#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l7y s SER 2 N 0.00 6.16 0.00 6.12 0.01 -1.26 -4.99 113.70 119.74 1l7y s SER 2 Ca 0.00 1.19 0.00 0.00 1.31 0.00 0.00 55.95 58.45 1l7y s SER 2 Cb 0.00 -2.53 0.00 0.00 0.21 0.00 0.00 66.02 63.70 1l7y s SER 2 CO 0.00 -1.51 0.00 0.61 0.41 0.00 0.00 173.24 172.75 1l7y n GLY 3 N 5.14 -2.10 3.56 3.44 0.00 -1.26 -4.76 105.19 109.21 1l7y n GLY 3 Ca 0.20 -1.32 -0.28 0.00 0.00 0.00 0.00 46.02 44.61 1l7y n GLY 3 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1l7y s GLY 4 N -0.74 0.27 0.53 -0.02 0.00 -1.26 -4.77 107.32 101.33 1l7y s GLY 4 Ca 0.00 -1.70 0.26 0.00 0.00 0.00 0.00 44.72 43.28 1l7y s GLY 4 CO 0.00 3.44 1.98 0.00 0.00 0.00 0.00 173.10 178.52 1l7y h THR 5 N 6.99 0.71 -2.39 0.90 1.03 -1.86 -2.73 112.91 115.56 1l7y h THR 5 Ca 0.13 0.00 -0.60 0.00 -0.01 0.00 0.00 66.41 65.93 1l7y h THR 5 Cb 0.99 0.71 -0.42 0.00 -1.07 0.00 0.00 68.15 68.36 1l7y h THR 5 CO 1.23 0.00 -0.61 0.00 -0.01 0.00 0.00 175.52 176.13 1l7y n ALA 6 N -2.65 3.84 -2.54 0.00 0.00 -1.26 -2.78 120.51 115.13 1l7y n ALA 6 Ca 0.11 -4.64 -0.42 0.00 0.00 0.00 0.00 53.44 48.49 1l7y n ALA 6 Cb 0.65 -0.92 -0.01 0.00 0.00 0.00 0.00 19.45 19.17 1l7y n ALA 6 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1l7y s ALA 7 N -2.16 3.17 -1.34 0.00 0.00 -1.03 -4.42 121.76 115.97 1l7y s ALA 7 Ca 0.36 -2.83 -0.17 0.00 0.00 0.00 0.00 51.96 49.32 1l7y s ALA 7 Cb 0.11 -4.65 0.02 0.00 0.00 0.00 0.00 23.12 18.60 1l7y s ALA 7 CO -0.05 -3.48 0.43 0.25 0.00 0.00 0.00 175.76 172.91 1l7y n THR 8 N 6.54 -2.55 -3.96 0.00 -2.24 -1.26 -4.92 114.28 105.89 1l7y n THR 8 Ca 0.48 -0.60 -0.32 0.00 -2.27 0.00 0.00 64.05 61.35 1l7y n THR 8 Cb 0.46 -2.14 -0.14 0.00 -2.10 0.00 0.00 70.33 66.41 1l7y n THR 8 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1l7y s THR 9 N -3.87 2.53 -0.01 4.28 2.01 -1.26 -5.08 115.64 114.24 1l7y s THR 9 Ca 0.26 -2.51 0.03 0.00 0.31 0.00 0.00 61.69 59.79 1l7y s THR 9 Cb -0.14 -2.82 -0.01 0.00 0.01 0.00 0.00 72.50 69.55 1l7y s THR 9 CO 0.96 -0.66 -0.11 0.00 -0.69 0.00 0.00 174.62 174.12 1l7y s ALA 10 N 0.68 0.91 0.00 7.40 0.00 -1.26 -4.80 121.76 124.69 1l7y s ALA 10 Ca 0.12 -0.46 0.00 0.00 0.00 0.00 0.00 51.96 51.61 1l7y s ALA 10 Cb -0.21 -0.24 0.00 0.00 0.00 0.00 0.00 23.12 22.67 1l7y s ALA 10 CO -0.06 0.22 0.00 0.41 0.00 0.00 0.00 175.76 176.33 1l7y n GLY 11 N 2.84 2.18 3.61 0.00 0.00 -1.26 -5.00 105.19 107.57 1l7y n GLY 11 Ca -0.14 -0.71 -0.42 0.00 0.00 0.00 0.00 46.02 44.74 1l7y n GLY 11 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1l7y s SER 12 N -1.42 6.72 0.08 1.61 0.15 -1.26 -5.03 113.70 114.56 1l7y s SER 12 Ca 0.00 0.69 0.04 0.00 0.70 0.00 0.00 55.95 57.38 1l7y s SER 12 Cb 0.00 -2.47 -0.03 0.00 -1.71 0.00 0.00 66.02 61.81 1l7y s SER 12 CO 0.00 -0.80 -0.10 -0.54 1.20 0.00 0.00 173.24 173.00 1l7y s LYS 13 N 3.38 0.76 -0.14 5.44 1.02 -1.26 -3.76 119.74 125.18 1l7y s LYS 13 Ca 0.38 -1.02 -0.03 0.00 0.02 0.00 0.00 55.97 55.31 1l7y s LYS 13 Cb -0.13 -0.52 -0.03 0.00 -0.52 0.00 0.00 37.83 36.64 1l7y s LYS 13 CO 0.16 0.09 -0.03 0.14 -0.92 0.00 0.00 175.35 174.80 1l7y s VAL 14 N -1.99 4.00 -0.08 3.17 -7.23 0.60 -4.93 120.40 113.93 1l7y s VAL 14 Ca 0.00 -0.33 -0.08 0.00 -1.81 0.00 0.00 61.98 59.76 1l7y s VAL 14 Cb -0.06 -2.73 -0.04 0.00 0.56 0.00 0.00 36.38 34.11 1l7y s VAL 14 CO 0.00 0.52 0.20 0.42 -0.31 0.00 0.00 175.10 175.93 1l7y s THR 15 N 0.06 5.41 -0.01 5.32 -4.23 -1.26 -2.50 115.64 118.43 1l7y s THR 15 Ca 0.01 0.26 0.06 0.00 -1.18 0.00 0.00 61.69 60.84 1l7y s THR 15 Cb -0.13 -3.48 -0.02 0.00 1.34 0.00 0.00 72.50 70.21 1l7y s THR 15 CO 0.02 0.55 -0.20 -0.36 -0.54 0.00 0.00 174.62 174.10 1l7y s PHE 16 N -1.10 1.82 -0.21 3.99 0.08 0.41 -4.23 117.98 118.74 1l7y s PHE 16 Ca 0.19 -0.35 0.01 0.00 0.12 0.00 0.00 56.93 56.90 1l7y s PHE 16 Cb -0.13 -1.16 0.05 0.00 -0.57 0.00 0.00 43.02 41.21 1l7y s PHE 16 CO 0.08 -0.01 -0.09 0.21 -0.10 0.00 0.00 175.22 175.31 1l7y s LYS 17 N -0.57 1.92 -0.23 0.44 2.20 0.12 -0.51 119.74 123.11 1l7y s LYS 17 Ca 0.08 -0.86 -0.05 0.00 -0.36 0.00 0.00 55.97 54.78 1l7y s LYS 17 Cb -0.08 -2.44 -0.01 0.00 -1.51 0.00 0.00 37.83 33.79 1l7y s LYS 17 CO -0.00 -0.46 -0.02 0.42 -0.36 0.00 0.00 175.35 174.92 1l7y s ILE 18 N 1.40 3.56 0.04 5.43 1.09 -0.57 -0.55 121.20 131.60 1l7y s ILE 18 Ca -0.02 -0.44 0.02 0.00 -1.10 0.00 0.00 60.65 59.11 1l7y s ILE 18 Cb -0.17 -2.64 -0.04 0.00 -1.06 0.00 0.00 42.46 38.55 1l7y s ILE 18 CO -0.08 0.39 0.02 -0.89 -0.10 0.00 0.00 174.94 174.29 1l7y s THR 19 N 1.50 4.25 0.29 2.92 2.01 -0.77 -0.56 115.64 125.28 1l7y s THR 19 Ca 0.06 -0.71 -0.29 0.00 0.31 0.00 0.00 61.69 61.05 1l7y s THR 19 Cb -0.14 -2.96 -0.10 0.00 0.01 0.00 0.00 72.50 69.30 1l7y s THR 19 CO -0.02 0.26 1.34 -0.22 -0.69 0.00 0.00 174.62 175.29 1l7y s LEU 20 N -1.92 4.42 -0.86 4.42 2.96 -1.26 -0.86 118.68 125.57 1l7y s LEU 20 Ca 0.23 2.63 -0.02 0.00 -0.22 0.00 0.00 54.13 56.75 1l7y s LEU 20 Cb -0.12 -3.64 0.31 0.00 0.50 0.00 0.00 46.19 43.25 1l7y s LEU 20 CO 0.15 -0.57 2.06 0.35 -1.32 0.00 0.00 176.35 177.03 1l7y n THR 21 N 1.48 4.11 0.10 3.68 -2.24 -1.19 -4.43 114.28 115.79 1l7y n THR 21 Ca 0.03 -4.52 0.00 0.00 -2.27 0.00 0.00 64.05 57.29 1l7y n THR 21 Cb 0.42 -1.35 0.00 0.00 -2.10 0.00 0.00 70.33 67.29 1l7y n THR 21 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1l7y n SER 22 N -0.27 -1.10 -3.98 3.42 7.64 -1.26 -5.06 113.62 113.01 1l7y n SER 22 Ca 0.52 0.35 -0.09 0.00 1.01 0.00 0.00 58.87 60.67 1l7y n SER 22 Cb 0.26 1.20 -0.10 0.00 -1.01 0.00 0.00 64.21 64.56 1l7y n SER 22 CO 0.00 0.00 0.00 1.51 -3.01 0.00 0.00 175.04 173.54 1l7y s ASP 23 N -3.56 0.25 0.33 6.43 1.47 -1.26 -5.03 116.67 115.30 1l7y s ASP 23 Ca 0.00 -0.56 0.26 0.00 1.18 0.00 0.00 52.55 53.42 1l7y s ASP 23 Cb 0.00 0.15 0.78 0.00 -0.34 0.00 0.00 42.92 43.51 1l7y s ASP 23 CO 0.00 -0.40 1.75 1.55 0.68 0.00 0.00 175.17 178.75 1l7y h PRO 24 N 4.16 0.00 0.03 2.11 0.13 -2.01 -3.31 132.00 133.11 1l7y h PRO 24 Ca -0.32 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 64.83 1l7y h PRO 24 Cb 1.19 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.29 1l7y h PRO 24 CO 0.47 0.00 -0.16 0.87 -0.23 0.00 0.00 178.00 178.95 1l7y h LYS 25 N 0.00 -0.28 -6.51 0.86 1.57 -1.98 -3.41 116.57 106.82 1l7y h LYS 25 Ca 0.00 0.02 -0.53 0.00 -1.87 0.00 0.00 60.65 58.27 1l7y h LYS 25 Cb 0.72 0.06 0.04 0.00 0.08 0.00 0.00 32.23 33.13 1l7y h LYS 25 CO 0.00 -0.18 1.04 -1.17 -0.57 0.00 0.00 179.45 178.57 1l7y s LEU 26 N -10.31 4.38 0.29 2.94 0.20 -1.25 -4.96 118.68 109.98 1l7y s LEU 26 Ca -0.15 2.66 -0.28 0.00 0.69 0.00 0.00 54.13 57.05 1l7y s LEU 26 Cb 0.08 -3.57 -0.09 0.00 -0.43 0.00 0.00 46.19 42.18 1l7y s LEU 26 CO 0.66 -0.94 1.01 -2.16 -0.29 0.00 0.00 176.35 174.63 1l7y s PRO 27 N 2.40 4.64 0.76 0.98 0.04 -1.26 -4.60 135.00 137.96 1l7y s PRO 27 Ca 0.77 1.57 -0.13 0.00 0.04 0.00 0.00 61.00 63.26 1l7y s PRO 27 Cb -0.44 -3.07 0.06 0.00 0.04 0.00 0.00 34.50 31.09 1l7y s PRO 27 CO 0.34 0.28 1.14 -0.59 0.04 0.00 0.00 177.00 178.21 1l7y s PHE 28 N -1.31 2.24 -0.17 0.56 -0.12 -1.26 -4.79 117.98 113.12 1l7y s PHE 28 Ca 0.46 1.62 -0.06 0.00 -0.05 0.00 0.00 56.93 58.90 1l7y s PHE 28 Cb -0.26 -3.26 -0.03 0.00 -0.63 0.00 0.00 43.02 38.83 1l7y s PHE 28 CO 0.33 -2.21 0.02 0.21 -0.05 0.00 0.00 175.22 173.52 1l7y s LYS 29 N -4.37 3.84 -0.23 1.99 2.36 0.27 -4.91 119.74 118.70 1l7y s LYS 29 Ca 0.67 -0.42 -0.10 0.00 -2.55 0.00 0.00 55.97 53.58 1l7y s LYS 29 Cb -0.22 -3.09 -0.05 0.00 -1.05 0.00 0.00 37.83 33.42 1l7y s LYS 29 CO 0.50 0.24 0.13 0.08 1.55 0.00 0.00 175.35 177.85 1l7y s VAL 30 N 0.41 5.16 -0.20 4.02 1.01 -1.26 -1.51 120.40 128.02 1l7y s VAL 30 Ca 0.00 0.11 0.01 0.00 0.00 0.00 0.00 61.98 62.10 1l7y s VAL 30 Cb -0.13 -3.38 0.03 0.00 0.00 0.00 0.00 36.38 32.89 1l7y s VAL 30 CO 0.01 0.38 -0.17 -0.76 0.00 0.00 0.00 175.10 174.56 1l7y s LEU 31 N 0.91 2.40 -0.37 3.92 1.43 0.34 -4.94 118.68 122.37 1l7y s LEU 31 Ca 0.06 -0.82 -0.07 0.00 -1.03 0.00 0.00 54.13 52.27 1l7y s LEU 31 Cb -0.13 -1.46 0.05 0.00 0.03 0.00 0.00 46.19 44.68 1l7y s LEU 31 CO 0.03 -0.05 0.16 -0.55 0.23 0.00 0.00 176.35 176.16 1l7y s SER 32 N 1.27 5.42 0.08 2.29 0.15 -1.26 -0.45 113.70 121.20 1l7y s SER 32 Ca 0.02 -1.28 0.02 0.00 0.70 0.00 0.00 55.95 55.41 1l7y s SER 32 Cb -0.15 -1.91 -0.04 0.00 -1.71 0.00 0.00 66.02 62.22 1l7y s SER 32 CO -0.11 -0.40 -0.07 0.68 1.20 0.00 0.00 173.24 174.54 1l7y s VAL 33 N 1.40 0.67 0.68 4.45 -7.23 -1.04 -4.99 120.40 114.34 1l7y s VAL 33 Ca 0.00 -1.70 -0.11 0.00 -1.81 0.00 0.00 61.98 58.36 1l7y s VAL 33 Cb -0.21 -1.39 -0.00 0.00 0.56 0.00 0.00 36.38 35.34 1l7y s VAL 33 CO 0.02 -0.73 1.05 -2.16 -0.31 0.00 0.00 175.10 172.98 1l7y s PRO 34 N -3.19 3.09 -1.05 4.82 0.04 -1.26 -0.29 135.00 137.15 1l7y s PRO 34 Ca 0.06 0.92 -0.25 0.00 0.04 0.00 0.00 61.00 61.77 1l7y s PRO 34 Cb 0.01 -2.01 -0.13 0.00 0.04 0.00 0.00 34.50 32.41 1l7y s PRO 34 CO -0.03 -0.98 2.05 -1.21 0.04 0.00 0.00 177.00 176.87 1l7y s GLU 35 N -5.03 1.99 0.00 4.56 8.01 -1.25 -2.63 118.70 124.36 1l7y s GLU 35 Ca 0.58 -0.56 0.00 0.00 0.01 0.00 0.00 54.97 55.00 1l7y s GLU 35 Cb -0.13 -5.07 0.00 0.00 -4.31 0.00 0.00 34.13 24.62 1l7y s GLU 35 CO 0.54 -4.39 0.00 -1.13 0.01 0.00 0.00 175.26 170.30 1l7y n SER 36 N 16.46 0.00 -4.72 -0.19 3.41 -1.26 -4.79 113.62 122.53 1l7y n SER 36 Ca 0.43 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.62 1l7y n SER 36 Cb 0.46 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.38 1l7y n SER 36 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1l7y s THR 37 N 0.00 2.49 0.60 6.66 2.01 -1.08 -4.65 115.64 121.67 1l7y s THR 37 Ca 0.00 0.36 -0.15 0.00 0.31 0.00 0.00 61.69 62.21 1l7y s THR 37 Cb 0.00 -3.23 -0.04 0.00 0.01 0.00 0.00 72.50 69.25 1l7y s THR 37 CO 0.00 0.03 1.05 -2.16 -0.69 0.00 0.00 174.62 172.85 1l7y s PRO 38 N 1.02 3.36 0.42 4.92 0.04 -1.26 -0.10 135.00 143.40 1l7y s PRO 38 Ca 0.70 1.11 0.30 0.00 0.04 0.00 0.00 61.00 63.15 1l7y s PRO 38 Cb -0.45 -2.04 1.43 0.00 0.04 0.00 0.00 34.50 33.47 1l7y s PRO 38 CO 0.32 -0.77 1.89 0.35 0.04 0.00 0.00 177.00 178.84 1l7y h PHE 39 N 0.30 0.00 -0.26 0.56 3.57 -0.98 -2.60 116.94 117.53 1l7y h PHE 39 Ca -0.46 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.04 1l7y h PHE 39 Cb 1.21 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.94 1l7y h PHE 39 CO 0.60 0.00 0.17 1.79 -2.23 0.00 0.00 178.31 178.64 1l7y h THR 40 N 0.00 1.08 -0.17 4.41 1.35 -1.82 0.22 112.91 117.98 1l7y h THR 40 Ca 0.00 -0.18 -0.21 0.00 -0.55 0.00 0.00 66.41 65.47 1l7y h THR 40 Cb 0.21 0.73 0.01 0.00 -1.73 0.00 0.00 68.15 67.37 1l7y h THR 40 CO 0.00 0.08 -0.70 0.00 -0.25 0.00 0.00 175.52 174.65 1l7y h ALA 41 N 1.07 0.31 -0.06 6.62 0.00 -1.83 -2.10 119.26 123.27 1l7y h ALA 41 Ca 0.09 -0.57 0.01 0.00 0.00 0.00 0.00 54.91 54.44 1l7y h ALA 41 Cb -0.01 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1l7y h ALA 41 CO -0.02 0.63 -0.01 0.28 0.00 0.00 0.00 179.25 180.13 1l7y h VAL 42 N 0.50 0.94 -0.29 0.00 2.07 -1.28 -1.29 116.25 116.91 1l7y h VAL 42 Ca -0.04 -0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.44 1l7y h VAL 42 Cb 1.33 0.94 -0.02 0.00 -1.52 0.00 0.00 31.29 32.02 1l7y h VAL 42 CO 0.15 0.00 -0.00 0.25 0.02 0.00 0.00 177.57 177.98 1l7y h LEU 43 N 0.01 0.41 -0.03 2.57 6.46 -0.60 -1.91 115.31 122.22 1l7y h LEU 43 Ca 0.03 -0.07 -0.00 0.00 -0.12 0.00 0.00 57.88 57.72 1l7y h LEU 43 Cb 0.04 -0.11 -0.00 0.00 -0.73 0.00 0.00 40.66 39.86 1l7y h LEU 43 CO -0.06 0.48 0.01 0.50 -0.62 0.00 0.00 178.44 178.75 1l7y h LYS 44 N 0.43 0.04 -0.50 1.25 3.64 -0.64 0.34 116.57 121.13 1l7y h LYS 44 Ca 0.09 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.44 1l7y h LYS 44 Cb 0.29 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.08 1l7y h LYS 44 CO 0.01 0.20 0.22 0.74 -2.27 0.00 0.00 179.45 178.35 1l7y h PHE 45 N -0.13 0.74 -0.79 1.91 0.04 -1.05 -0.34 116.94 117.33 1l7y h PHE 45 Ca 0.01 -0.05 -0.02 0.00 2.80 0.00 0.00 57.97 60.71 1l7y h PHE 45 Cb 0.18 -0.23 -0.04 0.00 2.20 0.00 0.00 35.95 38.06 1l7y h PHE 45 CO -0.02 0.61 0.42 0.00 -0.60 0.00 0.00 178.31 178.72 1l7y h ALA 46 N 1.06 1.02 -0.08 2.45 0.00 -1.24 -2.16 119.26 120.31 1l7y h ALA 46 Ca 0.17 -0.13 -0.10 0.00 0.00 0.00 0.00 54.91 54.84 1l7y h ALA 46 Cb 0.16 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1l7y h ALA 46 CO -0.02 0.55 -0.41 0.00 0.00 0.00 0.00 179.25 179.37 1l7y h ALA 47 N 1.22 1.17 0.12 0.00 0.00 -0.60 -1.97 119.26 119.20 1l7y h ALA 47 Ca 0.28 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.78 1l7y h ALA 47 Cb 0.06 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1l7y h ALA 47 CO -0.04 0.57 -0.06 0.93 0.00 0.00 0.00 179.25 180.65 1l7y h GLU 48 N 0.14 -0.15 -0.11 0.00 3.07 -0.41 -0.40 114.58 116.72 1l7y h GLU 48 Ca 0.01 0.01 -0.11 0.00 -0.50 0.00 0.00 59.36 58.77 1l7y h GLU 48 Cb 0.79 0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.73 1l7y h GLU 48 CO 0.06 -0.08 -0.44 1.49 -1.40 0.00 0.00 179.01 178.64 1l7y h GLU 49 N -0.18 0.26 0.00 2.33 4.22 -1.46 -2.63 114.58 117.12 1l7y h GLU 49 Ca -0.02 -0.13 0.00 0.00 0.08 0.00 0.00 59.36 59.30 1l7y h GLU 49 Cb 0.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.39 1l7y h GLU 49 CO 0.03 0.65 0.00 1.19 -2.18 0.00 0.00 179.01 178.70 1l7y n PHE 50 N -4.01 0.00 -3.07 0.92 3.01 -0.74 -4.90 117.46 108.67 1l7y n PHE 50 Ca -0.02 0.00 -0.17 0.00 1.01 0.00 0.00 57.45 58.27 1l7y n PHE 50 Cb 0.50 -0.33 0.04 0.00 -0.01 0.00 0.00 39.48 39.69 1l7y n PHE 50 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 1l7y n LYS 51 N -1.33 -4.84 -4.22 -1.08 4.01 -0.29 -5.02 118.16 105.40 1l7y n LYS 51 Ca 0.11 0.66 -0.15 0.00 -0.51 0.00 0.00 58.31 58.41 1l7y n LYS 51 Cb 0.21 -5.07 -0.11 0.00 -0.51 0.00 0.00 35.03 29.56 1l7y n LYS 51 CO 0.00 0.00 0.00 0.14 -1.11 0.00 0.00 177.40 176.43 1l7y s VAL 52 N -3.13 1.15 -0.10 -0.18 -7.23 -0.46 -5.05 120.40 105.41 1l7y s VAL 52 Ca 0.33 -1.82 -0.30 0.00 -1.81 0.00 0.00 61.98 58.39 1l7y s VAL 52 Cb -0.15 -1.59 -0.02 0.00 0.56 0.00 0.00 36.38 35.18 1l7y s VAL 52 CO 0.41 -0.58 1.16 -2.16 -0.31 0.00 0.00 175.10 173.62 1l7y s PRO 53 N -3.10 4.34 0.32 4.82 0.04 -1.26 -4.30 135.00 135.86 1l7y s PRO 53 Ca 0.11 1.59 0.13 0.00 0.04 0.00 0.00 61.00 62.86 1l7y s PRO 53 Cb -0.02 -3.59 0.54 0.00 0.04 0.00 0.00 34.50 31.48 1l7y s PRO 53 CO 0.01 -0.47 1.71 0.00 0.04 0.00 0.00 177.00 178.29 1l7y h ALA 54 N 7.49 1.11 -0.72 8.56 0.00 -1.90 -2.80 119.26 131.00 1l7y h ALA 54 Ca -0.31 -0.45 -0.01 0.00 0.00 0.00 0.00 54.91 54.14 1l7y h ALA 54 Cb 1.14 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.82 1l7y h ALA 54 CO 0.90 0.62 0.39 0.00 0.00 0.00 0.00 179.25 181.16 1l7y h ALA 55 N 1.51 0.92 -0.98 0.00 0.00 -1.97 -2.96 119.26 115.77 1l7y h ALA 55 Ca -0.00 -0.11 -0.62 0.00 0.00 0.00 0.00 54.91 54.17 1l7y h ALA 55 Cb 0.92 -0.29 -0.37 0.00 0.00 0.00 0.00 17.79 18.05 1l7y h ALA 55 CO 0.06 0.43 -0.06 0.25 0.00 0.00 0.00 179.25 179.93 1l7y n THR 56 N -4.48 2.97 -3.95 0.00 -2.24 -1.18 -4.99 114.28 100.42 1l7y n THR 56 Ca 0.06 -3.96 -0.10 0.00 -2.27 0.00 0.00 64.05 57.78 1l7y n THR 56 Cb 0.09 -1.18 -0.12 0.00 -2.10 0.00 0.00 70.33 67.02 1l7y n THR 56 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1l7y s SER 57 N -2.75 0.16 0.31 3.42 0.15 -1.06 -3.00 113.70 110.93 1l7y s SER 57 Ca 0.55 -0.35 0.03 0.00 0.70 0.00 0.00 55.95 56.88 1l7y s SER 57 Cb 0.44 0.09 -0.06 0.00 -1.71 0.00 0.00 66.02 64.78 1l7y s SER 57 CO -0.07 -0.23 0.07 0.00 1.20 0.00 0.00 173.24 174.21 1l7y s ALA 58 N -1.10 2.21 -0.12 5.45 0.00 -0.19 -4.78 121.76 123.23 1l7y s ALA 58 Ca -0.12 -1.96 0.00 0.00 0.00 0.00 0.00 51.96 49.89 1l7y s ALA 58 Cb -0.07 0.78 0.02 0.00 0.00 0.00 0.00 23.12 23.85 1l7y s ALA 58 CO -0.01 -0.36 -0.10 0.42 0.00 0.00 0.00 175.76 175.72 1l7y s ILE 59 N -3.42 1.22 0.47 0.00 1.01 -1.03 -1.05 121.20 118.41 1l7y s ILE 59 Ca 0.36 -0.43 0.07 0.00 0.00 0.00 0.00 60.65 60.65 1l7y s ILE 59 Cb 0.08 -1.19 0.03 0.00 0.01 0.00 0.00 42.46 41.39 1l7y s ILE 59 CO 0.15 0.40 0.65 0.27 0.00 0.00 0.00 174.94 176.41 1l7y s ILE 60 N 1.51 2.81 0.21 2.92 -4.36 0.22 0.36 121.20 124.87 1l7y s ILE 60 Ca 0.03 -0.92 0.05 0.00 -0.26 0.00 0.00 60.65 59.55 1l7y s ILE 60 Cb -0.13 -2.89 -0.03 0.00 1.25 0.00 0.00 42.46 40.66 1l7y s ILE 60 CO -0.08 0.00 0.25 -0.89 0.24 0.00 0.00 174.94 174.46 1l7y s THR 61 N -2.49 4.85 0.60 8.37 2.01 0.08 0.47 115.64 129.53 1l7y s THR 61 Ca 0.57 -1.09 0.30 0.00 0.31 0.00 0.00 61.69 61.78 1l7y s THR 61 Cb -0.09 -3.57 0.36 0.00 0.01 0.00 0.00 72.50 69.21 1l7y s THR 61 CO 0.35 -0.25 2.14 0.78 -0.69 0.00 0.00 174.62 176.95 1l7y h ASN 62 N 1.71 0.00 0.06 3.53 4.21 -1.85 -2.25 115.58 120.99 1l7y h ASN 62 Ca -0.49 0.00 -0.09 0.00 1.21 0.00 0.00 56.30 56.93 1l7y h ASN 62 Cb 1.22 0.00 0.01 0.00 -1.12 0.00 0.00 38.32 38.43 1l7y h ASN 62 CO 0.63 0.00 -0.37 0.44 -1.29 0.00 0.00 177.43 176.83 1l7y h ASP 63 N 0.00 0.23 0.00 5.81 3.32 -1.94 -3.48 116.42 120.36 1l7y h ASP 63 Ca 0.06 -0.94 0.00 0.00 0.02 0.00 0.00 57.03 56.17 1l7y h ASP 63 Cb 0.39 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.86 1l7y h ASP 63 CO -0.00 1.15 0.00 0.61 -1.72 0.00 0.00 179.24 179.28 1l7y n GLY 64 N 1.52 -0.13 2.89 2.75 0.00 -0.85 -5.15 105.19 106.22 1l7y n GLY 64 Ca -0.11 -0.08 -0.26 0.00 0.00 0.00 0.00 46.02 45.56 1l7y n GLY 64 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1l7y s VAL 65 N 0.00 0.96 -1.00 1.61 1.01 -1.26 -4.89 120.40 116.83 1l7y s VAL 65 Ca 0.00 -0.25 -0.23 0.00 0.00 0.00 0.00 61.98 61.50 1l7y s VAL 65 Cb 0.00 -1.00 -0.00 0.00 0.00 0.00 0.00 36.38 35.38 1l7y s VAL 65 CO 0.00 0.35 1.73 -0.83 0.00 0.00 0.00 175.10 176.36 1l7y s GLY 66 N 1.74 0.71 0.09 4.51 0.00 -1.26 -0.74 107.32 112.36 1l7y s GLY 66 Ca 0.05 -1.95 -0.31 0.00 0.00 0.00 0.00 44.72 42.51 1l7y s GLY 66 CO -0.08 3.13 1.31 0.14 0.00 0.00 0.00 173.10 177.60 1l7y s VAL 67 N 7.74 3.61 0.23 1.40 1.01 0.16 -4.92 120.40 129.63 1l7y s VAL 67 Ca 0.59 1.15 0.05 0.00 0.00 0.00 0.00 61.98 63.78 1l7y s VAL 67 Cb -0.03 -3.74 -0.03 0.00 0.00 0.00 0.00 36.38 32.58 1l7y s VAL 67 CO -0.03 0.09 0.30 0.20 0.00 0.00 0.00 175.10 175.66 1l7y s ASN 68 N 1.11 6.07 -1.33 3.32 0.01 -1.26 -2.45 114.94 120.40 1l7y s ASN 68 Ca 0.62 -0.02 -0.13 0.00 -0.71 0.00 0.00 52.86 52.62 1l7y s ASN 68 Cb -0.34 -1.72 -0.04 0.00 0.41 0.00 0.00 41.25 39.56 1l7y s ASN 68 CO 0.30 -0.04 2.37 -0.81 -1.51 0.00 0.00 177.10 177.41 1l7y n PRO 69 N -1.22 2.78 0.00 -0.60 -0.04 -1.26 -3.96 135.00 130.69 1l7y n PRO 69 Ca -0.08 -2.23 0.00 0.00 -0.04 0.00 0.00 63.50 61.15 1l7y n PRO 69 Cb 0.57 -2.99 0.00 0.00 -0.04 0.00 0.00 33.50 31.04 1l7y n PRO 69 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1l7y n ALA 70 N 5.39 2.59 -1.20 0.55 0.00 -1.26 -3.79 120.51 122.79 1l7y n ALA 70 Ca 0.58 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.69 1l7y n ALA 70 Cb 0.32 0.00 0.11 0.00 0.00 0.00 0.00 19.45 19.87 1l7y n ALA 70 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1l7y s GLN 71 N -1.84 1.92 0.59 0.00 -0.21 -1.25 -4.43 119.66 114.44 1l7y s GLN 71 Ca 0.00 1.63 -0.14 0.00 0.02 0.00 0.00 55.36 56.87 1l7y s GLN 71 Cb 0.00 -1.82 -0.04 0.00 1.00 0.00 0.00 33.01 32.15 1l7y s GLN 71 CO 0.00 -1.97 1.03 -1.25 -2.12 0.00 0.00 175.29 170.97 1l7y s PRO 72 N -4.19 3.53 0.22 2.91 0.04 -1.26 -0.46 135.00 135.79 1l7y s PRO 72 Ca 0.71 0.96 -0.08 0.00 0.04 0.00 0.00 61.00 62.63 1l7y s PRO 72 Cb -0.26 -2.07 0.29 0.00 0.04 0.00 0.00 34.50 32.50 1l7y s PRO 72 CO 0.49 -0.62 1.81 0.00 0.04 0.00 0.00 177.00 178.72 1l7y h ALA 73 N 0.20 0.98 -0.53 8.56 0.00 -0.78 0.93 119.26 128.62 1l7y h ALA 73 Ca -0.46 0.02 0.06 0.00 0.00 0.00 0.00 54.91 54.54 1l7y h ALA 73 Cb 1.20 -0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.80 1l7y h ALA 73 CO 0.60 0.08 0.24 0.78 0.00 0.00 0.00 179.25 180.94 1l7y h GLY 74 N 0.73 0.74 1.34 0.00 0.00 -1.83 -0.41 103.07 103.64 1l7y h GLY 74 Ca 0.33 -0.15 -0.19 0.00 0.00 0.00 0.00 47.33 47.32 1l7y h GLY 74 CO -0.20 0.06 -0.67 -0.57 0.00 0.00 0.00 176.54 175.16 1l7y h ASN 75 N 0.45 0.77 -0.88 0.19 -1.24 -1.76 -1.63 115.58 111.48 1l7y h ASN 75 Ca 0.25 -0.47 -0.00 0.00 0.71 0.00 0.00 56.30 56.79 1l7y h ASN 75 Cb 0.22 -0.23 -0.04 0.00 0.73 0.00 0.00 38.32 39.00 1l7y h ASN 75 CO -0.21 1.23 0.54 0.40 -1.29 0.00 0.00 177.43 178.10 1l7y h ILE 76 N 0.48 1.24 -0.03 2.57 1.08 -0.28 0.33 117.51 122.90 1l7y h ILE 76 Ca -0.02 -0.52 -0.23 0.00 -0.39 0.00 0.00 64.86 63.70 1l7y h ILE 76 Cb 1.27 -0.00 0.01 0.00 -3.07 0.00 0.00 36.82 35.02 1l7y h ILE 76 CO 0.13 0.25 -0.93 0.15 -0.69 0.00 0.00 178.15 177.07 1l7y h PHE 77 N 1.21 0.82 -0.47 1.37 3.04 -1.07 0.68 116.94 122.53 1l7y h PHE 77 Ca 0.32 -0.42 -0.09 0.00 3.98 0.00 0.00 57.97 61.75 1l7y h PHE 77 Cb -0.06 -0.10 -0.02 0.00 2.56 0.00 0.00 35.95 38.33 1l7y h PHE 77 CO -0.00 1.25 -0.08 -0.07 -2.02 0.00 0.00 178.31 177.39 1l7y h LEU 78 N 0.34 0.81 0.00 0.59 3.38 -0.92 -1.69 115.31 117.82 1l7y h LEU 78 Ca -0.09 -0.23 -0.10 0.00 0.09 0.00 0.00 57.88 57.55 1l7y h LEU 78 Cb 1.56 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 42.08 1l7y h LEU 78 CO 0.17 0.92 -0.68 0.50 0.09 0.00 0.00 178.44 179.44 1l7y h LYS 79 N 0.75 0.00 0.00 1.13 3.64 -0.97 -3.44 116.57 117.68 1l7y h LYS 79 Ca 0.13 0.00 -0.04 0.00 -1.27 0.00 0.00 60.65 59.47 1l7y h LYS 79 Cb 0.57 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.38 1l7y h LYS 79 CO 0.03 0.56 -0.87 0.72 -2.27 0.00 0.00 179.45 177.62 1l7y n HIS 80 N -4.56 0.53 0.00 1.91 8.25 0.13 -5.09 115.22 116.39 1l7y n HIS 80 Ca -0.17 0.23 0.00 0.00 -0.26 0.00 0.00 57.72 57.52 1l7y n HIS 80 Cb 0.44 -0.71 0.00 0.00 1.12 0.00 0.00 29.99 30.84 1l7y n HIS 80 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1l7y n GLY 81 N 1.52 0.31 0.06 -1.41 0.00 -0.56 -4.71 105.19 100.40 1l7y n GLY 81 Ca -0.14 -1.43 -0.08 0.00 0.00 0.00 0.00 46.02 44.36 1l7y n GLY 81 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1l7y n SER 82 N 0.00 3.06 -4.57 1.61 2.88 -1.26 -4.32 113.62 111.02 1l7y n SER 82 Ca 0.00 -0.06 -0.39 0.00 -1.33 0.00 0.00 58.87 57.09 1l7y n SER 82 Cb 0.00 -0.17 -0.03 0.00 -0.75 0.00 0.00 64.21 63.26 1l7y n SER 82 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 1l7y s GLU 83 N -2.24 2.57 0.23 -1.46 8.01 -1.26 -0.70 118.70 123.85 1l7y s GLU 83 Ca -0.16 1.51 0.01 0.00 0.01 0.00 0.00 54.97 56.34 1l7y s GLU 83 Cb 0.04 -4.47 -0.04 0.00 -4.31 0.00 0.00 34.13 25.36 1l7y s GLU 83 CO 0.28 -2.74 0.15 -0.51 0.01 0.00 0.00 175.26 172.44 1l7y s LEU 84 N 10.23 1.33 0.04 1.80 1.43 0.29 -3.30 118.68 130.50 1l7y s LEU 84 Ca 0.94 -1.45 -0.00 0.00 -1.03 0.00 0.00 54.13 52.58 1l7y s LEU 84 Cb -0.22 0.34 -0.03 0.00 0.03 0.00 0.00 46.19 46.31 1l7y s LEU 84 CO 0.29 -0.86 -0.03 -0.13 0.23 0.00 0.00 176.35 175.84 1l7y s ARG 85 N -4.02 0.50 -0.16 1.70 0.52 0.18 -1.85 118.95 115.81 1l7y s ARG 85 Ca 0.39 -0.95 -0.05 0.00 -0.52 0.00 0.00 55.73 54.60 1l7y s ARG 85 Cb 0.06 0.11 -0.03 0.00 0.52 0.00 0.00 34.95 35.61 1l7y s ARG 85 CO 0.15 -0.07 0.00 -1.17 0.02 0.00 0.00 175.30 174.23 1l7y s LEU 86 N -2.25 3.49 -0.05 2.53 0.20 -0.04 -0.61 118.68 121.95 1l7y s LEU 86 Ca -0.03 -0.04 0.02 0.00 0.69 0.00 0.00 54.13 54.77 1l7y s LEU 86 Cb -0.01 -1.86 0.02 0.00 -0.43 0.00 0.00 46.19 43.91 1l7y s LEU 86 CO -0.05 0.18 -0.08 -0.51 -0.29 0.00 0.00 176.35 175.59 1l7y s ILE 87 N 0.32 0.81 -1.01 6.68 2.07 -0.21 -3.15 121.20 126.72 1l7y s ILE 87 Ca -0.01 -0.30 -0.23 0.00 -1.41 0.00 0.00 60.65 58.70 1l7y s ILE 87 Cb -0.13 -0.77 0.01 0.00 0.13 0.00 0.00 42.46 41.69 1l7y s ILE 87 CO 0.02 0.28 1.69 -2.16 -1.91 0.00 0.00 174.94 172.85 1l7y s PRO 88 N 0.69 3.17 -1.00 3.50 0.04 -1.26 -1.02 135.00 139.12 1l7y s PRO 88 Ca -0.12 -0.88 -0.23 0.00 0.04 0.00 0.00 61.00 59.81 1l7y s PRO 88 Cb -0.14 -5.26 0.05 0.00 0.04 0.00 0.00 34.50 29.19 1l7y s PRO 88 CO 0.02 -2.76 1.44 1.03 0.04 0.00 0.00 177.00 176.77 1l7y s ARG 89 N 5.77 3.57 -0.05 4.56 1.81 -1.16 -4.66 118.95 128.79 1l7y s ARG 89 Ca 0.57 -1.07 -0.04 0.00 -1.72 0.00 0.00 55.73 53.46 1l7y s ARG 89 Cb -0.02 -5.30 -0.03 0.00 -0.45 0.00 0.00 34.95 29.15 1l7y s ARG 89 CO -0.04 -2.21 -0.10 -0.25 -0.68 0.00 0.00 175.30 172.02 1l7y n ASP 90 N 8.91 0.82 -3.01 0.23 8.00 -1.26 -4.12 116.55 126.11 1l7y n ASP 90 Ca 0.31 0.13 -0.07 0.00 0.71 0.00 0.00 54.79 55.87 1l7y n ASP 90 Cb 0.51 -0.31 0.02 0.00 -0.02 0.00 0.00 41.12 41.32 1l7y n ASP 90 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1l7y n ARG 91 N -3.49 0.93 -0.06 -1.24 1.74 -1.26 -4.99 116.66 108.29 1l7y n ARG 91 Ca -0.12 -1.11 -0.13 0.00 -0.77 0.00 0.00 57.85 55.72 1l7y n ARG 91 Cb 0.46 -0.04 -0.07 0.00 -1.02 0.00 0.00 32.46 31.79 1l7y n ARG 91 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 1l7y h VAL 92 N 0.14 1.35 -0.88 1.55 2.07 -1.99 -3.20 116.25 115.29 1l7y h VAL 92 Ca -0.10 -1.41 -0.55 0.00 0.82 0.00 0.00 66.70 65.46 1l7y h VAL 92 Cb 0.44 1.92 -0.29 0.00 -1.52 0.00 0.00 31.29 31.83 1l7y h VAL 92 CO 0.15 0.42 0.46 0.61 0.02 0.00 0.00 177.57 179.22 1l7y n GLY 93 N 0.29 5.47 0.00 2.17 0.00 -1.26 -5.17 105.19 106.68 1l7y n GLY 93 Ca -0.06 -1.91 0.00 0.00 0.00 0.00 0.00 46.02 44.05 1l7y n GLY 93 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89