#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l7y n SER 2 N 0.00 1.94 -3.93 6.12 3.41 -1.26 -3.97 113.62 115.94 1l7y n SER 2 Ca 0.00 0.30 -0.31 0.00 -0.26 0.00 0.00 58.87 58.61 1l7y n SER 2 Cb 0.00 -0.82 -0.15 0.00 -0.26 0.00 0.00 64.21 62.98 1l7y n SER 2 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1l7y s GLY 3 N -5.44 1.48 0.00 5.00 0.00 -1.26 -3.49 107.32 103.61 1l7y s GLY 3 Ca -0.35 -1.86 0.00 0.00 0.00 0.00 0.00 44.72 42.51 1l7y s GLY 3 CO 0.55 1.08 0.00 0.61 0.00 0.00 0.00 173.10 175.33 1l7y n GLY 4 N 4.56 1.90 3.59 0.20 0.00 -1.26 -5.02 105.19 109.16 1l7y n GLY 4 Ca -0.04 -0.47 -0.34 0.00 0.00 0.00 0.00 46.02 45.16 1l7y n GLY 4 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1l7y s THR 5 N 0.00 4.35 -1.40 2.61 2.01 -1.26 -3.90 115.64 118.06 1l7y s THR 5 Ca 0.00 -0.20 -0.03 0.00 0.31 0.00 0.00 61.69 61.77 1l7y s THR 5 Cb 0.00 -2.92 0.02 0.00 0.01 0.00 0.00 72.50 69.61 1l7y s THR 5 CO 0.00 0.51 0.61 0.00 -0.69 0.00 0.00 174.62 175.05 1l7y n ALA 6 N 3.23 -1.89 -1.83 7.40 0.00 -1.25 -1.78 120.51 124.39 1l7y n ALA 6 Ca -0.17 -0.16 -0.42 0.00 0.00 0.00 0.00 53.44 52.68 1l7y n ALA 6 Cb 0.53 -2.11 -0.03 0.00 0.00 0.00 0.00 19.45 17.84 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 -3.73 3.80 0.02 0.00 0.00 -1.25 -4.56 121.76 116.04 1l7y s ALA 7 Ca 0.12 1.42 -0.19 0.00 0.00 0.00 0.00 51.96 53.31 1l7y s ALA 7 Cb -0.06 -3.69 -0.06 0.00 0.00 0.00 0.00 23.12 19.31 1l7y s ALA 7 CO 0.85 -0.97 0.53 0.95 0.00 0.00 0.00 175.76 177.13 1l7y s THR 8 N 1.76 4.88 -0.44 0.00 -4.23 -1.23 -4.24 115.64 112.13 1l7y s THR 8 Ca 0.74 1.12 -0.27 0.00 -1.18 0.00 0.00 61.69 62.11 1l7y s THR 8 Cb -0.45 -3.86 -0.04 0.00 1.34 0.00 0.00 72.50 69.49 1l7y s THR 8 CO 0.33 0.51 2.06 -0.89 -0.54 0.00 0.00 174.62 176.08 1l7y s THR 9 N -0.73 3.23 -0.12 3.99 2.01 -1.26 -4.94 115.64 117.81 1l7y s THR 9 Ca 0.28 0.19 0.01 0.00 0.31 0.00 0.00 61.69 62.48 1l7y s THR 9 Cb -0.18 -3.46 0.02 0.00 0.01 0.00 0.00 72.50 68.89 1l7y s THR 9 CO 0.17 -0.39 -0.13 0.00 -0.69 0.00 0.00 174.62 173.58 1l7y s ALA 10 N 9.29 1.69 0.00 7.40 0.00 -1.26 -4.99 121.76 133.88 1l7y s ALA 10 Ca 0.84 -0.76 0.00 0.00 0.00 0.00 0.00 51.96 52.04 1l7y s ALA 10 Cb -0.20 -0.93 0.00 0.00 0.00 0.00 0.00 23.12 22.00 1l7y s ALA 10 CO 0.28 -0.25 0.00 0.41 0.00 0.00 0.00 175.76 176.20 1l7y n GLY 11 N 4.53 0.77 1.50 0.00 0.00 -1.26 -4.84 105.19 105.88 1l7y n GLY 11 Ca -0.17 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 44.79 1l7y n GLY 11 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1l7y n SER 12 N 0.00 0.14 -4.69 1.61 7.64 -1.26 -5.12 113.62 111.94 1l7y n SER 12 Ca 0.00 0.00 -0.24 0.00 1.01 0.00 0.00 58.87 59.64 1l7y n SER 12 Cb 0.00 0.00 -0.08 0.00 -1.01 0.00 0.00 64.21 63.12 1l7y n SER 12 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1l7y s LYS 13 N -1.87 2.20 -0.10 1.43 1.02 -1.26 -4.45 119.74 116.71 1l7y s LYS 13 Ca 0.00 -1.72 0.01 0.00 0.02 0.00 0.00 55.97 54.28 1l7y s LYS 13 Cb 0.00 -2.01 -0.02 0.00 -0.52 0.00 0.00 37.83 35.28 1l7y s LYS 13 CO 0.00 0.07 -0.11 0.14 -0.92 0.00 0.00 175.35 174.53 1l7y s VAL 14 N -2.51 3.29 0.21 3.17 -7.23 0.49 -4.81 120.40 113.01 1l7y s VAL 14 Ca 0.37 -0.60 0.04 0.00 -1.81 0.00 0.00 61.98 59.98 1l7y s VAL 14 Cb 0.00 -2.36 -0.03 0.00 0.56 0.00 0.00 36.38 34.55 1l7y s VAL 14 CO 0.21 0.55 0.33 0.28 -0.31 0.00 0.00 175.10 176.16 1l7y s THR 15 N -0.18 5.22 0.01 5.32 -1.32 -1.26 -1.95 115.64 121.47 1l7y s THR 15 Ca 0.01 -0.93 0.01 0.00 -1.21 0.00 0.00 61.69 59.57 1l7y s THR 15 Cb -0.13 -3.79 -0.01 0.00 -1.51 0.00 0.00 72.50 67.06 1l7y s THR 15 CO 0.03 -0.26 -0.04 -0.36 -2.21 0.00 0.00 174.62 171.78 1l7y s PHE 16 N -1.92 0.32 -0.25 9.09 0.08 -0.31 -4.48 117.98 120.51 1l7y s PHE 16 Ca 0.34 -0.18 0.02 0.00 0.12 0.00 0.00 56.93 57.24 1l7y s PHE 16 Cb -0.10 -0.20 0.05 0.00 -0.57 0.00 0.00 43.02 42.21 1l7y s PHE 16 CO 0.29 -0.04 -0.11 0.15 -0.10 0.00 0.00 175.22 175.40 1l7y s LYS 17 N -0.47 2.35 -0.11 0.44 1.02 0.23 -1.13 119.74 122.07 1l7y s LYS 17 Ca -0.03 -1.28 0.03 0.00 0.02 0.00 0.00 55.97 54.71 1l7y s LYS 17 Cb -0.04 -2.87 0.01 0.00 -0.52 0.00 0.00 37.83 34.41 1l7y s LYS 17 CO -0.00 -0.53 -0.19 0.42 -0.92 0.00 0.00 175.35 174.13 1l7y s ILE 18 N 1.14 1.79 0.14 2.17 1.09 -0.70 -0.30 121.20 126.52 1l7y s ILE 18 Ca -0.07 -0.83 0.09 0.00 -1.10 0.00 0.00 60.65 58.74 1l7y s ILE 18 Cb -0.19 -1.59 -0.04 0.00 -1.06 0.00 0.00 42.46 39.58 1l7y s ILE 18 CO -0.06 0.50 -0.18 0.28 -0.10 0.00 0.00 174.94 175.38 1l7y s THR 19 N 0.75 2.79 0.17 2.92 -1.32 -1.18 -0.43 115.64 119.33 1l7y s THR 19 Ca -0.10 -1.64 -0.30 0.00 -1.21 0.00 0.00 61.69 58.44 1l7y s THR 19 Cb -0.16 -2.30 -0.08 0.00 -1.51 0.00 0.00 72.50 68.45 1l7y s THR 19 CO 0.01 0.03 1.28 -0.22 -2.21 0.00 0.00 174.62 173.51 1l7y s LEU 20 N -2.35 4.41 0.11 9.08 2.96 -1.26 -0.34 118.68 131.29 1l7y s LEU 20 Ca 0.19 2.31 0.19 0.00 -0.22 0.00 0.00 54.13 56.60 1l7y s LEU 20 Cb -0.10 -3.60 -0.09 0.00 0.50 0.00 0.00 46.19 42.90 1l7y s LEU 20 CO 0.11 -0.50 0.89 0.35 -1.32 0.00 0.00 176.35 175.87 1l7y n THR 21 N 2.92 0.97 0.07 3.68 -2.24 -1.00 -4.24 114.28 114.43 1l7y n THR 21 Ca 0.07 -0.64 -0.13 0.00 -2.27 0.00 0.00 64.05 61.08 1l7y n THR 21 Cb 0.43 -0.59 -0.08 0.00 -2.10 0.00 0.00 70.33 68.00 1l7y n THR 21 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1l7y h SER 22 N 0.00 -0.11 -4.96 3.42 0.02 -1.92 -3.45 113.55 106.55 1l7y h SER 22 Ca -0.11 -0.14 -0.18 0.00 -0.84 0.00 0.00 61.79 60.52 1l7y h SER 22 Cb 1.38 0.03 -0.20 0.00 0.14 0.00 0.00 62.40 63.75 1l7y h SER 22 CO 0.03 0.07 -0.70 1.51 -1.14 0.00 0.00 176.83 176.60 1l7y s ASP 23 N -5.23 0.47 0.00 3.07 1.47 -1.26 -5.03 116.67 110.16 1l7y s ASP 23 Ca -0.14 -0.64 0.29 0.00 1.18 0.00 0.00 52.55 53.24 1l7y s ASP 23 Cb 0.04 0.11 1.42 0.00 -0.34 0.00 0.00 42.92 44.14 1l7y s ASP 23 CO 0.65 -0.35 1.99 -0.81 0.68 0.00 0.00 175.17 177.33 1l7y n PRO 24 N 1.18 0.33 0.43 2.11 -0.04 -1.26 -4.05 135.00 133.70 1l7y n PRO 24 Ca -0.21 0.01 -0.19 0.00 -0.04 0.00 0.00 63.50 63.07 1l7y n PRO 24 Cb 0.56 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.43 1l7y n PRO 24 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 1l7y h LYS 25 N 0.00 -1.10 -6.40 0.54 3.64 -1.96 -3.40 116.57 107.90 1l7y h LYS 25 Ca 0.00 0.07 -0.54 0.00 -1.27 0.00 0.00 60.65 58.92 1l7y h LYS 25 Cb 0.32 0.25 0.01 0.00 -0.41 0.00 0.00 32.23 32.40 1l7y h LYS 25 CO 0.00 -0.73 1.01 -0.51 -2.27 0.00 0.00 179.45 176.95 1l7y s LEU 26 N -10.05 4.35 0.00 5.20 1.43 -1.26 -5.00 118.68 113.36 1l7y s LEU 26 Ca -0.19 2.41 -0.07 0.00 -1.03 0.00 0.00 54.13 55.25 1l7y s LEU 26 Cb 0.03 -3.56 0.10 0.00 0.03 0.00 0.00 46.19 42.80 1l7y s LEU 26 CO 0.61 -0.89 0.49 -0.81 0.23 0.00 0.00 176.35 175.98 1l7y n PRO 27 N 5.98 -0.98 -1.25 1.29 -0.04 -1.26 -4.18 135.00 134.56 1l7y n PRO 27 Ca 0.16 -0.77 -0.31 0.00 -0.04 0.00 0.00 63.50 62.54 1l7y n PRO 27 Cb 0.41 -0.58 0.09 0.00 -0.04 0.00 0.00 33.50 33.39 1l7y n PRO 27 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1l7y s PHE 28 N -2.02 2.56 -0.14 0.54 0.08 -1.26 -4.37 117.98 113.36 1l7y s PHE 28 Ca 0.29 1.54 0.01 0.00 0.12 0.00 0.00 56.93 58.89 1l7y s PHE 28 Cb -0.01 -3.06 0.02 0.00 -0.57 0.00 0.00 43.02 39.40 1l7y s PHE 28 CO 0.21 -1.84 -0.17 0.15 -0.10 0.00 0.00 175.22 173.47 1l7y s LYS 29 N -4.90 2.52 -0.29 0.44 3.01 0.42 -4.91 119.74 116.03 1l7y s LYS 29 Ca 0.61 -0.65 -0.13 0.00 -1.01 0.00 0.00 55.97 54.79 1l7y s LYS 29 Cb -0.17 -2.18 -0.04 0.00 -1.01 0.00 0.00 37.83 34.42 1l7y s LYS 29 CO 0.56 -0.15 0.27 0.08 0.51 0.00 0.00 175.35 176.62 1l7y s VAL 30 N 1.21 5.25 -0.29 3.17 1.01 -1.26 -1.73 120.40 127.77 1l7y s VAL 30 Ca -0.00 0.27 0.03 0.00 0.00 0.00 0.00 61.98 62.28 1l7y s VAL 30 Cb -0.14 -3.62 0.07 0.00 0.00 0.00 0.00 36.38 32.69 1l7y s VAL 30 CO -0.07 0.17 -0.05 -0.76 0.00 0.00 0.00 175.10 174.39 1l7y s LEU 31 N 1.88 3.91 -0.46 3.92 1.43 -0.28 -4.92 118.68 124.15 1l7y s LEU 31 Ca 0.10 -1.65 -0.16 0.00 -1.03 0.00 0.00 54.13 51.39 1l7y s LEU 31 Cb -0.16 -1.58 0.06 0.00 0.03 0.00 0.00 46.19 44.54 1l7y s LEU 31 CO 0.11 -0.26 0.41 -0.44 0.23 0.00 0.00 176.35 176.40 1l7y s SER 32 N 1.04 6.15 0.10 2.29 0.01 -1.26 -1.16 113.70 120.87 1l7y s SER 32 Ca -0.02 -1.17 0.03 0.00 1.31 0.00 0.00 55.95 56.10 1l7y s SER 32 Cb -0.20 -2.20 -0.04 0.00 0.21 0.00 0.00 66.02 63.80 1l7y s SER 32 CO -0.06 -0.64 -0.08 0.68 0.41 0.00 0.00 173.24 173.55 1l7y s VAL 33 N 1.81 0.80 0.73 3.43 -7.23 -0.82 -4.97 120.40 114.14 1l7y s VAL 33 Ca 0.06 -1.74 -0.11 0.00 -1.81 0.00 0.00 61.98 58.38 1l7y s VAL 33 Cb -0.22 -1.45 0.03 0.00 0.56 0.00 0.00 36.38 35.29 1l7y s VAL 33 CO 0.08 -0.70 1.07 -2.16 -0.31 0.00 0.00 175.10 173.09 1l7y s PRO 34 N -3.19 2.68 0.43 4.82 0.04 -1.26 -0.38 135.00 138.14 1l7y s PRO 34 Ca 0.07 0.83 0.13 0.00 0.04 0.00 0.00 61.00 62.07 1l7y s PRO 34 Cb 0.00 -1.97 1.01 0.00 0.04 0.00 0.00 34.50 33.58 1l7y s PRO 34 CO -0.02 -1.25 2.00 1.49 0.04 0.00 0.00 177.00 179.27 1l7y h GLU 35 N -0.82 0.41 -0.89 4.56 4.22 -1.93 -1.63 114.58 118.50 1l7y h GLU 35 Ca -0.45 -0.02 0.09 0.00 0.08 0.00 0.00 59.36 59.06 1l7y h GLU 35 Cb 1.23 -0.09 -0.07 0.00 0.50 0.00 0.00 28.75 30.31 1l7y h GLU 35 CO 0.58 0.27 0.54 0.66 -2.18 0.00 0.00 179.01 178.88 1l7y h SER 36 N 0.42 0.80 -2.69 1.04 4.64 -1.95 -3.29 113.55 112.51 1l7y h SER 36 Ca 0.24 0.04 -0.54 0.00 -0.47 0.00 0.00 61.79 61.06 1l7y h SER 36 Cb 0.41 -0.12 0.02 0.00 -0.31 0.00 0.00 62.40 62.39 1l7y h SER 36 CO -0.06 0.47 1.00 -0.89 -0.87 0.00 0.00 176.83 176.47 1l7y s THR 37 N -6.02 3.14 0.75 2.95 2.01 -0.62 -4.82 115.64 113.04 1l7y s THR 37 Ca -0.12 0.55 -0.12 0.00 0.31 0.00 0.00 61.69 62.31 1l7y s THR 37 Cb 0.20 -3.35 0.04 0.00 0.01 0.00 0.00 72.50 69.40 1l7y s THR 37 CO 0.79 -0.01 1.11 -2.16 -0.69 0.00 0.00 174.62 173.66 1l7y s PRO 38 N 2.79 2.50 0.47 4.92 0.04 -1.26 -1.24 135.00 143.22 1l7y s PRO 38 Ca 0.73 0.47 0.32 0.00 0.04 0.00 0.00 61.00 62.57 1l7y s PRO 38 Cb -0.39 -1.98 1.51 0.00 0.04 0.00 0.00 34.50 33.68 1l7y s PRO 38 CO 0.32 -1.29 1.96 0.35 0.04 0.00 0.00 177.00 178.38 1l7y h PHE 39 N -0.84 0.00 -0.45 0.56 3.57 -1.15 -2.63 116.94 116.00 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 1.27 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.99 1l7y h PHE 39 CO 0.47 0.00 0.26 1.79 -2.23 0.00 0.00 178.31 178.60 1l7y h THR 40 N 0.00 1.15 -0.06 4.41 1.35 -1.80 0.20 112.91 118.16 1l7y h THR 40 Ca 0.00 -0.36 -0.22 0.00 -0.55 0.00 0.00 66.41 65.28 1l7y h THR 40 Cb 0.27 0.58 0.01 0.00 -1.73 0.00 0.00 68.15 67.27 1l7y h THR 40 CO 0.00 0.15 -0.86 0.00 -0.25 0.00 0.00 175.52 174.56 1l7y h ALA 41 N 1.11 0.36 -0.38 6.62 0.00 -1.86 -2.24 119.26 122.88 1l7y h ALA 41 Ca 0.16 -0.65 -0.01 0.00 0.00 0.00 0.00 54.91 54.41 1l7y h ALA 41 Cb 0.02 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1l7y h ALA 41 CO -0.03 0.74 0.20 0.28 0.00 0.00 0.00 179.25 180.45 1l7y h VAL 42 N 0.36 1.15 -0.42 0.00 2.07 -1.24 -1.18 116.25 116.99 1l7y h VAL 42 Ca -0.07 -0.38 -0.10 0.00 0.82 0.00 0.00 66.70 66.97 1l7y h VAL 42 Cb 1.48 0.72 -0.02 0.00 -1.52 0.00 0.00 31.29 31.95 1l7y h VAL 42 CO 0.16 0.15 -0.15 0.25 0.02 0.00 0.00 177.57 178.00 1l7y h LEU 43 N 0.48 0.77 -0.36 2.57 6.46 -0.64 -1.78 115.31 122.80 1l7y h LEU 43 Ca 0.13 -0.25 -0.02 0.00 -0.12 0.00 0.00 57.88 57.62 1l7y h LEU 43 Cb 0.06 -0.21 -0.02 0.00 -0.73 0.00 0.00 40.66 39.76 1l7y h LEU 43 CO -0.02 0.93 0.13 0.11 -0.62 0.00 0.00 178.44 178.98 1l7y h LYS 44 N 0.69 0.55 -0.36 1.25 1.57 -1.04 0.84 116.57 120.08 1l7y h LYS 44 Ca 0.11 -0.11 -0.06 0.00 -1.87 0.00 0.00 60.65 58.73 1l7y h LYS 44 Cb 0.65 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.86 1l7y h LYS 44 CO 0.05 0.55 0.01 0.35 -0.57 0.00 0.00 179.45 179.83 1l7y h PHE 45 N 0.44 0.68 -0.35 -1.35 3.57 -1.12 0.14 116.94 118.95 1l7y h PHE 45 Ca 0.12 -0.12 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 1l7y h PHE 45 Cb 0.22 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 38.76 1l7y h PHE 45 CO 0.00 0.72 0.18 0.00 -2.23 0.00 0.00 178.31 176.98 1l7y h ALA 46 N 0.87 0.45 -0.44 2.41 0.00 -1.18 -2.20 119.26 119.17 1l7y h ALA 46 Ca 0.10 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 1l7y h ALA 46 Cb 0.45 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1l7y h ALA 46 CO 0.02 0.00 0.02 0.00 0.00 0.00 0.00 179.25 179.29 1l7y h ALA 47 N 1.03 1.21 -0.42 0.00 0.00 -0.73 -1.33 119.26 119.02 1l7y h ALA 47 Ca 0.12 -0.23 0.01 0.00 0.00 0.00 0.00 54.91 54.80 1l7y h ALA 47 Cb 0.10 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1l7y h ALA 47 CO -0.02 0.52 0.27 1.49 0.00 0.00 0.00 179.25 181.52 1l7y h GLU 48 N 0.67 0.54 0.00 0.00 4.22 -0.52 -0.48 114.58 119.01 1l7y h GLU 48 Ca 0.14 -0.03 -0.11 0.00 0.08 0.00 0.00 59.36 59.44 1l7y h GLU 48 Cb 0.39 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.50 1l7y h GLU 48 CO 0.01 0.36 -0.50 0.93 -2.18 0.00 0.00 179.01 177.63 1l7y h GLU 49 N 0.56 0.00 -0.00 1.92 3.07 -1.13 -2.71 114.58 116.28 1l7y h GLU 49 Ca 0.16 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.02 1l7y h GLU 49 Cb -0.05 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.86 1l7y h GLU 49 CO -0.04 0.50 -0.04 1.19 -1.40 0.00 0.00 179.01 179.22 1l7y n PHE 50 N -3.81 0.00 -2.97 4.33 3.72 -0.53 -4.91 117.46 113.29 1l7y n PHE 50 Ca -0.01 0.00 -0.17 0.00 -0.05 0.00 0.00 57.45 57.22 1l7y n PHE 50 Cb 0.54 -0.15 0.04 0.00 -0.94 0.00 0.00 39.48 38.97 1l7y n PHE 50 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1l7y n LYS 51 N -0.99 -4.29 -4.22 -1.08 4.01 -0.32 -5.02 118.16 106.25 1l7y n LYS 51 Ca 0.18 0.64 -0.15 0.00 -0.51 0.00 0.00 58.31 58.46 1l7y n LYS 51 Cb 0.22 -4.98 -0.11 0.00 -0.51 0.00 0.00 35.03 29.66 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 -3.08 1.14 -0.07 -0.18 -7.23 -0.42 -5.04 120.40 105.53 1l7y s VAL 52 Ca 0.29 -1.79 -0.30 0.00 -1.81 0.00 0.00 61.98 58.37 1l7y s VAL 52 Cb -0.13 -1.56 -0.03 0.00 0.56 0.00 0.00 36.38 35.22 1l7y s VAL 52 CO 0.36 -0.57 1.15 -2.16 -0.31 0.00 0.00 175.10 173.57 1l7y s PRO 53 N -3.04 4.37 0.26 4.82 0.04 -1.26 -4.14 135.00 136.05 1l7y s PRO 53 Ca 0.10 1.60 -0.02 0.00 0.04 0.00 0.00 61.00 62.72 1l7y s PRO 53 Cb -0.02 -3.55 0.33 0.00 0.04 0.00 0.00 34.50 31.30 1l7y s PRO 53 CO 0.01 -0.42 1.77 0.00 0.04 0.00 0.00 177.00 178.41 1l7y h ALA 54 N 7.37 1.12 -0.51 8.56 0.00 -1.90 -2.68 119.26 131.22 1l7y h ALA 54 Ca -0.33 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.30 1l7y h ALA 54 Cb 1.16 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 1l7y h ALA 54 CO 0.87 0.57 0.17 0.00 0.00 0.00 0.00 179.25 180.86 1l7y h ALA 55 N 1.27 1.34 -0.98 0.00 0.00 -1.97 -2.77 119.26 116.14 1l7y h ALA 55 Ca 0.16 -0.16 -0.66 0.00 0.00 0.00 0.00 54.91 54.25 1l7y h ALA 55 Cb 0.40 -0.21 -0.33 0.00 0.00 0.00 0.00 17.79 17.65 1l7y h ALA 55 CO 0.01 0.48 0.39 2.41 0.00 0.00 0.00 179.25 182.55 1l7y n THR 56 N -4.32 3.28 -3.80 0.00 -1.04 -1.03 -4.97 114.28 102.40 1l7y n THR 56 Ca 0.04 -3.62 -0.09 0.00 -2.04 0.00 0.00 64.05 58.34 1l7y n THR 56 Cb 0.19 -1.18 -0.06 0.00 -1.82 0.00 0.00 70.33 67.45 1l7y n THR 56 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 1l7y s SER 57 N -2.25 0.01 0.18 8.00 0.01 -1.05 -1.61 113.70 116.99 1l7y s SER 57 Ca 0.58 -0.57 -0.04 0.00 1.31 0.00 0.00 55.95 57.24 1l7y s SER 57 Cb 0.47 0.39 -0.03 0.00 0.21 0.00 0.00 66.02 67.05 1l7y s SER 57 CO -0.08 -0.78 0.18 0.00 0.41 0.00 0.00 173.24 172.97 1l7y s ALA 58 N -3.85 0.72 -0.15 1.44 0.00 -0.29 -4.79 121.76 114.84 1l7y s ALA 58 Ca 0.05 -1.41 0.00 0.00 0.00 0.00 0.00 51.96 50.61 1l7y s ALA 58 Cb 0.04 1.13 0.03 0.00 0.00 0.00 0.00 23.12 24.31 1l7y s ALA 58 CO -0.10 -0.61 -0.11 0.42 0.00 0.00 0.00 175.76 175.36 1l7y s ILE 59 N -4.08 1.40 0.44 0.00 1.01 -1.02 -1.03 121.20 117.92 1l7y s ILE 59 Ca 0.29 -0.63 0.06 0.00 0.00 0.00 0.00 60.65 60.38 1l7y s ILE 59 Cb 0.06 -1.40 0.01 0.00 0.01 0.00 0.00 42.46 41.14 1l7y s ILE 59 CO 0.07 0.34 0.61 0.27 0.00 0.00 0.00 174.94 176.23 1l7y s ILE 60 N 1.54 3.03 0.49 2.92 -4.36 0.27 0.34 121.20 125.43 1l7y s ILE 60 Ca 0.03 -0.91 0.05 0.00 -0.26 0.00 0.00 60.65 59.56 1l7y s ILE 60 Cb -0.14 -3.04 0.03 0.00 1.25 0.00 0.00 42.46 40.56 1l7y s ILE 60 CO -0.09 -0.02 0.68 0.42 0.24 0.00 0.00 174.94 176.16 1l7y s THR 61 N -2.43 2.80 0.31 8.37 -4.23 0.04 0.45 115.64 120.94 1l7y s THR 61 Ca 0.55 -0.85 0.26 0.00 -1.18 0.00 0.00 61.69 60.47 1l7y s THR 61 Cb -0.10 -2.95 0.27 0.00 1.34 0.00 0.00 72.50 71.06 1l7y s THR 61 CO 0.34 0.00 1.98 0.78 -0.54 0.00 0.00 174.62 177.18 1l7y h ASN 62 N 0.35 0.00 0.00 3.99 2.35 -1.85 -3.19 115.58 117.23 1l7y h ASN 62 Ca -0.40 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.34 1l7y h ASN 62 Cb 1.29 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.66 1l7y h ASN 62 CO 0.48 0.16 -0.04 0.44 -1.65 0.00 0.00 177.43 176.82 1l7y h ASP 63 N 0.00 0.00 0.00 5.81 3.32 -1.94 -3.49 116.42 120.13 1l7y h ASP 63 Ca -0.00 -0.54 0.00 0.00 0.02 0.00 0.00 57.03 56.51 1l7y h ASP 63 Cb 0.50 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.05 1l7y h ASP 63 CO 0.02 0.79 0.00 0.61 -1.72 0.00 0.00 179.24 178.94 1l7y n GLY 64 N 1.68 -0.66 2.88 2.75 0.00 -1.21 -5.15 105.19 105.48 1l7y n GLY 64 Ca -0.06 0.11 -0.27 0.00 0.00 0.00 0.00 46.02 45.80 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 0.95 -1.04 1.61 1.01 -1.26 -4.90 120.40 116.77 1l7y s VAL 65 Ca 0.00 -0.29 -0.23 0.00 0.00 0.00 0.00 61.98 61.46 1l7y s VAL 65 Cb 0.00 -1.02 0.01 0.00 0.00 0.00 0.00 36.38 35.37 1l7y s VAL 65 CO 0.00 0.31 1.71 -0.83 0.00 0.00 0.00 175.10 176.28 1l7y s GLY 66 N 1.73 0.84 0.15 4.51 0.00 -1.26 -0.78 107.32 112.51 1l7y s GLY 66 Ca 0.04 -2.10 -0.30 0.00 0.00 0.00 0.00 44.72 42.36 1l7y s GLY 66 CO -0.08 3.05 1.27 0.14 0.00 0.00 0.00 173.10 177.49 1l7y s VAL 67 N 7.19 3.50 0.29 1.40 1.01 0.15 -4.92 120.40 129.03 1l7y s VAL 67 Ca 0.57 1.17 0.08 0.00 0.00 0.00 0.00 61.98 63.81 1l7y s VAL 67 Cb -0.02 -3.75 -0.04 0.00 0.00 0.00 0.00 36.38 32.58 1l7y s VAL 67 CO -0.02 0.14 0.11 0.20 0.00 0.00 0.00 175.10 175.53 1l7y s ASN 68 N 0.61 4.89 -1.36 3.32 0.01 -1.26 -2.43 114.94 118.71 1l7y s ASN 68 Ca 0.58 -0.57 -0.13 0.00 -0.71 0.00 0.00 52.86 52.03 1l7y s ASN 68 Cb -0.34 -0.96 -0.03 0.00 0.41 0.00 0.00 41.25 40.32 1l7y s ASN 68 CO 0.34 -0.12 2.39 -0.81 -1.51 0.00 0.00 177.10 177.40 1l7y n PRO 69 N -1.07 2.84 0.00 -0.60 -0.04 -1.26 -4.06 135.00 130.81 1l7y n PRO 69 Ca -0.05 -2.27 0.00 0.00 -0.04 0.00 0.00 63.50 61.13 1l7y n PRO 69 Cb 0.59 -3.02 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 5.38 2.06 -2.02 0.55 0.00 -1.26 -4.23 120.51 120.99 1l7y n ALA 70 Ca 0.59 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.74 1l7y n ALA 70 Cb 0.32 0.21 0.02 0.00 0.00 0.00 0.00 19.45 20.01 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 -1.47 3.18 0.60 0.00 1.11 -1.26 -4.79 119.66 117.04 1l7y s GLN 71 Ca 0.00 0.33 -0.14 0.00 0.01 0.00 0.00 55.36 55.56 1l7y s GLN 71 Cb 0.00 -2.18 -0.04 0.00 -1.01 0.00 0.00 33.01 29.78 1l7y s GLN 71 CO 0.00 -0.66 1.03 -1.25 0.01 0.00 0.00 175.29 174.42 1l7y s PRO 72 N -5.08 3.46 0.28 2.91 0.04 -1.26 -0.67 135.00 134.67 1l7y s PRO 72 Ca 0.54 0.98 0.00 0.00 0.04 0.00 0.00 61.00 62.56 1l7y s PRO 72 Cb -0.11 -2.06 0.51 0.00 0.04 0.00 0.00 34.50 32.88 1l7y s PRO 72 CO 0.49 -0.68 1.85 0.00 0.04 0.00 0.00 177.00 178.69 1l7y h ALA 73 N 0.14 1.48 -0.31 8.56 0.00 -1.24 -0.41 119.26 127.48 1l7y h ALA 73 Ca -0.46 0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.48 1l7y h ALA 73 Cb 1.20 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 1l7y h ALA 73 CO 0.59 0.28 0.16 0.78 0.00 0.00 0.00 179.25 181.07 1l7y h GLY 74 N 1.04 0.41 1.20 0.00 0.00 -1.81 -0.67 103.07 103.24 1l7y h GLY 74 Ca 0.48 -0.12 -0.13 0.00 0.00 0.00 0.00 47.33 47.56 1l7y h GLY 74 CO -0.24 0.10 -0.22 -0.57 0.00 0.00 0.00 176.54 175.60 1l7y h ASN 75 N 0.34 0.93 -0.87 0.19 -0.73 -1.71 -1.21 115.58 112.52 1l7y h ASN 75 Ca 0.12 -0.35 -0.01 0.00 1.87 0.00 0.00 56.30 57.93 1l7y h ASN 75 Cb 0.03 -0.26 -0.04 0.00 0.27 0.00 0.00 38.32 38.32 1l7y h ASN 75 CO -0.08 1.12 0.50 0.40 -0.37 0.00 0.00 177.43 179.00 1l7y h ILE 76 N 0.79 1.25 -0.12 2.57 1.08 -0.72 -0.09 117.51 122.26 1l7y h ILE 76 Ca 0.10 -0.58 -0.20 0.00 -0.39 0.00 0.00 64.86 63.79 1l7y h ILE 76 Cb 0.78 0.06 0.00 0.00 -3.07 0.00 0.00 36.82 34.59 1l7y h ILE 76 CO 0.06 0.27 -0.73 0.15 -0.69 0.00 0.00 178.15 177.22 1l7y h PHE 77 N 1.20 0.78 -0.46 1.37 3.57 -0.98 0.96 116.94 123.37 1l7y h PHE 77 Ca 0.31 -0.33 -0.13 0.00 3.53 0.00 0.00 57.97 61.35 1l7y h PHE 77 Cb -0.01 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 38.60 1l7y h PHE 77 CO 0.00 1.12 -0.21 -0.07 -2.23 0.00 0.00 178.31 176.92 1l7y h LEU 78 N 0.40 0.96 0.00 0.59 3.38 -0.81 -1.89 115.31 117.95 1l7y h LEU 78 Ca -0.03 -0.36 -0.09 0.00 0.09 0.00 0.00 57.88 57.48 1l7y h LEU 78 Cb 1.32 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.79 1l7y h LEU 78 CO 0.14 1.14 -0.68 0.11 0.09 0.00 0.00 178.44 179.23 1l7y h LYS 79 N 0.82 0.00 0.00 1.13 6.56 -1.05 -3.44 116.57 120.59 1l7y h LYS 79 Ca 0.11 0.00 -0.10 0.00 -1.06 0.00 0.00 60.65 59.60 1l7y h LYS 79 Cb 0.77 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 32.42 1l7y h LYS 79 CO 0.06 0.54 -0.86 0.72 -2.06 0.00 0.00 179.45 177.85 1l7y n HIS 80 N -4.56 0.91 0.00 -1.35 8.25 0.20 -4.79 115.22 113.88 1l7y n HIS 80 Ca -0.17 0.39 0.00 0.00 -0.26 0.00 0.00 57.72 57.69 1l7y n HIS 80 Cb 0.43 -0.89 0.00 0.00 1.12 0.00 0.00 29.99 30.65 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 1.53 0.41 0.10 -1.41 0.00 -0.44 -3.84 105.19 101.53 1l7y n GLY 81 Ca -0.18 -1.48 -0.06 0.00 0.00 0.00 0.00 46.02 44.30 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 3.11 -4.57 1.61 2.88 -1.26 -4.29 113.62 111.11 1l7y n SER 82 Ca 0.00 -0.03 -0.38 0.00 -1.33 0.00 0.00 58.87 57.12 1l7y n SER 82 Cb 0.00 -0.15 -0.03 0.00 -0.75 0.00 0.00 64.21 63.28 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 -2.17 2.44 0.26 -1.46 0.41 -1.25 -0.60 118.70 116.33 1l7y s GLU 83 Ca -0.12 1.58 0.03 0.00 -0.41 0.00 0.00 54.97 56.06 1l7y s GLU 83 Cb 0.03 -4.51 -0.04 0.00 -1.78 0.00 0.00 34.13 27.83 1l7y s GLU 83 CO 0.19 -2.89 0.19 -0.51 -0.49 0.00 0.00 175.26 171.76 1l7y s LEU 84 N 10.88 1.45 0.03 1.80 1.43 0.59 -3.21 118.68 131.65 1l7y s LEU 84 Ca 0.98 -1.56 -0.03 0.00 -1.03 0.00 0.00 54.13 52.49 1l7y s LEU 84 Cb -0.22 0.43 -0.02 0.00 0.03 0.00 0.00 46.19 46.41 1l7y s LEU 84 CO 0.29 -0.93 0.03 -0.13 0.23 0.00 0.00 176.35 175.83 1l7y s ARG 85 N -3.84 0.48 -0.21 1.70 0.52 0.17 -3.12 118.95 114.66 1l7y s ARG 85 Ca 0.39 -0.76 -0.07 0.00 -0.52 0.00 0.00 55.73 54.77 1l7y s ARG 85 Cb 0.05 0.18 -0.04 0.00 0.52 0.00 0.00 34.95 35.66 1l7y s ARG 85 CO 0.19 -0.10 0.07 -1.17 0.02 0.00 0.00 175.30 174.31 1l7y s LEU 86 N -1.97 3.65 -0.08 2.53 2.96 0.54 -0.56 118.68 125.75 1l7y s LEU 86 Ca -0.08 -0.05 0.04 0.00 -0.22 0.00 0.00 54.13 53.82 1l7y s LEU 86 Cb -0.03 -1.95 0.00 0.00 0.50 0.00 0.00 46.19 44.71 1l7y s LEU 86 CO -0.04 0.08 -0.20 -0.51 -1.32 0.00 0.00 176.35 174.36 1l7y s ILE 87 N 0.94 1.74 -0.08 6.68 2.07 -0.20 -2.38 121.20 129.97 1l7y s ILE 87 Ca 0.04 -0.84 -0.30 0.00 -1.41 0.00 0.00 60.65 58.14 1l7y s ILE 87 Cb -0.14 -1.51 -0.03 0.00 0.13 0.00 0.00 42.46 40.91 1l7y s ILE 87 CO 0.03 0.49 1.24 -2.16 -1.91 0.00 0.00 174.94 172.62 1l7y s PRO 88 N 0.36 4.31 0.50 3.50 0.04 -1.26 -1.13 135.00 141.32 1l7y s PRO 88 Ca -0.15 1.70 -0.12 0.00 0.04 0.00 0.00 61.00 62.46 1l7y s PRO 88 Cb -0.16 -3.62 -0.06 0.00 0.04 0.00 0.00 34.50 30.70 1l7y s PRO 88 CO 0.06 -0.53 0.91 1.03 0.04 0.00 0.00 177.00 178.52 1l7y s ARG 89 N 2.57 3.78 0.52 4.56 1.81 -0.63 -4.90 118.95 126.66 1l7y s ARG 89 Ca 0.56 0.70 -0.20 0.00 -1.72 0.00 0.00 55.73 55.07 1l7y s ARG 89 Cb -0.24 -2.22 -0.06 0.00 -0.45 0.00 0.00 34.95 31.97 1l7y s ARG 89 CO 0.20 -0.26 1.14 0.16 -0.68 0.00 0.00 175.30 175.86 1l7y s ASP 90 N -3.44 5.88 -0.42 0.23 1.47 -1.26 -4.74 116.67 114.38 1l7y s ASP 90 Ca 0.55 2.20 -0.21 0.00 1.18 0.00 0.00 52.55 56.27 1l7y s ASP 90 Cb -0.10 -2.59 0.02 0.00 -0.34 0.00 0.00 42.92 39.91 1l7y s ASP 90 CO 0.38 -1.11 0.65 -0.60 0.68 0.00 0.00 175.17 175.17 1l7y s ARG 91 N -3.11 3.41 0.02 2.11 3.00 -1.26 -4.81 118.95 118.31 1l7y s ARG 91 Ca 0.70 -0.22 0.00 0.00 -1.00 0.00 0.00 55.73 55.21 1l7y s ARG 91 Cb -0.25 -3.91 0.00 0.00 0.00 0.00 0.00 34.95 30.79 1l7y s ARG 91 CO 0.29 -0.94 0.00 1.33 0.00 0.00 0.00 175.30 175.98 1l7y n VAL 92 N 5.81 0.05 -2.81 7.11 0.24 -1.26 -5.00 118.33 122.47 1l7y n VAL 92 Ca -0.01 0.02 -0.11 0.00 -2.04 0.00 0.00 64.34 62.20 1l7y n VAL 92 Cb 0.48 -0.92 0.07 0.00 -1.47 0.00 0.00 33.84 32.00 1l7y n VAL 92 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1l7y n GLY 93 N 2.15 1.24 0.64 7.63 0.00 -1.26 -5.30 105.19 110.28 1l7y n GLY 93 Ca 0.00 -0.34 0.08 0.00 0.00 0.00 0.00 46.02 45.76 1l7y n GLY 93 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74