.00 0.00 34.13 31.65 1x5f s GLU 64 CO -0.04 0.34 -0.19 1.03 -1.33 0.00 0.00 175.26 175.06 1x5f s ARG 65 N -2.23 1.16 -0.04 -4.83 0.52 -1.04 -4.94 118.95 107.55 1x5f s ARG 65 Ca 0.11 -1.03 -0.05 0.00 -0.52 0.00 0.00 55.73 54.25 1x5f s ARG 65 Cb -0.09 -1.32 -0.04 0.00 0.52 0.00 0.00 34.95 34.02 1x5f s ARG 65 CO 0.06 0.32 0.18 0.54 0.02 0.00 0.00 175.30 176.42 1x5f s VAL 66 N -1.02 5.44 -0.27 3.52 0.11 -1.26 -2.43 120.40 124.49 1x5f s VAL 66 Ca 0.05 -0.00 -0.00 0.00 -2.93 0.00 0.00 61.98 59.10 1x5f s VAL 66 Cb -0.09 -3.50 0.08 0.00 -1.53 0.00 0.00 36.38 31.34 1x5f s VAL 66 CO 0.03 0.42 0.04 -0.70 -3.33 0.00 0.00 175.10 171.56 1x5f s GLU 67 N -1.63 1.04 0.02 1.54 -6.30 -0.72 -4.92 118.70 107.73 1x5f s GLU 67 Ca 0.23 -1.04 -0.30 0.00 -2.50 0.00 0.00 54.97 51.36 1x5f s GLU 67 Cb -0.13 -2.33 -0.05 0.00 0.00 0.00 0.00 34.13 31.62 1x5f s GLU 67 CO 0.14 -0.82 1.30 -0.80 0.02 0.00 0.00 175.26 175.10 1x5f s ASN 68 N 1.51 6.95 0.11 -1.70 0.01 -1.26 -3.13 114.94 117.42 1x5f s ASN 68 Ca 0.04 2.04 -0.34 0.00 -0.71 0.00 0.00 52.86 53.89 1x5f s ASN 68 Cb -0.18 -2.57 -0.14 0.00 0.41 0.00 0.00 41.25 38.78 1x5f s ASN 68 CO -0.15 -0.62 1.62 0.35 -1.51 0.00 0.00 177.10 176.79 1x5f n THR 69 N 4.39 0.10 -0.48 1.60 -2.24 -1.11 -4.78 114.28 111.76 1x5f n THR 69 Ca 0.11 -0.02 0.38 0.00 -2.27 0.00 0.00 64.05 62.26 1x5f n THR 69 Cb 0.45 -1.55 0.61 0.00 -2.10 0.00 0.00 70.33 67.74 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 3.92 0.10 -4.00 3.42 2.88 -1.26 -4.18 113.62 114.50 1x5f n SER 70 Ca 0.18 1.00 -0.14 0.00 -1.33 0.00 0.00 58.87 58.58 1x5f n SER 70 Cb 0.28 -0.50 -0.13 0.00 -0.75 0.00 0.00 64.21 63.12 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 -4.77 0.53 0.10 0.66 3.76 -1.26 -5.13 115.29 109.18 1x5f s HIS 71 Ca -0.05 -0.26 -0.31 0.00 -0.15 0.00 0.00 55.06 54.29 1x5f s HIS 71 Cb 0.24 -0.33 -0.08 0.00 1.11 0.00 0.00 32.58 33.52 1x5f s HIS 71 CO 0.70 -0.04 1.37 -1.25 -0.85 0.00 0.00 174.74 174.67 1x5f s PRO 72 N -0.72 4.33 0.00 8.40 0.04 -1.26 -2.92 135.00 142.87 1x5f s PRO 72 Ca -0.03 2.04 0.00 0.00 0.04 0.00 0.00 61.00 63.04 1x5f s PRO 72 Cb -0.05 -3.28 0.00 0.00 0.04 0.00 0.00 34.50 31.21 1x5f s PRO 72 CO 0.00 -0.43 0.00 0.41 0.04 0.00 0.00 177.00 177.02 1x5f n GLY 73 N 3.48 2.87 3.58 0.56 0.00 -0.93 -4.86 105.19 109.90 1x5f n GLY 73 Ca 0.11 0.00 -0.64 0.00 0.00 0.00 0.00 46.02 45.50 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 -0.53 0.00 -0.41 1.61 2.13 -1.15 -4.78 120.64 117.51 1x5f n GLU 74 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1x5f n GLU 74 Cb 0.00 -1.46 0.15 0.00 0.27 0.00 0.00 31.44 30.40 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 3.21 2.42 -3.62 5.31 2.81 -1.26 -4.82 117.12 121.16 1x5f n MET 75 Ca 0.27 -1.32 -0.10 0.00 -1.81 0.00 0.00 57.70 54.74 1x5f n MET 75 Cb -0.02 -1.76 -0.07 0.00 -0.71 0.00 0.00 33.22 30.67 1x5f n MET 75 CO 0.00 0.00 0.00 1.14 1.51 0.00 0.00 175.97 178.62 1x5f s GLN 76 N -1.67 0.55 0.11 0.03 -2.07 -1.26 -1.84 119.66 113.50 1x5f s GLN 76 Ca 0.23 0.53 -0.05 0.00 -1.82 0.00 0.00 55.36 54.25 1x5f s GLN 76 Cb 0.18 0.26 -0.02 0.00 -1.09 0.00 0.00 33.01 32.34 1x5f s GLN 76 CO 0.06 -0.09 0.11 0.54 -1.32 0.00 0.00 175.29 174.60 1x5f s VAL 77 N -0.04 0.14 -0.08 3.63 0.11 -0.97 -4.97 120.40 118.22 1x5f s VAL 77 Ca 0.02 -1.59 0.04 0.00 -2.93 0.00 0.00 61.98 57.52 1x5f s VAL 77 Cb -0.04 -1.68 -0.01 0.00 -1.53 0.00 0.00 36.38 33.12 1x5f s VAL 77 CO -0.04 -0.62 -0.20 -0.89 -3.33 0.00 0.00 175.10 170.01 1x5f s THR 78 N -3.95 2.46 -0.54 5.04 2.01 -1.26 -1.20 115.64 118.20 1x5f s THR 78 Ca 0.13 -0.90 -0.02 0.00 0.31 0.00 0.00 61.69 61.21 1x5f s THR 78 Cb 0.06 -1.95 0.14 0.00 0.01 0.00 0.00 72.50 70.76 1x5f s THR 78 CO -0.05 0.56 0.34 -0.63 -0.69 0.00 0.00 174.62 174.15 1x5f s ILE 79 N -0.02 3.42 0.78 1.82 -1.09 -1.03 -4.98 121.20 120.10 1x5f s ILE 79 Ca -0.06 -2.72 -0.05 0.00 -2.23 0.00 0.00 60.65 55.59 1x5f s ILE 79 Cb -0.15 -3.28 0.14 0.00 -1.58 0.00 0.00 42.46 37.59 1x5f s ILE 79 CO 0.05 -0.81 1.08 -1.10 -1.23 0.00 0.00 174.94 172.93 1x5f s GLN 80 N 0.29 1.45 -0.53 2.79 -0.21 -1.26 -2.24 119.66 119.94 1x5f s GLN 80 Ca 0.14 -0.88 -0.02 0.00 0.02 0.00 0.00 55.36 54.63 1x5f s GLN 80 Cb -0.21 -2.20 0.00 0.00 1.00 0.00 0.00 33.01 31.60 1x5f s GLN 80 CO -0.03 -1.68 0.45 0.09 -2.12 0.00 0.00 175.29 172.00 1x5f n ASN 81 N -3.08 -2.75 -4.57 5.90 3.02 -0.59 -4.90 115.26 108.28 1x5f n ASN 81 Ca 0.15 -0.25 -0.26 0.00 -0.03 0.00 0.00 54.58 54.19 1x5f n ASN 81 Cb 0.60 -2.44 -0.10 0.00 -0.61 0.00 0.00 39.78 37.23 1x5f n ASN 81 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1x5f s LEU 82 N -3.77 2.80 -0.12 3.41 1.43 0.34 -5.01 118.68 117.75 1x5f s LEU 82 Ca 0.10 -1.17 -0.06 0.00 -1.03 0.00 0.00 54.13 51.97 1x5f s LEU 82 Cb -0.04 -1.07 -0.04 0.00 0.03 0.00 0.00 46.19 45.07 1x5f s LEU 82 CO 0.31 -0.23 0.09 -0.32 0.23 0.00 0.00 176.35 176.43 1x5f s MET 83 N -3.64 3.43 0.62 1.70 -2.45 -1.26 -4.34 119.30 113.36 1x5f s MET 83 Ca 0.33 -0.24 -0.17 0.00 -1.25 0.00 0.00 55.69 54.37 1x5f s MET 83 Cb 0.02 -3.10 -0.02 0.00 1.25 0.00 0.00 34.83 32.98 1x5f s MET 83 CO 0.17 0.67 1.12 -1.25 1.05 0.00 0.00 175.02 176.78 1x5f s PRO 84 N -0.73 3.00 -1.50 4.11 0.04 -0.79 -3.55 135.00 135.58 1x5f s PRO 84 Ca 0.13 1.47 -0.12 0.00 0.04 0.00 0.00 61.00 62.51 1x5f s PRO 84 Cb -0.12 -1.97 0.07 0.00 0.04 0.00 0.00 34.50 32.52 1x5f s PRO 84 CO 0.03 -1.10 0.98 0.00 0.04 0.00 0.00 177.00 176.95 1x5f n ALA 85 N -2.02 -1.35 -3.66 8.56 0.00 -1.13 -4.84 120.51 116.08 1x5f n ALA 85 Ca 0.11 0.19 -0.22 0.00 0.00 0.00 0.00 53.44 53.51 1x5f n ALA 85 Cb 0.52 -4.40 -0.18 0.00 0.00 0.00 0.00 19.45 15.39 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 -0.07 0.50 0.00 2.01 -1.23 -4.92 115.64 108.60 1x5f s THR 86 Ca 0.61 0.21 -0.23 0.00 0.31 0.00 0.00 61.69 62.59 1x5f s THR 86 Cb -0.30 -0.32 -0.06 0.00 0.01 0.00 0.00 72.50 71.83 1x5f s THR 86 CO 0.82 0.03 1.33 -0.69 -0.69 0.00 0.00 174.62 175.42 1x5f s VAL 87 N 2.15 2.29 0.01 3.82 1.01 -1.26 -3.51 120.40 124.90 1x5f s VAL 87 Ca 0.04 0.23 -0.01 0.00 0.00 0.00 0.00 61.98 62.24 1x5f s VAL 87 Cb -0.13 -3.12 -0.01 0.00 0.00 0.00 0.00 36.38 33.12 1x5f s VAL 87 CO -0.05 0.01 0.00 -0.31 0.00 0.00 0.00 175.10 174.75 1x5f s TYR 88 N -1.32 0.12 -0.52 5.22 2.02 0.68 -3.93 117.35 119.63 1x5f s TYR 88 Ca 0.67 -0.25 -0.11 0.00 -0.37 0.00 0.00 57.07 57.01 1x5f s TYR 88 Cb -0.39 -0.09 0.13 0.00 -0.40 0.00 0.00 41.96 41.21 1x5f s TYR 88 CO 0.47 -0.12 0.42 0.42 -1.57 0.00 0.00 175.55 175.17 1x5f s ILE 89 N -0.80 4.59 0.08 2.71 -1.09 0.03 -0.67 121.20 126.05 1x5f s ILE 89 Ca -0.09 -1.77 -0.20 0.00 -2.23 0.00 0.00 60.65 56.36 1x5f s ILE 89 Cb -0.05 -3.98 -0.07 0.00 -1.58 0.00 0.00 42.46 36.78 1x5f s ILE 89 CO -0.00 -0.82 0.59 -0.36 -1.23 0.00 0.00 174.94 173.12 1x5f s PHE 90 N 1.33 3.81 -0.14 3.97 0.40 0.26 -3.15 117.98 124.46 1x5f s PHE 90 Ca 0.06 1.31 -0.02 0.00 -0.60 0.00 0.00 56.93 57.68 1x5f s PHE 90 Cb -0.26 -2.54 0.04 0.00 0.51 0.00 0.00 43.02 40.77 1x5f s PHE 90 CO -0.00 0.56 0.00 1.03 0.70 0.00 0.00 175.22 177.51 1x5f s ARG 91 N -1.02 0.82 0.00 0.44 0.52 0.91 -0.51 118.95 120.11 1x5f s ARG 91 Ca 0.30 -0.22 -0.11 0.00 -0.52 0.00 0.00 55.73 55.18 1x5f s ARG 91 Cb -0.20 -1.62 -0.05 0.00 0.52 0.00 0.00 34.95 33.60 1x5f s ARG 91 CO 0.20 -0.45 0.34 0.08 0.02 0.00 0.00 175.30 175.48 1x5f s VAL 92 N 1.86 5.17 0.05 3.52 1.01 -1.26 -0.29 120.40 130.46 1x5f s VAL 92 Ca 0.02 0.52 -0.08 0.00 0.00 0.00 0.00 61.98 62.44 1x5f s VAL 92 Cb -0.15 -3.62 -0.00 0.00 0.00 0.00 0.00 36.38 32.61 1x5f s VAL 92 CO -0.07 0.47 0.16 -0.32 0.00 0.00 0.00 175.10 175.34 1x5f s MET 93 N -1.42 0.70 0.15 2.72 0.00 0.08 0.33 119.30 121.87 1x5f s MET 93 Ca 0.26 -0.77 0.04 0.00 0.00 0.00 0.00 55.69 55.22 1x5f s MET 93 Cb -0.15 0.28 -0.04 0.00 0.00 0.00 0.00 34.83 34.93 1x5f s MET 93 CO 0.14 -0.20 0.16 0.00 0.00 0.00 0.00 175.02 175.12 1x5f s ALA 94 N -2.97 3.66 -0.10 4.11 0.00 -1.26 -0.81 121.76 124.39 1x5f s ALA 94 Ca -0.02 -1.15 -0.04 0.00 0.00 0.00 0.00 51.96 50.75 1x5f s ALA 94 Cb 0.01 -1.47 0.05 0.00 0.00 0.00 0.00 23.12 21.71 1x5f s ALA 94 CO -0.06 0.54 0.20 -0.65 0.00 0.00 0.00 175.76 175.79 1x5f s GLN 95 N -3.06 0.11 0.24 0.00 -0.21 -0.13 -3.05 119.66 113.56 1x5f s GLN 95 Ca 0.32 0.57 0.01 0.00 0.02 0.00 0.00 55.36 56.28 1x5f s GLN 95 Cb -0.10 -0.15 0.01 0.00 1.00 0.00 0.00 33.01 33.76 1x5f s GLN 95 CO 0.24 -0.24 0.04 0.27 -2.12 0.00 0.00 175.29 173.48 1x5f n ASN 96 N 4.89 2.48 0.28 5.90 0.23 -1.06 0.13 115.26 128.12 1x5f n ASN 96 Ca -0.14 -2.02 0.09 0.00 -0.53 0.00 0.00 54.58 51.99 1x5f n ASN 96 Cb 0.51 0.13 0.39 0.00 -2.08 0.00 0.00 39.78 38.72 1x5f n ASN 96 CO 0.00 0.00 0.00 0.07 -0.93 0.00 0.00 177.26 176.40 1x5f h LYS 97 N 0.00 0.00 0.00 -3.83 5.09 -2.02 -1.75 116.57 114.06 1x5f h LYS 97 Ca -0.19 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.55 1x5f h LYS 97 Cb 0.60 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.93 1x5f h LYS 97 CO 0.32 0.00 -0.02 0.45 -2.09 0.00 0.00 179.45 178.11 1x5f h HIS 98 N 0.00 0.00 0.00 0.07 3.86 -1.93 -3.51 115.15 113.64 1x5f h HIS 98 Ca 0.05 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.26 1x5f h HIS 98 Cb 1.51 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.98 1x5f h HIS 98 CO 0.00 0.00 0.00 0.41 0.86 0.00 0.00 177.93 179.20 1x5f n GLY 99 N 1.91 -0.66 3.61 2.45 0.00 -0.66 -5.09 105.19 106.76 1x5f n GLY 99 Ca -0.00 -0.43 -0.41 0.00 0.00 0.00 0.00 46.02 45.17 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 6.59 0.00 1.61 1.04 -1.26 -2.55 113.70 115.13 1x5f s SER 100 Ca 0.00 0.58 0.00 0.00 0.48 0.00 0.00 55.95 57.01 1x5f s SER 100 Cb 0.00 -2.37 0.00 0.00 0.10 0.00 0.00 66.02 63.75 1x5f s SER 100 CO 0.00 -0.54 0.00 0.61 0.98 0.00 0.00 173.24 174.29 1x5f n GLY 101 N 4.27 1.19 3.79 7.32 0.00 -1.17 -4.98 105.19 115.62 1x5f n GLY 101 Ca 0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.68 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 0.48 3.44 -0.10 1.61 2.12 -1.12 -4.98 118.70 120.15 1x5f s GLU 102 Ca 0.00 -0.23 -0.23 0.00 0.36 0.00 0.00 54.97 54.87 1x5f s GLU 102 Cb 0.00 -3.11 -0.03 0.00 0.26 0.00 0.00 34.13 31.25 1x5f s GLU 102 CO 0.00 0.67 0.70 -1.54 -0.54 0.00 0.00 175.26 174.55 1x5f s SER 103 N -0.73 6.94 1.20 -1.70 1.04 -1.26 -2.56 113.70 116.63 1x5f s SER 103 Ca 0.13 1.13 -0.17 0.00 0.48 0.00 0.00 55.95 57.52 1x5f s SER 103 Cb -0.12 -2.41 0.24 0.00 0.10 0.00 0.00 66.02 63.83 1x5f s SER 103 CO 0.03 -0.17 0.57 -1.54 0.98 0.00 0.00 173.24 173.11 1x5f n SER 104 N 4.12 -2.48 -4.77 7.02 3.41 0.15 -4.86 113.62 116.21 1x5f n SER 104 Ca -0.01 -0.29 -0.36 0.00 -0.26 0.00 0.00 58.87 57.95 1x5f n SER 104 Cb 0.51 -1.07 0.00 0.00 -0.26 0.00 0.00 64.21 63.39 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 -2.27 2.80 -0.43 7.33 0.00 -1.26 -4.63 121.76 123.30 1x5f s ALA 105 Ca 0.61 0.94 -0.28 0.00 0.00 0.00 0.00 51.96 53.23 1x5f s ALA 105 Cb -0.17 -3.40 -0.01 0.00 0.00 0.00 0.00 23.12 19.53 1x5f s ALA 105 CO 0.62 -0.82 1.75 -1.25 0.00 0.00 0.00 175.76 176.07 1x5f s PRO 106 N -3.01 3.15 -0.11 0.00 0.04 -1.26 -4.63 135.00 129.17 1x5f s PRO 106 Ca 0.69 1.08 -0.24 0.00 0.04 0.00 0.00 61.00 62.58 1x5f s PRO 106 Cb -0.28 -4.23 -0.03 0.00 0.04 0.00 0.00 34.50 30.00 1x5f s PRO 106 CO 0.33 -2.09 0.74 -1.17 0.04 0.00 0.00 177.00 174.85 1x5f s LEU 107 N 7.34 4.25 -0.48 -3.56 2.96 0.33 -4.87 118.68 124.65 1x5f s LEU 107 Ca 0.73 1.15 -0.19 0.00 -0.22 0.00 0.00 54.13 55.59 1x5f s LEU 107 Cb -0.18 -3.12 0.05 0.00 0.50 0.00 0.00 46.19 43.44 1x5f s LEU 107 CO 0.29 -0.23 0.62 -0.60 -1.32 0.00 0.00 176.35 175.11 1x5f s ARG 108 N 1.39 3.16 -0.14 1.98 3.52 -1.26 -0.57 118.95 127.02 1x5f s ARG 108 Ca 0.37 -0.76 0.01 0.00 -0.13 0.00 0.00 55.73 55.22 1x5f s ARG 108 Cb -0.17 -4.05 -0.00 0.00 -1.56 0.00 0.00 34.95 29.16 1x5f s ARG 108 CO 0.16 -1.15 -0.17 0.08 -0.81 0.00 0.00 175.30 173.40 1x5f s VAL 109 N 2.65 2.54 -0.18 7.11 1.01 0.16 -4.93 120.40 128.76 1x5f s VAL 109 Ca 0.17 -0.83 -0.05 0.00 0.00 0.00 0.00 61.98 61.27 1x5f s VAL 109 Cb -0.18 -2.05 -0.03 0.00 0.00 0.00 0.00 36.38 34.13 1x5f s VAL 109 CO 0.14 0.53 0.00 -0.70 0.00 0.00 0.00 175.10 175.07 1x5f s GLU 110 N 0.64 3.72 1.07 2.72 2.12 -1.26 -0.23 118.70 127.47 1x5f s GLU 110 Ca -0.09 -0.48 -0.18 0.00 0.36 0.00 0.00 54.97 54.58 1x5f s GLU 110 Cb -0.16 -3.05 0.26 0.00 0.26 0.00 0.00 34.13 31.44 1x5f s GLU 110 CO 0.02 0.15 0.96 0.25 -0.54 0.00 0.00 175.26 176.10 1x5f n THR 111 N 3.84 0.00 -4.06 -1.70 -2.24 -1.23 -4.93 114.28 103.95 1x5f n THR 111 Ca -0.17 -0.43 -0.36 0.00 -2.27 0.00 0.00 64.05 60.82 1x5f n THR 111 Cb 0.52 -1.21 -0.08 0.00 -2.10 0.00 0.00 70.33 67.46 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 -5.17 3.34 -0.54 -0.78 -0.21 -1.26 -3.83 119.66 111.21 1x5f s GLN 112 Ca 0.62 -0.25 -0.27 0.00 0.02 0.00 0.00 55.36 55.48 1x5f s GLN 112 Cb -0.06 -3.06 -0.02 0.00 1.00 0.00 0.00 33.01 30.87 1x5f s GLN 112 CO 0.47 0.70 1.82 -1.25 -2.12 0.00 0.00 175.29 174.91 1x5f s PRO 113 N -0.83 2.82 0.59 2.91 0.04 -1.26 -2.81 135.00 136.46 1x5f s PRO 113 Ca 0.13 0.79 -0.08 0.00 0.04 0.00 0.00 61.00 61.88 1x5f s PRO 113 Cb -0.12 -4.33 0.13 0.00 0.04 0.00 0.00 34.50 30.22 1x5f s PRO 113 CO 0.03 -2.49 0.28 0.39 0.04 0.00 0.00 177.00 175.26 1x5f n GLU 114 N 8.97 -1.42 -1.68 4.56 -0.58 -1.26 -4.72 120.64 124.51 1x5f n GLU 114 Ca 0.21 -0.48 -0.49 0.00 -0.42 0.00 0.00 57.16 55.98 1x5f n GLU 114 Cb 0.51 -0.83 -0.05 0.00 -0.57 0.00 0.00 31.44 30.50 1x5f n GLU 114 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 1x5f n SER 115 N -2.17 3.35 -4.58 1.62 2.88 -1.26 -4.89 113.62 108.57 1x5f n SER 115 Ca 0.05 0.95 -0.38 0.00 -1.33 0.00 0.00 58.87 58.15 1x5f n SER 115 Cb 0.20 -1.36 0.05 0.00 -0.75 0.00 0.00 64.21 62.35 1x5f n SER 115 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1x5f n GLY 116 N 4.50 -0.62 3.69 0.46 0.00 -1.26 -4.89 105.19 107.06 1x5f n GLY 116 Ca 0.24 -0.13 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 1x5f n GLY 116 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1x5f s PRO 117 N -2.53 4.27 -0.29 1.61 0.04 -1.26 -4.99 135.00 131.85 1x5f s PRO 117 Ca 0.73 2.02 -0.22 0.00 0.04 0.00 0.00 61.00 63.57 1x5f s PRO 117 Cb -0.43 -3.58 0.16 0.00 0.04 0.00 0.00 34.50 30.68 1x5f s PRO 117 CO 0.50 -0.60 1.19 -1.54 0.04 0.00 0.00 177.00 176.58 1x5f s SER 118 N 1.98 -0.27 0.50 6.66 1.04 -1.26 -5.15 113.70 117.19 1x5f s SER 118 Ca 0.65 0.50 -0.23 0.00 0.48 0.00 0.00 55.95 57.35 1x5f s SER 118 Cb -0.33 0.70 -0.07 0.00 0.10 0.00 0.00 66.02 66.43 1x5f s SER 118 CO 0.27 -0.08 1.38 -0.24 0.98 0.00 0.00 173.24 175.55 1x5f n SER 119 N 2.40 2.92 0.00 7.02 2.88 -1.26 -5.26 113.62 122.33 1x5f n SER 119 Ca -0.14 1.04 0.00 0.00 -1.33 0.00 0.00 58.87 58.44 1x5f n SER 119 Cb 0.57 -1.58 0.00 0.00 -0.75 0.00 0.00 64.21 62.44 1x5f n SER 119 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42