#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v5t s SER 2 N 0.00 -0.02 1.05 1.61 0.15 -1.26 -5.16 113.70 110.07 1v5t s SER 2 Ca 0.00 -0.25 -0.12 0.00 0.70 0.00 0.00 55.95 56.29 1v5t s SER 2 Cb 0.00 0.29 0.20 0.00 -1.71 0.00 0.00 66.02 64.80 1v5t s SER 2 CO 0.00 -0.52 0.98 -1.20 1.20 0.00 0.00 173.24 173.70 1v5t n SER 3 N 0.89 -0.89 -2.32 5.45 7.64 -1.26 -5.01 113.62 118.13 1v5t n SER 3 Ca -0.20 0.12 -0.00 0.00 1.01 0.00 0.00 58.87 59.80 1v5t n SER 3 Cb 0.58 -1.34 0.00 0.00 -1.01 0.00 0.00 64.21 62.45 1v5t n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1v5t n GLY 4 N 0.78 -1.90 2.95 0.23 0.00 -1.26 -5.08 105.19 100.90 1v5t n GLY 4 Ca 0.07 -1.54 -0.22 0.00 0.00 0.00 0.00 46.02 44.33 1v5t n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1v5t s SER 5 N -1.35 1.32 -0.57 1.61 0.01 -1.26 -5.09 113.70 108.37 1v5t s SER 5 Ca 0.01 -0.20 -0.27 0.00 1.31 0.00 0.00 55.95 56.80 1v5t s SER 5 Cb -0.00 -0.62 -0.01 0.00 0.21 0.00 0.00 66.02 65.61 1v5t s SER 5 CO 0.01 -0.02 1.69 -0.44 0.41 0.00 0.00 173.24 174.89 1v5t s SER 6 N 0.82 5.65 0.00 2.44 0.01 -1.26 -4.72 113.70 116.64 1v5t s SER 6 Ca -0.12 0.39 0.00 0.00 1.31 0.00 0.00 55.95 57.52 1v5t s SER 6 Cb -0.15 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.54 1v5t s SER 6 CO 0.02 -2.07 0.00 0.61 0.41 0.00 0.00 173.24 172.20 1v5t n GLY 7 N 5.52 0.16 2.84 3.44 0.00 -1.26 -4.94 105.19 110.95 1v5t n GLY 7 Ca 0.17 -2.26 -0.30 0.00 0.00 0.00 0.00 46.02 43.63 1v5t n GLY 7 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1v5t s LEU 8 N 0.00 3.29 0.06 0.99 2.96 -1.26 -5.07 118.68 119.65 1v5t s LEU 8 Ca 0.00 -2.08 -0.30 0.00 -0.22 0.00 0.00 54.13 51.53 1v5t s LEU 8 Cb 0.00 -1.20 -0.05 0.00 0.50 0.00 0.00 46.19 45.44 1v5t s LEU 8 CO 0.00 -0.37 1.16 -2.16 -1.32 0.00 0.00 176.35 173.67 1v5t s PRO 9 N 1.03 4.46 -0.20 0.98 0.04 -1.26 -4.64 135.00 135.40 1v5t s PRO 9 Ca 0.12 1.72 0.01 0.00 0.04 0.00 0.00 61.00 62.89 1v5t s PRO 9 Cb -0.20 -3.36 0.03 0.00 0.04 0.00 0.00 34.50 31.02 1v5t s PRO 9 CO -0.13 -0.21 -0.15 0.42 0.04 0.00 0.00 177.00 176.96 1v5t s ILE 10 N 0.98 1.99 -0.08 0.56 1.01 0.11 -1.77 121.20 124.00 1v5t s ILE 10 Ca 0.57 -1.12 -0.14 0.00 0.00 0.00 0.00 60.65 59.96 1v5t s ILE 10 Cb -0.28 -1.93 -0.05 0.00 0.01 0.00 0.00 42.46 40.21 1v5t s ILE 10 CO 0.29 0.32 0.36 -0.63 0.00 0.00 0.00 174.94 175.27 1v5t s ILE 11 N 1.27 5.19 -0.23 2.92 1.01 -1.21 0.24 121.20 130.38 1v5t s ILE 11 Ca 0.00 0.70 0.00 0.00 0.00 0.00 0.00 60.65 61.36 1v5t s ILE 11 Cb -0.15 -3.67 0.06 0.00 0.01 0.00 0.00 42.46 38.71 1v5t s ILE 11 CO -0.10 0.49 -0.04 -0.69 0.00 0.00 0.00 174.94 174.60 1v5t s VAL 12 N -0.34 1.44 -0.33 2.92 1.01 0.13 -1.03 120.40 124.20 1v5t s VAL 12 Ca 0.21 -1.19 -0.22 0.00 0.00 0.00 0.00 61.98 60.78 1v5t s VAL 12 Cb -0.15 -1.74 0.00 0.00 0.00 0.00 0.00 36.38 34.49 1v5t s VAL 12 CO 0.09 -0.13 0.74 -0.75 0.00 0.00 0.00 175.10 175.04 1v5t s LYS 13 N 1.43 3.84 0.04 2.72 2.47 -0.58 0.26 119.74 129.91 1v5t s LYS 13 Ca -0.05 0.36 0.05 0.00 -1.56 0.00 0.00 55.97 54.78 1v5t s LYS 13 Cb -0.19 -3.77 -0.02 0.00 -1.46 0.00 0.00 37.83 32.39 1v5t s LYS 13 CO -0.07 -0.73 -0.16 -0.46 0.16 0.00 0.00 175.35 174.10 1v5t s TRP 14 N 2.91 1.39 0.00 4.03 -0.00 0.11 -1.67 118.94 125.71 1v5t s TRP 14 Ca 0.30 -0.35 0.00 0.00 -0.00 0.00 0.00 56.10 56.05 1v5t s TRP 14 Cb -0.14 -0.83 0.00 0.00 -0.00 0.00 0.00 33.47 32.50 1v5t s TRP 14 CO 0.14 0.05 0.00 0.41 -0.00 0.00 0.00 176.95 177.55 1v5t n GLY 15 N 1.95 1.45 0.00 5.86 0.00 -1.26 0.19 105.19 113.38 1v5t n GLY 15 Ca -0.17 0.58 0.00 0.00 0.00 0.00 0.00 46.02 46.42 1v5t n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1v5t n GLY 16 N 0.00 1.91 3.37 -0.02 0.00 -1.26 -5.04 105.19 104.14 1v5t n GLY 16 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 1v5t n GLY 16 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1v5t s GLN 17 N -0.79 1.40 0.14 1.61 -1.52 0.13 -5.16 119.66 115.46 1v5t s GLN 17 Ca 0.00 -1.68 0.09 0.00 -1.95 0.00 0.00 55.36 51.82 1v5t s GLN 17 Cb 0.00 -0.95 -0.04 0.00 -0.22 0.00 0.00 33.01 31.80 1v5t s GLN 17 CO 0.00 0.04 -0.21 -1.21 -0.25 0.00 0.00 175.29 173.66 1v5t s GLU 18 N -3.75 1.26 -0.07 2.91 2.02 -1.26 0.09 118.70 119.90 1v5t s GLU 18 Ca 0.26 -1.31 0.05 0.00 0.02 0.00 0.00 54.97 53.99 1v5t s GLU 18 Cb 0.03 -1.49 -0.00 0.00 0.10 0.00 0.00 34.13 32.77 1v5t s GLU 18 CO 0.09 0.33 -0.23 0.71 0.02 0.00 0.00 175.26 176.18 1v5t s TYR 19 N -1.51 2.30 -0.25 1.61 1.51 0.14 -4.93 117.35 116.23 1v5t s TYR 19 Ca 0.12 -0.80 -0.10 0.00 -1.01 0.00 0.00 57.07 55.29 1v5t s TYR 19 Cb -0.08 -1.54 -0.04 0.00 -0.11 0.00 0.00 41.96 40.19 1v5t s TYR 19 CO 0.06 -0.29 0.14 -1.54 -1.11 0.00 0.00 175.55 172.81 1v5t s SER 20 N 0.11 5.82 -0.20 2.29 1.04 -1.26 0.19 113.70 121.68 1v5t s SER 20 Ca -0.10 0.00 -0.05 0.00 0.48 0.00 0.00 55.95 56.28 1v5t s SER 20 Cb -0.15 -2.05 -0.02 0.00 0.10 0.00 0.00 66.02 63.89 1v5t s SER 20 CO 0.05 0.02 -0.01 -0.69 0.98 0.00 0.00 173.24 173.60 1v5t s VAL 21 N 1.32 3.85 -0.15 5.02 1.01 0.14 -4.94 120.40 126.64 1v5t s VAL 21 Ca 0.06 -0.35 0.17 0.00 0.00 0.00 0.00 61.98 61.87 1v5t s VAL 21 Cb -0.15 -2.74 0.37 0.00 0.00 0.00 0.00 36.38 33.86 1v5t s VAL 21 CO 0.06 0.43 1.20 0.35 0.00 0.00 0.00 175.10 177.14 1v5t n THR 22 N 4.32 0.40 -0.09 3.92 -2.24 -1.26 0.06 114.28 119.39 1v5t n THR 22 Ca -0.17 -1.41 -0.17 0.00 -2.27 0.00 0.00 64.05 60.03 1v5t n THR 22 Cb 0.52 1.00 -0.06 0.00 -2.10 0.00 0.00 70.33 69.68 1v5t n THR 22 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1v5t n THR 23 N -0.37 0.94 -2.03 4.28 -1.04 -1.26 -4.96 114.28 109.84 1v5t n THR 23 Ca -0.05 -0.26 -0.29 0.00 -2.04 0.00 0.00 64.05 61.40 1v5t n THR 23 Cb 0.90 -1.60 0.04 0.00 -1.82 0.00 0.00 70.33 67.85 1v5t n THR 23 CO 0.00 0.00 0.00 -1.48 -0.64 0.00 0.00 175.07 172.95 1v5t s LEU 24 N -6.73 3.03 0.37 -4.42 2.34 -1.26 -5.09 118.68 106.92 1v5t s LEU 24 Ca -0.24 1.05 0.05 0.00 0.06 0.00 0.00 54.13 55.06 1v5t s LEU 24 Cb 0.09 -3.88 -0.03 0.00 -0.56 0.00 0.00 46.19 41.81 1v5t s LEU 24 CO 0.32 -1.21 0.20 -0.94 -1.06 0.00 0.00 176.35 173.66 1v5t s SER 25 N -4.32 2.23 0.31 1.48 1.04 -1.26 -4.57 113.70 108.60 1v5t s SER 25 Ca 0.57 -1.72 0.06 0.00 0.48 0.00 0.00 55.95 55.34 1v5t s SER 25 Cb -0.11 0.55 0.85 0.00 0.10 0.00 0.00 66.02 67.41 1v5t s SER 25 CO 0.50 -1.00 1.64 -0.33 0.98 0.00 0.00 173.24 175.03 1v5t h GLU 26 N 1.96 0.20 -0.12 4.02 5.08 -1.94 -0.08 114.58 123.69 1v5t h GLU 26 Ca -0.30 -0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.07 1v5t h GLU 26 Cb 1.25 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 30.42 1v5t h GLU 26 CO 0.47 0.13 -0.34 0.22 -1.00 0.00 0.00 179.01 178.49 1v5t h ASP 27 N 0.20 -1.09 -1.90 1.42 3.58 -1.98 -3.26 116.42 113.40 1v5t h ASP 27 Ca 0.62 0.13 -0.49 0.00 0.42 0.00 0.00 57.03 57.72 1v5t h ASP 27 Cb 1.34 0.43 0.24 0.00 1.72 0.00 0.00 39.33 43.06 1v5t h ASP 27 CO -0.68 -0.29 -1.74 0.47 -2.88 0.00 0.00 179.24 174.13 1v5t n ASP 28 N -4.33 -2.97 -4.63 2.28 9.92 -0.04 -4.73 116.55 112.04 1v5t n ASP 28 Ca -0.03 0.00 -0.26 0.00 -0.53 0.00 0.00 54.79 53.97 1v5t n ASP 28 Cb 0.23 -0.79 -0.09 0.00 -0.64 0.00 0.00 41.12 39.82 1v5t n ASP 28 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 1v5t s THR 29 N -2.14 2.32 0.28 -3.53 -4.23 -1.26 -3.45 115.64 103.63 1v5t s THR 29 Ca 0.47 -1.98 0.00 0.00 -1.18 0.00 0.00 61.69 59.00 1v5t s THR 29 Cb -0.05 -2.86 0.31 0.00 1.34 0.00 0.00 72.50 71.24 1v5t s THR 29 CO 0.68 -0.11 1.64 0.58 -0.54 0.00 0.00 174.62 176.87 1v5t h VAL 30 N 1.77 0.31 -0.58 2.29 2.07 -1.15 0.24 116.25 121.21 1v5t h VAL 30 Ca -0.43 -0.06 0.09 0.00 0.82 0.00 0.00 66.70 67.12 1v5t h VAL 30 Cb 1.25 0.11 -0.11 0.00 -1.52 0.00 0.00 31.29 31.02 1v5t h VAL 30 CO 0.72 0.03 -0.40 0.25 0.02 0.00 0.00 177.57 178.19 1v5t h LEU 31 N 0.18 -1.37 -0.90 2.57 5.85 -0.36 0.70 115.31 121.99 1v5t h LEU 31 Ca 0.52 0.24 0.25 0.00 0.84 0.00 0.00 57.88 59.73 1v5t h LEU 31 Cb 1.03 0.64 -0.15 0.00 0.37 0.00 0.00 40.66 42.55 1v5t h LEU 31 CO -0.67 -0.33 0.19 0.44 -0.34 0.00 0.00 178.44 177.74 1v5t h ASP 32 N -0.21 -0.11 0.22 1.25 3.32 -0.77 1.01 116.42 121.13 1v5t h ASP 32 Ca 0.20 0.22 -0.01 0.00 0.02 0.00 0.00 57.03 57.45 1v5t h ASP 32 Cb 0.56 0.32 0.00 0.00 0.22 0.00 0.00 39.33 40.43 1v5t h ASP 32 CO -0.68 -0.21 -0.11 0.25 -1.72 0.00 0.00 179.24 176.77 1v5t h LEU 33 N 0.15 -0.25 -0.07 1.55 5.85 0.28 -1.04 115.31 121.77 1v5t h LEU 33 Ca 0.56 -0.23 0.03 0.00 0.84 0.00 0.00 57.88 59.08 1v5t h LEU 33 Cb 1.16 0.07 -0.06 0.00 0.37 0.00 0.00 40.66 42.20 1v5t h LEU 33 CO -0.72 0.13 -0.52 0.11 -0.34 0.00 0.00 178.44 177.10 1v5t h LYS 34 N -0.68 -0.59 -0.88 1.25 1.57 0.32 1.18 116.57 118.75 1v5t h LYS 34 Ca -0.03 0.04 0.18 0.00 -1.87 0.00 0.00 60.65 58.96 1v5t h LYS 34 Cb 0.47 0.13 -0.11 0.00 0.08 0.00 0.00 32.23 32.81 1v5t h LYS 34 CO 0.05 -0.39 0.44 1.96 -0.57 0.00 0.00 179.45 180.94 1v5t h GLN 35 N -0.61 0.55 -0.24 3.15 4.20 0.84 0.30 115.11 123.29 1v5t h GLN 35 Ca 0.03 -0.03 -0.11 0.00 0.06 0.00 0.00 58.65 58.60 1v5t h GLN 35 Cb 0.69 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.34 1v5t h GLN 35 CO -0.39 0.36 -0.30 0.35 -0.67 0.00 0.00 178.83 178.18 1v5t h PHE 36 N 0.56 0.55 0.00 2.96 3.57 0.42 -1.79 116.94 123.21 1v5t h PHE 36 Ca 0.51 -0.13 0.00 0.00 3.53 0.00 0.00 57.97 61.88 1v5t h PHE 36 Cb 0.81 -0.13 0.00 0.00 2.79 0.00 0.00 35.95 39.42 1v5t h PHE 36 CO -0.10 0.73 0.00 1.28 -2.23 0.00 0.00 178.31 177.99 1v5t n LEU 37 N -4.09 0.56 0.12 0.59 4.77 0.39 -0.70 117.00 118.64 1v5t n LEU 37 Ca -0.01 0.64 -0.01 0.00 -0.03 0.00 0.00 56.01 56.61 1v5t n LEU 37 Cb 0.44 -0.57 0.02 0.00 -2.33 0.00 0.00 43.42 40.98 1v5t n LEU 37 CO 0.43 -0.52 0.38 0.50 -1.33 0.00 0.00 177.39 176.85 1v5t h LYS 38 N 0.00 0.00 0.00 3.23 3.64 -0.26 -2.56 116.57 120.62 1v5t h LYS 38 Ca 0.00 0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.30 1v5t h LYS 38 Cb 0.34 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.15 1v5t h LYS 38 CO 0.00 0.68 -1.92 -2.37 -2.27 0.00 0.00 179.45 173.56 1v5t n THR 39 N -3.34 0.41 -0.04 1.00 5.66 -0.62 -2.31 114.28 115.05 1v5t n THR 39 Ca 0.01 -0.59 -0.15 0.00 -3.05 0.00 0.00 64.05 60.27 1v5t n THR 39 Cb 0.78 -0.17 -0.08 0.00 -1.55 0.00 0.00 70.33 69.30 1v5t n THR 39 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 175.07 171.95 1v5t h LEU 40 N 0.00 0.49 0.00 1.09 3.38 -0.94 -3.42 115.31 115.92 1v5t h LEU 40 Ca -0.11 -0.60 0.00 0.00 0.09 0.00 0.00 57.88 57.26 1v5t h LEU 40 Cb 1.28 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.88 1v5t h LEU 40 CO 0.01 1.00 -0.24 0.35 0.09 0.00 0.00 178.44 179.65 1v5t n THR 41 N -4.38 0.54 0.00 0.22 -2.24 -0.97 -5.08 114.28 102.38 1v5t n THR 41 Ca -0.07 0.28 0.00 0.00 -2.27 0.00 0.00 64.05 61.99 1v5t n THR 41 Cb 0.50 -1.60 0.00 0.00 -2.10 0.00 0.00 70.33 67.13 1v5t n THR 41 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1v5t n GLY 42 N 2.24 0.67 3.01 3.38 0.00 -0.98 -5.04 105.19 108.48 1v5t n GLY 42 Ca -0.03 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.76 1v5t n GLY 42 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1v5t s VAL 43 N -1.32 0.96 0.62 1.61 1.01 -1.25 -4.38 120.40 117.64 1v5t s VAL 43 Ca 0.00 -0.42 -0.18 0.00 0.00 0.00 0.00 61.98 61.38 1v5t s VAL 43 Cb 0.00 -0.87 -0.12 0.00 0.00 0.00 0.00 36.38 35.39 1v5t s VAL 43 CO 0.00 0.30 0.01 0.18 0.00 0.00 0.00 175.10 175.59 1v5t n LEU 44 N 3.55 -2.44 0.23 3.92 4.77 -1.26 -4.34 117.00 121.43 1v5t n LEU 44 Ca -0.21 0.60 0.12 0.00 -0.03 0.00 0.00 56.01 56.49 1v5t n LEU 44 Cb 0.53 -0.96 0.39 0.00 -2.33 0.00 0.00 43.42 41.05 1v5t n LEU 44 CO 0.25 -4.37 0.84 1.55 -1.33 0.00 0.00 177.39 174.33 1v5t h PRO 45 N -0.15 0.00 0.14 3.23 0.13 -1.92 -0.74 132.00 132.69 1v5t h PRO 45 Ca -0.43 0.00 -0.28 0.00 -0.87 0.00 0.00 66.00 64.42 1v5t h PRO 45 Cb 1.40 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.54 1v5t h PRO 45 CO 0.40 0.10 -1.29 1.05 -0.23 0.00 0.00 178.00 178.03 1v5t h GLU 46 N 0.00 0.30 0.09 0.86 4.11 -1.98 -3.30 114.58 114.66 1v5t h GLU 46 Ca -0.00 -0.52 -0.26 0.00 0.07 0.00 0.00 59.36 58.66 1v5t h GLU 46 Cb 0.83 0.19 -0.01 0.00 0.50 0.00 0.00 28.75 30.26 1v5t h GLU 46 CO 0.01 1.24 -1.18 0.00 0.07 0.00 0.00 179.01 179.16 1v5t h ARG 47 N 0.08 0.19 -6.27 1.06 2.47 -1.88 -3.45 114.38 106.58 1v5t h ARG 47 Ca -0.15 -0.33 -0.58 0.00 -1.26 0.00 0.00 59.98 57.66 1v5t h ARG 47 Cb 2.00 0.12 0.02 0.00 -1.65 0.00 0.00 29.97 30.46 1v5t h ARG 47 CO 0.21 1.16 1.22 1.04 0.56 0.00 0.00 179.97 184.15 1v5t n GLN 48 N -3.48 2.44 -3.61 0.04 6.02 -0.29 -4.58 117.38 113.92 1v5t n GLN 48 Ca -0.06 0.87 -0.39 0.00 -0.01 0.00 0.00 57.00 57.41 1v5t n GLN 48 Cb 1.00 -2.87 -0.11 0.00 1.02 0.00 0.00 30.24 29.28 1v5t n GLN 48 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 1v5t s LYS 49 N 4.59 3.30 -0.50 -1.09 2.36 0.14 -4.92 119.74 123.62 1v5t s LYS 49 Ca 0.93 -0.75 -0.19 0.00 -2.55 0.00 0.00 55.97 53.41 1v5t s LYS 49 Cb -0.54 -3.66 0.06 0.00 -1.05 0.00 0.00 37.83 32.64 1v5t s LYS 49 CO 0.46 -0.47 0.59 -0.51 1.55 0.00 0.00 175.35 176.97 1v5t s LEU 50 N 1.64 5.08 -0.34 5.43 1.43 -1.26 0.17 118.68 130.82 1v5t s LEU 50 Ca 0.05 -0.98 -0.13 0.00 -1.03 0.00 0.00 54.13 52.04 1v5t s LEU 50 Cb -0.17 -2.40 -0.02 0.00 0.03 0.00 0.00 46.19 43.62 1v5t s LEU 50 CO 0.08 -0.85 0.24 -0.22 0.23 0.00 0.00 176.35 175.82 1v5t s LEU 51 N 2.47 4.51 0.00 1.79 2.96 0.14 -4.51 118.68 126.04 1v5t s LEU 51 Ca 0.13 -0.41 0.00 0.00 -0.22 0.00 0.00 54.13 53.64 1v5t s LEU 51 Cb -0.20 -2.14 0.00 0.00 0.50 0.00 0.00 46.19 44.35 1v5t s LEU 51 CO 0.11 -0.23 0.00 0.61 -1.32 0.00 0.00 176.35 175.52 1v5t n GLY 52 N 5.10 0.58 3.13 7.98 0.00 -1.26 0.23 105.19 120.95 1v5t n GLY 52 Ca -0.13 0.09 -0.33 0.00 0.00 0.00 0.00 46.02 45.66 1v5t n GLY 52 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1v5t s LEU 53 N 0.00 2.10 0.33 0.99 2.34 -1.26 -5.08 118.68 118.11 1v5t s LEU 53 Ca 0.00 -0.63 0.03 0.00 0.06 0.00 0.00 54.13 53.59 1v5t s LEU 53 Cb 0.00 -1.46 -0.05 0.00 -0.56 0.00 0.00 46.19 44.12 1v5t s LEU 53 CO 0.00 0.02 0.08 -0.54 -1.06 0.00 0.00 176.35 174.85 1v5t s LYS 54 N 1.16 1.67 -0.30 1.48 1.02 -1.26 -4.59 119.74 118.92 1v5t s LYS 54 Ca 0.02 -1.94 -0.02 0.00 0.02 0.00 0.00 55.97 54.04 1v5t s LYS 54 Cb -0.14 -0.73 0.10 0.00 -0.52 0.00 0.00 37.83 36.54 1v5t s LYS 54 CO -0.10 -0.26 0.11 0.08 -0.92 0.00 0.00 175.35 174.26 1v5t s VAL 55 N -3.35 0.61 -1.22 3.17 1.01 0.47 -4.75 120.40 116.35 1v5t s VAL 55 Ca 0.34 -1.21 -0.32 0.00 0.00 0.00 0.00 61.98 60.79 1v5t s VAL 55 Cb 0.07 -1.47 0.04 0.00 0.00 0.00 0.00 36.38 35.03 1v5t s VAL 55 CO 0.15 -0.68 0.67 0.29 0.00 0.00 0.00 175.10 175.53 1v5t n LYS 56 N 4.96 -0.38 0.00 2.72 5.02 -1.26 -2.38 118.16 126.84 1v5t n LYS 56 Ca -0.03 0.12 0.00 0.00 -2.02 0.00 0.00 58.31 56.37 1v5t n LYS 56 Cb 0.42 -2.74 0.00 0.00 -0.02 0.00 0.00 35.03 32.69 1v5t n LYS 56 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1v5t n GLY 57 N -2.07 2.08 3.90 0.72 0.00 -1.26 -5.00 105.19 103.57 1v5t n GLY 57 Ca -0.12 -0.65 -0.30 0.00 0.00 0.00 0.00 46.02 44.96 1v5t n GLY 57 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1v5t s LYS 58 N 0.00 3.66 0.70 1.61 0.00 -1.00 -4.92 119.74 119.79 1v5t s LYS 58 Ca 0.00 0.02 -0.11 0.00 0.00 0.00 0.00 55.97 55.88 1v5t s LYS 58 Cb 0.00 -2.69 0.01 0.00 0.00 0.00 0.00 37.83 35.15 1v5t s LYS 58 CO 0.00 0.29 1.06 -1.25 0.00 0.00 0.00 175.35 175.45 1v5t s PRO 59 N -3.24 2.91 1.03 1.78 0.04 -1.26 0.18 135.00 136.44 1v5t s PRO 59 Ca 0.44 0.94 -0.17 0.00 0.04 0.00 0.00 61.00 62.25 1v5t s PRO 59 Cb -0.11 -1.99 0.01 0.00 0.04 0.00 0.00 34.50 32.45 1v5t s PRO 59 CO 0.27 -1.11 -0.15 0.00 0.04 0.00 0.00 177.00 176.05 1v5t n ALA 60 N -3.14 -3.98 -1.11 8.56 0.00 -1.26 -4.66 120.51 114.92 1v5t n ALA 60 Ca 0.07 -0.98 -0.29 0.00 0.00 0.00 0.00 53.44 52.25 1v5t n ALA 60 Cb 0.54 -1.48 0.19 0.00 0.00 0.00 0.00 19.45 18.69 1v5t n ALA 60 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1v5t s GLU 61 N -3.16 0.15 0.16 0.00 0.41 -1.26 -4.95 118.70 110.05 1v5t s GLU 61 Ca 0.52 0.48 0.07 0.00 -0.41 0.00 0.00 54.97 55.62 1v5t s GLU 61 Cb -0.13 -1.71 -0.04 0.00 -1.78 0.00 0.00 34.13 30.47 1v5t s GLU 61 CO 0.69 -2.91 1.37 -2.95 -0.49 0.00 0.00 175.26 170.97 1v5t h ASN 62 N -2.02 0.06 -0.77 -0.19 7.08 -1.95 -3.19 115.58 114.60 1v5t h ASN 62 Ca -0.55 -0.06 -0.46 0.00 -3.08 0.00 0.00 56.30 52.15 1v5t h ASN 62 Cb 1.33 -0.02 -0.19 0.00 -2.08 0.00 0.00 38.32 37.37 1v5t h ASN 62 CO 0.57 0.92 0.55 0.47 -2.08 0.00 0.00 177.43 177.86 1v5t n ASP 63 N -3.52 6.82 -4.55 6.14 8.00 -1.26 0.38 116.55 128.56 1v5t n ASP 63 Ca -0.01 -3.30 -0.31 0.00 0.71 0.00 0.00 54.79 51.88 1v5t n ASP 63 Cb 0.84 -1.07 -0.11 0.00 -0.02 0.00 0.00 41.12 40.76 1v5t n ASP 63 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1v5t s VAL 64 N -3.01 3.29 -0.19 2.53 1.01 -1.20 -4.97 120.40 117.85 1v5t s VAL 64 Ca 0.45 -1.08 -0.29 0.00 0.00 0.00 0.00 61.98 61.05 1v5t s VAL 64 Cb 0.34 -2.46 -0.01 0.00 0.00 0.00 0.00 36.38 34.25 1v5t s VAL 64 CO -0.06 0.27 1.29 -0.54 0.00 0.00 0.00 175.10 176.06 1v5t s LYS 65 N -1.72 4.16 0.65 2.72 -0.14 -1.26 -1.87 119.74 122.28 1v5t s LYS 65 Ca 0.18 1.60 0.41 0.00 -1.36 0.00 0.00 55.97 56.80 1v5t s LYS 65 Cb -0.11 -3.80 2.28 0.00 -1.68 0.00 0.00 37.83 34.52 1v5t s LYS 65 CO 0.09 -0.80 2.33 -0.07 -0.76 0.00 0.00 175.35 176.14 1v5t h LEU 66 N 10.01 0.00 0.17 3.17 3.38 -1.62 -0.28 115.31 130.13 1v5t h LEU 66 Ca -0.27 0.00 -0.31 0.00 0.09 0.00 0.00 57.88 57.39 1v5t h LEU 66 Cb 1.11 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.87 1v5t h LEU 66 CO 0.98 0.00 -1.49 1.23 0.09 0.00 0.00 178.44 179.26 1v5t h GLY 67 N 0.00 0.41 1.50 0.83 0.00 -1.83 -3.24 103.07 100.74 1v5t h GLY 67 Ca 0.00 -1.05 0.06 0.00 0.00 0.00 0.00 47.33 46.33 1v5t h GLY 67 CO -0.00 0.92 0.20 0.00 0.00 0.00 0.00 176.54 177.66 1v5t h ALA 68 N 0.36 1.88 0.01 3.60 0.00 -1.36 0.45 119.26 124.20 1v5t h ALA 68 Ca -0.24 -0.01 -0.20 0.00 0.00 0.00 0.00 54.91 54.47 1v5t h ALA 68 Cb 2.06 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.85 1v5t h ALA 68 CO 0.21 -0.30 -0.94 -0.07 0.00 0.00 0.00 179.25 178.16 1v5t h LEU 69 N 0.00 0.07 -2.79 0.00 -0.00 -1.55 -3.48 115.31 107.56 1v5t h LEU 69 Ca 0.09 -0.07 -0.35 0.00 -0.00 0.00 0.00 57.88 57.55 1v5t h LEU 69 Cb 0.48 -0.02 0.13 0.00 -0.00 0.00 0.00 40.66 41.25 1v5t h LEU 69 CO -0.00 0.96 -0.90 0.29 -0.00 0.00 0.00 178.44 178.79 1v5t n LYS 70 N -3.49 -1.93 -1.99 1.13 4.76 0.16 -4.98 118.16 111.81 1v5t n LYS 70 Ca -0.01 0.65 -0.29 0.00 -2.87 0.00 0.00 58.31 55.78 1v5t n LYS 70 Cb 0.87 -4.94 0.20 0.00 -1.84 0.00 0.00 35.03 29.32 1v5t n LYS 70 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1v5t s LEU 71 N -6.02 2.77 0.44 -0.35 1.43 -1.26 -5.06 118.68 110.62 1v5t s LEU 71 Ca 0.44 0.13 -0.08 0.00 -1.03 0.00 0.00 54.13 53.59 1v5t s LEU 71 Cb -0.11 -2.12 -0.05 0.00 0.03 0.00 0.00 46.19 43.93 1v5t s LEU 71 CO 0.81 -2.80 0.77 -0.54 0.23 0.00 0.00 176.35 174.82 1v5t s LYS 72 N -5.88 3.66 0.69 1.70 -0.14 -1.26 -5.07 119.74 113.44 1v5t s LYS 72 Ca 0.75 0.32 -0.11 0.00 -1.36 0.00 0.00 55.97 55.58 1v5t s LYS 72 Cb -0.03 -2.39 0.01 0.00 -1.68 0.00 0.00 37.83 33.74 1v5t s LYS 72 CO 0.53 -0.11 1.06 -1.25 -0.76 0.00 0.00 175.35 174.82 1v5t s PRO 73 N -4.27 2.94 -0.70 -1.68 0.04 -1.26 -3.39 135.00 126.68 1v5t s PRO 73 Ca 0.49 0.96 -0.09 0.00 0.04 0.00 0.00 61.00 62.40 1v5t s PRO 73 Cb -0.10 -1.99 0.08 0.00 0.04 0.00 0.00 34.50 32.53 1v5t s PRO 73 CO 0.38 -1.10 0.22 0.27 0.04 0.00 0.00 177.00 176.81 1v5t n ASN 74 N -3.12 -1.40 -4.57 6.66 6.94 -0.73 -4.73 115.26 114.31 1v5t n ASN 74 Ca 0.08 -0.13 -0.40 0.00 -0.02 0.00 0.00 54.58 54.11 1v5t n ASN 74 Cb 0.53 -1.30 -0.03 0.00 -2.36 0.00 0.00 39.78 36.63 1v5t n ASN 74 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 1v5t s THR 75 N -2.46 3.31 -0.64 5.53 2.01 -1.22 -4.68 115.64 117.48 1v5t s THR 75 Ca 0.30 0.25 -0.27 0.00 0.31 0.00 0.00 61.69 62.28 1v5t s THR 75 Cb -0.17 -3.61 -0.01 0.00 0.01 0.00 0.00 72.50 68.72 1v5t s THR 75 CO 0.37 -0.52 1.74 -0.54 -0.69 0.00 0.00 174.62 174.98 1v5t s LYS 76 N 6.75 2.75 0.54 4.92 1.02 -1.26 -3.36 119.74 131.10 1v5t s LYS 76 Ca 0.79 0.41 -0.01 0.00 0.02 0.00 0.00 55.97 57.19 1v5t s LYS 76 Cb -0.18 -4.36 0.02 0.00 -0.52 0.00 0.00 37.83 32.79 1v5t s LYS 76 CO 0.27 -2.62 0.79 0.96 -0.92 0.00 0.00 175.35 173.83 1v5t s ILE 77 N 8.38 3.09 -0.01 2.17 -5.25 -0.19 -4.93 121.20 124.46 1v5t s ILE 77 Ca 0.60 -0.51 0.01 0.00 -0.99 0.00 0.00 60.65 59.77 1v5t s ILE 77 Cb -0.11 -3.18 -0.04 0.00 2.95 0.00 0.00 42.46 42.08 1v5t s ILE 77 CO 0.19 -0.14 -0.00 -0.32 -1.79 0.00 0.00 174.94 172.88 1v5t s MET 78 N -4.78 2.80 -0.11 0.37 -2.45 0.13 -1.53 119.30 113.73 1v5t s MET 78 Ca 0.55 -0.59 0.01 0.00 -1.25 0.00 0.00 55.69 54.40 1v5t s MET 78 Cb -0.10 -2.68 0.02 0.00 1.25 0.00 0.00 34.83 33.32 1v5t s MET 78 CO 0.40 0.63 -0.12 1.41 1.05 0.00 0.00 175.02 178.39 1v5t s MET 79 N -1.48 1.90 -0.15 4.11 1.75 -0.67 0.24 119.30 124.99 1v5t s MET 79 Ca 0.19 -0.42 0.01 0.00 -1.25 0.00 0.00 55.69 54.22 1v5t s MET 79 Cb -0.11 -1.75 0.02 0.00 2.84 0.00 0.00 34.83 35.82 1v5t s MET 79 CO 0.09 -0.17 -0.17 -1.64 -0.65 0.00 0.00 175.02 172.49 1v5t s MET 80 N 1.32 2.54 0.00 4.11 -1.94 0.13 -4.50 119.30 120.96 1v5t s MET 80 Ca -0.01 -0.66 0.00 0.00 -1.71 0.00 0.00 55.69 53.31 1v5t s MET 80 Cb -0.14 -2.22 0.00 0.00 2.01 0.00 0.00 34.83 34.48 1v5t s MET 80 CO -0.05 -0.17 0.00 0.41 -0.01 0.00 0.00 175.02 175.19 1v5t n GLY 81 N 4.55 3.90 3.19 -0.03 0.00 -1.26 0.23 105.19 115.77 1v5t n GLY 81 Ca -0.19 -0.59 -0.20 0.00 0.00 0.00 0.00 46.02 45.04 1v5t n GLY 81 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1v5t s THR 82 N -1.70 1.26 0.74 2.61 2.01 -1.26 -4.99 115.64 114.31 1v5t s THR 82 Ca 0.00 -1.23 -0.17 0.00 0.31 0.00 0.00 61.69 60.60 1v5t s THR 82 Cb 0.00 -1.16 -0.14 0.00 0.01 0.00 0.00 72.50 71.20 1v5t s THR 82 CO 0.00 -0.08 -0.48 -2.11 -0.69 0.00 0.00 174.62 171.26 1v5t n ARG 83 N 1.50 0.00 0.00 4.92 0.00 -1.26 -4.57 116.66 117.25 1v5t n ARG 83 Ca -0.19 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.66 1v5t n ARG 83 Cb 0.54 -0.96 0.00 0.00 -0.00 0.00 0.00 32.46 32.05 1v5t n ARG 83 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 1v5t n GLU 84 N 1.96 0.00 -3.65 2.89 1.02 -1.26 -4.90 120.64 116.70 1v5t n GLU 84 Ca 0.02 0.00 -0.04 0.00 -0.02 0.00 0.00 57.16 57.12 1v5t n GLU 84 Cb 0.50 0.00 -0.06 0.00 -0.02 0.00 0.00 31.44 31.86 1v5t n GLU 84 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1v5t s SER 85 N -4.00 -0.98 0.00 1.62 0.15 -1.26 -4.94 113.70 104.29 1v5t s SER 85 Ca 0.00 1.47 0.00 0.00 0.70 0.00 0.00 55.95 58.12 1v5t s SER 85 Cb 0.00 1.87 0.00 0.00 -1.71 0.00 0.00 66.02 66.18 1v5t s SER 85 CO 0.00 -0.23 0.00 0.61 1.20 0.00 0.00 173.24 174.82 1v5t n GLY 86 N 5.04 0.31 3.58 9.45 0.00 -1.26 -4.99 105.19 117.32 1v5t n GLY 86 Ca -0.15 -1.22 -0.36 0.00 0.00 0.00 0.00 46.02 44.30 1v5t n GLY 86 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1v5t s PRO 87 N -2.00 3.24 0.99 1.61 0.04 -1.26 -4.96 135.00 132.67 1v5t s PRO 87 Ca 0.00 -1.54 -0.14 0.00 0.04 0.00 0.00 61.00 59.36 1v5t s PRO 87 Cb 0.00 -5.38 0.05 0.00 0.04 0.00 0.00 34.50 29.21 1v5t s PRO 87 CO 0.00 -3.09 0.31 0.43 0.04 0.00 0.00 177.00 174.69 1v5t n SER 88 N 11.35 -2.18 -4.70 6.66 7.64 -1.26 -4.84 113.62 126.29 1v5t n SER 88 Ca 0.46 0.22 -0.42 0.00 1.01 0.00 0.00 58.87 60.14 1v5t n SER 88 Cb 0.46 -1.15 -0.03 0.00 -1.01 0.00 0.00 64.21 62.49 1v5t n SER 88 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1v5t s SER 89 N -1.97 6.67 0.00 6.43 0.15 -1.26 -5.23 113.70 118.48 1v5t s SER 89 Ca 0.57 2.44 0.00 0.00 0.70 0.00 0.00 55.95 59.66 1v5t s SER 89 Cb -0.19 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.55 1v5t s SER 89 CO 0.67 -0.81 0.37 0.61 1.20 0.00 0.00 173.24 175.28