#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 5.37 -3.19 7.83 3.41 -1.26 -4.62 113.62 121.17 1l7y n SER 2 Ca 0.00 -3.01 -0.15 0.00 -0.26 0.00 0.00 58.87 55.45 1l7y n SER 2 Cb 0.00 -1.48 0.07 0.00 -0.26 0.00 0.00 64.21 62.54 1l7y n SER 2 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1l7y n GLY 3 N 3.40 -0.96 3.04 5.00 0.00 -1.26 -3.99 105.19 110.41 1l7y n GLY 3 Ca 0.31 0.48 0.00 0.00 0.00 0.00 0.00 46.02 46.81 1l7y n GLY 3 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1l7y n GLY 4 N -1.23 1.38 0.59 -0.02 0.00 -1.26 -3.61 105.19 101.04 1l7y n GLY 4 Ca -0.10 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.39 1l7y n GLY 4 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1l7y n THR 5 N 0.00 0.00 0.00 2.61 -1.04 -1.26 -4.94 114.28 109.65 1l7y n THR 5 Ca 0.00 0.19 0.00 0.00 -2.04 0.00 0.00 64.05 62.20 1l7y n THR 5 Cb 0.00 -1.18 0.00 0.00 -1.82 0.00 0.00 70.33 67.33 1l7y n THR 5 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1l7y n ALA 6 N -2.45 0.00 -2.37 2.41 0.00 -1.26 -4.64 120.51 112.20 1l7y n ALA 6 Ca 0.00 0.00 -0.38 0.00 0.00 0.00 0.00 53.44 53.06 1l7y n ALA 6 Cb 0.00 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.47 1l7y n ALA 6 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1l7y n ALA 7 N -3.00 6.03 -2.05 0.00 0.00 -1.26 -4.55 120.51 115.68 1l7y n ALA 7 Ca 0.00 -4.40 -0.19 0.00 0.00 0.00 0.00 53.44 48.85 1l7y n ALA 7 Cb 0.00 -1.82 0.05 0.00 0.00 0.00 0.00 19.45 17.68 1l7y n ALA 7 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1l7y s THR 8 N -4.76 2.27 0.70 0.00 -4.23 -1.24 -5.06 115.64 103.33 1l7y s THR 8 Ca 0.46 -1.03 -0.15 0.00 -1.18 0.00 0.00 61.69 59.79 1l7y s THR 8 Cb 0.32 -2.31 0.02 0.00 1.34 0.00 0.00 72.50 71.87 1l7y s THR 8 CO -0.25 0.00 1.16 0.28 -0.54 0.00 0.00 174.62 175.27 1l7y s THR 9 N -2.61 2.72 -0.57 3.99 -1.32 -1.26 -4.18 115.64 112.41 1l7y s THR 9 Ca 0.59 0.35 -0.27 0.00 -1.21 0.00 0.00 61.69 61.15 1l7y s THR 9 Cb -0.06 -2.89 0.00 0.00 -1.51 0.00 0.00 72.50 68.04 1l7y s THR 9 CO 0.37 -0.20 1.56 0.00 -2.21 0.00 0.00 174.62 174.14 1l7y s ALA 10 N -2.13 2.64 -0.40 11.08 0.00 -1.26 -4.18 121.76 127.51 1l7y s ALA 10 Ca 0.71 -0.64 0.02 0.00 0.00 0.00 0.00 51.96 52.05 1l7y s ALA 10 Cb -0.25 -4.16 0.12 0.00 0.00 0.00 0.00 23.12 18.82 1l7y s ALA 10 CO 0.43 -3.20 0.17 0.20 0.00 0.00 0.00 175.76 173.36 1l7y s GLY 11 N 5.51 1.70 -0.75 0.00 0.00 -1.26 -5.01 107.32 107.52 1l7y s GLY 11 Ca 0.57 -2.47 -0.23 0.00 0.00 0.00 0.00 44.72 42.60 1l7y s GLY 11 CO 0.24 1.36 1.11 -1.35 0.00 0.00 0.00 173.10 174.45 1l7y s SER 12 N 0.67 6.26 0.11 1.64 1.04 -1.26 -4.75 113.70 117.40 1l7y s SER 12 Ca 0.14 -1.03 0.06 0.00 0.48 0.00 0.00 55.95 55.60 1l7y s SER 12 Cb -0.22 -2.47 -0.04 0.00 0.10 0.00 0.00 66.02 63.40 1l7y s SER 12 CO -0.08 -1.50 -0.15 -0.54 0.98 0.00 0.00 173.24 171.95 1l7y s LYS 13 N 4.39 0.99 -0.22 4.02 1.02 -1.26 -4.38 119.74 124.30 1l7y s LYS 13 Ca 0.29 -1.16 -0.06 0.00 0.02 0.00 0.00 55.97 55.06 1l7y s LYS 13 Cb -0.12 -0.95 -0.02 0.00 -0.52 0.00 0.00 37.83 36.22 1l7y s LYS 13 CO 0.07 0.19 0.02 0.14 -0.92 0.00 0.00 175.35 174.85 1l7y s VAL 14 N -1.81 4.01 0.03 3.17 -7.23 0.26 -4.94 120.40 113.89 1l7y s VAL 14 Ca 0.06 -0.28 -0.01 0.00 -1.81 0.00 0.00 61.98 59.94 1l7y s VAL 14 Cb -0.07 -2.84 -0.04 0.00 0.56 0.00 0.00 36.38 33.99 1l7y s VAL 14 CO 0.03 0.40 0.18 0.28 -0.31 0.00 0.00 175.10 175.67 1l7y s THR 15 N 1.26 5.27 -0.03 5.32 -1.32 -1.26 -2.49 115.64 122.38 1l7y s THR 15 Ca 0.04 -0.34 0.04 0.00 -1.21 0.00 0.00 61.69 60.22 1l7y s THR 15 Cb -0.15 -3.51 -0.00 0.00 -1.51 0.00 0.00 72.50 67.33 1l7y s THR 15 CO 0.02 0.22 -0.15 -0.36 -2.21 0.00 0.00 174.62 172.14 1l7y s PHE 16 N -1.40 1.50 -0.42 9.09 0.08 -0.29 -4.49 117.98 122.05 1l7y s PHE 16 Ca 0.31 -0.39 -0.08 0.00 0.12 0.00 0.00 56.93 56.88 1l7y s PHE 16 Cb -0.13 -1.01 0.09 0.00 -0.57 0.00 0.00 43.02 41.40 1l7y s PHE 16 CO 0.23 -0.12 0.26 0.21 -0.10 0.00 0.00 175.22 175.70 1l7y s LYS 17 N -0.01 2.49 -0.22 0.44 2.20 0.57 -0.94 119.74 124.26 1l7y s LYS 17 Ca -0.02 -1.57 -0.10 0.00 -0.36 0.00 0.00 55.97 53.92 1l7y s LYS 17 Cb -0.10 -3.76 -0.05 0.00 -1.51 0.00 0.00 37.83 32.41 1l7y s LYS 17 CO 0.01 -1.01 0.13 0.42 -0.36 0.00 0.00 175.35 174.54 1l7y s ILE 18 N 1.36 5.25 0.24 5.43 1.09 -0.07 0.00 121.20 134.51 1l7y s ILE 18 Ca 0.04 0.14 0.06 0.00 -1.10 0.00 0.00 60.65 59.79 1l7y s ILE 18 Cb -0.24 -3.42 -0.05 0.00 -1.06 0.00 0.00 42.46 37.69 1l7y s ILE 18 CO 0.00 0.39 -0.07 0.28 -0.10 0.00 0.00 174.94 175.44 1l7y s THR 19 N 0.79 1.49 0.57 2.92 -1.32 -0.83 -1.98 115.64 117.28 1l7y s THR 19 Ca 0.07 -2.12 -0.18 0.00 -1.21 0.00 0.00 61.69 58.25 1l7y s THR 19 Cb -0.13 -2.29 -0.04 0.00 -1.51 0.00 0.00 72.50 68.53 1l7y s THR 19 CO 0.02 -0.41 1.09 -0.22 -2.21 0.00 0.00 174.62 172.89 1l7y s LEU 20 N -3.36 3.63 -0.07 9.08 0.20 -1.25 -1.39 118.68 125.51 1l7y s LEU 20 Ca 0.27 2.00 -0.14 0.00 0.69 0.00 0.00 54.13 56.95 1l7y s LEU 20 Cb 0.03 -4.56 -0.29 0.00 -0.43 0.00 0.00 46.19 40.94 1l7y s LEU 20 CO 0.09 -1.22 0.63 0.71 -0.29 0.00 0.00 176.35 176.27 1l7y h THR 21 N 0.82 1.02 -0.13 3.68 1.35 -1.95 -3.38 112.91 114.32 1l7y h THR 21 Ca -0.48 -2.46 -0.04 0.00 -0.55 0.00 0.00 66.41 62.87 1l7y h THR 21 Cb 1.24 2.77 -0.00 0.00 -1.73 0.00 0.00 68.15 70.43 1l7y h THR 21 CO 0.57 0.77 -0.08 0.77 -0.25 0.00 0.00 175.52 177.30 1l7y h SER 22 N -0.13 0.30 -2.63 5.36 4.64 -1.93 -3.45 113.55 115.71 1l7y h SER 22 Ca -0.31 -0.44 -0.62 0.00 -0.47 0.00 0.00 61.79 59.95 1l7y h SER 22 Cb 1.91 -0.08 -0.15 0.00 -0.31 0.00 0.00 62.40 63.77 1l7y h SER 22 CO 0.12 0.67 -0.76 1.51 -0.87 0.00 0.00 176.83 177.50 1l7y s ASP 23 N -5.97 3.78 0.09 4.97 -4.77 -1.26 -5.04 116.67 108.47 1l7y s ASP 23 Ca -0.14 -0.86 -0.11 0.00 -3.30 0.00 0.00 52.55 48.14 1l7y s ASP 23 Cb 0.05 -0.43 -0.19 0.00 -1.09 0.00 0.00 42.92 41.26 1l7y s ASP 23 CO 0.73 0.07 1.23 1.55 0.70 0.00 0.00 175.17 179.45 1l7y h PRO 24 N 2.60 0.61 -2.96 2.11 0.13 -1.88 -3.31 132.00 129.30 1l7y h PRO 24 Ca -0.44 -0.66 0.00 0.00 -0.87 0.00 0.00 66.00 64.03 1l7y h PRO 24 Cb 1.23 0.19 0.00 0.00 0.13 0.00 0.00 31.00 32.55 1l7y h PRO 24 CO 0.55 1.26 -0.63 1.17 -0.23 0.00 0.00 178.00 180.13 1l7y n LYS 25 N -3.82 -3.57 0.27 0.86 4.81 -1.26 -4.46 118.16 110.99 1l7y n LYS 25 Ca -0.10 2.64 -0.16 0.00 -0.87 0.00 0.00 58.31 59.83 1l7y n LYS 25 Cb 0.87 -2.77 -0.08 0.00 0.02 0.00 0.00 35.03 33.06 1l7y n LYS 25 CO 0.00 0.00 0.00 -0.07 1.17 0.00 0.00 177.40 178.50 1l7y h LEU 26 N 2.44 -0.56 -9.47 3.14 -0.00 -2.04 -3.42 115.31 105.41 1l7y h LEU 26 Ca 0.00 -0.02 -0.53 0.00 -0.00 0.00 0.00 57.88 57.33 1l7y h LEU 26 Cb 0.00 0.14 -0.01 0.00 -0.00 0.00 0.00 40.66 40.79 1l7y h LEU 26 CO 0.00 -0.34 0.42 -2.16 -0.00 0.00 0.00 178.44 176.36 1l7y s PRO 27 N -5.76 4.56 0.06 1.13 0.04 -1.26 -5.05 135.00 128.72 1l7y s PRO 27 Ca -0.16 1.52 0.03 0.00 0.04 0.00 0.00 61.00 62.43 1l7y s PRO 27 Cb 0.03 -3.41 -0.04 0.00 0.04 0.00 0.00 34.50 31.13 1l7y s PRO 27 CO 0.61 -0.04 0.05 -0.06 0.04 0.00 0.00 177.00 177.59 1l7y s PHE 28 N 0.76 3.13 -0.68 0.56 0.08 -1.26 -4.99 117.98 115.57 1l7y s PHE 28 Ca 0.52 0.06 -0.23 0.00 0.12 0.00 0.00 56.93 57.40 1l7y s PHE 28 Cb -0.24 -1.62 0.07 0.00 -0.57 0.00 0.00 43.02 40.66 1l7y s PHE 28 CO 0.29 0.51 1.02 0.15 -0.10 0.00 0.00 175.22 177.08 1l7y s LYS 29 N -2.19 3.13 -0.28 0.44 3.01 -0.84 -4.94 119.74 118.07 1l7y s LYS 29 Ca 0.26 -0.77 -0.12 0.00 -1.01 0.00 0.00 55.97 54.33 1l7y s LYS 29 Cb -0.12 -4.24 -0.05 0.00 -1.01 0.00 0.00 37.83 32.41 1l7y s LYS 29 CO 0.19 -1.87 0.23 0.08 0.51 0.00 0.00 175.35 174.49 1l7y s VAL 30 N 4.28 5.28 -0.31 3.17 1.01 -1.26 -0.89 120.40 131.68 1l7y s VAL 30 Ca 0.24 0.23 -0.02 0.00 0.00 0.00 0.00 61.98 62.43 1l7y s VAL 30 Cb -0.15 -3.58 0.05 0.00 0.00 0.00 0.00 36.38 32.70 1l7y s VAL 30 CO 0.10 0.21 0.01 -0.76 0.00 0.00 0.00 175.10 174.67 1l7y s LEU 31 N 1.82 3.97 -0.41 3.92 1.43 -0.12 -4.92 118.68 124.37 1l7y s LEU 31 Ca 0.09 -1.29 -0.16 0.00 -1.03 0.00 0.00 54.13 51.74 1l7y s LEU 31 Cb -0.16 -1.73 0.02 0.00 0.03 0.00 0.00 46.19 44.35 1l7y s LEU 31 CO 0.11 -0.27 0.36 -0.44 0.23 0.00 0.00 176.35 176.33 1l7y s SER 32 N 1.28 6.15 0.07 2.29 0.01 -1.26 -1.13 113.70 121.10 1l7y s SER 32 Ca -0.05 -0.78 0.00 0.00 1.31 0.00 0.00 55.95 56.44 1l7y s SER 32 Cb -0.20 -2.19 -0.04 0.00 0.21 0.00 0.00 66.02 63.80 1l7y s SER 32 CO -0.01 -0.50 -0.05 0.68 0.41 0.00 0.00 173.24 173.78 1l7y s VAL 33 N 1.88 0.45 0.73 3.43 -7.23 -1.04 -4.99 120.40 113.63 1l7y s VAL 33 Ca 0.08 -1.84 -0.11 0.00 -1.81 0.00 0.00 61.98 58.30 1l7y s VAL 33 Cb -0.18 -1.56 0.03 0.00 0.56 0.00 0.00 36.38 35.23 1l7y s VAL 33 CO 0.12 -0.92 1.07 -2.16 -0.31 0.00 0.00 175.10 172.90 1l7y s PRO 34 N -3.79 2.61 0.52 4.82 0.04 -1.26 -0.58 135.00 137.37 1l7y s PRO 34 Ca 0.09 0.82 0.17 0.00 0.04 0.00 0.00 61.00 62.12 1l7y s PRO 34 Cb 0.06 -1.96 1.30 0.00 0.04 0.00 0.00 34.50 33.94 1l7y s PRO 34 CO -0.07 -1.30 2.16 0.93 0.04 0.00 0.00 177.00 178.76 1l7y h GLU 35 N -0.86 0.00 -0.77 4.56 3.07 -1.93 -1.79 114.58 116.87 1l7y h GLU 35 Ca -0.45 0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.40 1l7y h GLU 35 Cb 1.23 0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 29.11 1l7y h GLU 35 CO 0.58 0.00 0.46 0.66 -1.40 0.00 0.00 179.01 179.31 1l7y h SER 36 N 0.00 0.93 -2.66 1.42 4.64 -1.95 -3.26 113.55 112.67 1l7y h SER 36 Ca -0.00 -0.06 -0.53 0.00 -0.47 0.00 0.00 61.79 60.73 1l7y h SER 36 Cb 0.00 -0.24 0.02 0.00 -0.31 0.00 0.00 62.40 61.88 1l7y h SER 36 CO 0.00 0.72 1.02 -0.89 -0.87 0.00 0.00 176.83 176.81 1l7y s THR 37 N -5.77 2.99 0.70 2.95 2.01 -0.67 -4.80 115.64 113.04 1l7y s THR 37 Ca -0.11 0.43 -0.11 0.00 0.31 0.00 0.00 61.69 62.21 1l7y s THR 37 Cb 0.17 -3.28 0.01 0.00 0.01 0.00 0.00 72.50 69.41 1l7y s THR 37 CO 0.80 -0.00 1.08 -2.16 -0.69 0.00 0.00 174.62 173.64 1l7y s PRO 38 N 2.70 2.92 0.38 4.92 0.04 -1.26 -0.99 135.00 143.71 1l7y s PRO 38 Ca 0.75 0.63 0.28 0.00 0.04 0.00 0.00 61.00 62.69 1l7y s PRO 38 Cb -0.40 -2.01 1.28 0.00 0.04 0.00 0.00 34.50 33.41 1l7y s PRO 38 CO 0.33 -1.03 1.84 0.35 0.04 0.00 0.00 177.00 178.52 1l7y h PHE 39 N -0.66 0.00 -0.46 0.56 3.57 -1.04 -2.63 116.94 116.29 1l7y h PHE 39 Ca -0.45 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.05 1l7y h PHE 39 Cb 1.23 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.95 1l7y h PHE 39 CO 0.55 0.00 0.30 1.79 -2.23 0.00 0.00 178.31 178.72 1l7y h THR 40 N 0.00 1.13 0.04 4.41 1.35 -1.79 0.25 112.91 118.29 1l7y h THR 40 Ca 0.00 -0.24 -0.25 0.00 -0.55 0.00 0.00 66.41 65.36 1l7y h THR 40 Cb 0.26 0.46 0.01 0.00 -1.73 0.00 0.00 68.15 67.16 1l7y h THR 40 CO 0.00 0.12 -1.05 0.00 -0.25 0.00 0.00 175.52 174.34 1l7y h ALA 41 N 1.16 0.21 0.09 6.62 0.00 -1.86 -2.09 119.26 123.40 1l7y h ALA 41 Ca 0.17 -0.74 -0.00 0.00 0.00 0.00 0.00 54.91 54.34 1l7y h ALA 41 Cb -0.06 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.76 1l7y h ALA 41 CO -0.04 0.77 -0.05 0.28 0.00 0.00 0.00 179.25 180.22 1l7y h VAL 42 N 0.27 0.96 -0.48 0.00 2.07 -1.26 -0.65 116.25 117.15 1l7y h VAL 42 Ca -0.12 -0.19 -0.06 0.00 0.82 0.00 0.00 66.70 67.15 1l7y h VAL 42 Cb 1.71 1.08 -0.02 0.00 -1.52 0.00 0.00 31.29 32.54 1l7y h VAL 42 CO 0.19 0.05 0.04 0.25 0.02 0.00 0.00 177.57 178.12 1l7y h LEU 43 N -0.21 0.73 -0.35 2.57 6.46 -0.60 -0.80 115.31 123.12 1l7y h LEU 43 Ca -0.01 -0.16 -0.01 0.00 -0.12 0.00 0.00 57.88 57.58 1l7y h LEU 43 Cb 0.17 -0.19 -0.02 0.00 -0.73 0.00 0.00 40.66 39.89 1l7y h LEU 43 CO 0.02 0.77 0.19 0.50 -0.62 0.00 0.00 178.44 179.31 1l7y h LYS 44 N 0.73 0.48 -0.36 1.25 3.64 -1.07 0.25 116.57 121.49 1l7y h LYS 44 Ca 0.15 -0.06 -0.08 0.00 -1.27 0.00 0.00 60.65 59.39 1l7y h LYS 44 Cb 0.39 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.10 1l7y h LYS 44 CO 0.01 0.40 -0.10 0.35 -2.27 0.00 0.00 179.45 177.84 1l7y h PHE 45 N 0.43 0.80 -0.48 1.91 3.57 -0.87 -1.51 116.94 120.79 1l7y h PHE 45 Ca 0.12 -0.17 0.01 0.00 3.53 0.00 0.00 57.97 61.45 1l7y h PHE 45 Cb 0.06 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 38.58 1l7y h PHE 45 CO -0.03 0.86 0.32 0.00 -2.23 0.00 0.00 178.31 177.23 1l7y h ALA 46 N 0.82 0.61 -0.64 2.41 0.00 -0.93 -1.71 119.26 119.82 1l7y h ALA 46 Ca 0.09 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 1l7y h ALA 46 Cb 0.61 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 1l7y h ALA 46 CO 0.04 0.06 0.15 0.00 0.00 0.00 0.00 179.25 179.49 1l7y h ALA 47 N 1.18 1.05 -0.46 0.00 0.00 -0.86 0.52 119.26 120.69 1l7y h ALA 47 Ca 0.18 -0.23 0.01 0.00 0.00 0.00 0.00 54.91 54.86 1l7y h ALA 47 Cb -0.07 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.44 1l7y h ALA 47 CO -0.04 0.62 0.30 1.49 0.00 0.00 0.00 179.25 181.62 1l7y h GLU 48 N 0.97 0.59 -0.02 0.00 4.81 -0.70 -0.60 114.58 119.62 1l7y h GLU 48 Ca 0.20 -0.04 -0.15 0.00 -0.13 0.00 0.00 59.36 59.25 1l7y h GLU 48 Cb 0.35 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 29.58 1l7y h GLU 48 CO 0.00 0.39 -0.67 0.93 -0.73 0.00 0.00 179.01 178.94 1l7y h GLU 49 N 0.61 0.11 0.00 1.92 3.07 -1.07 -2.87 114.58 116.35 1l7y h GLU 49 Ca 0.17 -0.09 0.00 0.00 -0.50 0.00 0.00 59.36 58.94 1l7y h GLU 49 Cb -0.05 0.02 0.00 0.00 -0.84 0.00 0.00 28.75 27.87 1l7y h GLU 49 CO -0.05 0.73 0.00 1.19 -1.40 0.00 0.00 179.01 179.49 1l7y n PHE 50 N -3.79 0.00 -3.44 4.33 3.72 0.15 -4.89 117.46 113.54 1l7y n PHE 50 Ca -0.02 0.00 -0.20 0.00 -0.05 0.00 0.00 57.45 57.18 1l7y n PHE 50 Cb 0.66 0.00 0.07 0.00 -0.94 0.00 0.00 39.48 39.27 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 -0.98 -6.84 -4.16 -1.08 5.02 -0.48 -5.01 118.16 104.62 1l7y n LYS 51 Ca 0.22 0.71 -0.14 0.00 -2.02 0.00 0.00 58.31 57.09 1l7y n LYS 51 Cb 0.10 -5.41 -0.11 0.00 -0.02 0.00 0.00 35.03 29.60 1l7y n LYS 51 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1l7y s VAL 52 N -3.27 0.84 0.05 -0.18 -7.23 -0.36 -5.04 120.40 105.20 1l7y s VAL 52 Ca 0.50 -1.60 -0.30 0.00 -1.81 0.00 0.00 61.98 58.76 1l7y s VAL 52 Cb -0.22 -1.30 -0.05 0.00 0.56 0.00 0.00 36.38 35.37 1l7y s VAL 52 CO 0.63 -0.58 1.12 -2.16 -0.31 0.00 0.00 175.10 173.80 1l7y s PRO 53 N -2.77 4.48 0.46 4.82 0.04 -1.26 -4.10 135.00 136.67 1l7y s PRO 53 Ca 0.04 1.65 0.16 0.00 0.04 0.00 0.00 61.00 62.89 1l7y s PRO 53 Cb -0.03 -3.38 1.08 0.00 0.04 0.00 0.00 34.50 32.21 1l7y s PRO 53 CO -0.01 -0.17 2.02 0.00 0.04 0.00 0.00 177.00 178.88 1l7y h ALA 54 N 6.70 1.69 0.00 8.56 0.00 -1.90 -1.04 119.26 133.26 1l7y h ALA 54 Ca -0.42 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.35 1l7y h ALA 54 Cb 1.22 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1l7y h ALA 54 CO 0.79 0.20 0.00 0.00 0.00 0.00 0.00 179.25 180.23 1l7y n ALA 55 N -2.49 1.85 -2.63 0.00 0.00 -1.26 -3.42 120.51 112.56 1l7y n ALA 55 Ca -0.02 -0.01 -0.11 0.00 0.00 0.00 0.00 53.44 53.29 1l7y n ALA 55 Cb 0.23 -1.35 0.03 0.00 0.00 0.00 0.00 19.45 18.35 1l7y n ALA 55 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1l7y n THR 56 N -1.84 1.27 -3.77 0.00 -1.04 -0.42 -2.30 114.28 106.18 1l7y n THR 56 Ca 0.04 -3.36 -0.13 0.00 -2.04 0.00 0.00 64.05 58.56 1l7y n THR 56 Cb 0.25 0.38 -0.08 0.00 -1.82 0.00 0.00 70.33 69.06 1l7y n THR 56 CO 0.00 0.00 0.00 -0.94 -0.64 0.00 0.00 175.07 173.49 1l7y s SER 57 N -3.26 -0.16 0.12 8.00 1.04 -0.16 -3.22 113.70 116.06 1l7y s SER 57 Ca 0.31 0.00 -0.06 0.00 0.48 0.00 0.00 55.95 56.69 1l7y s SER 57 Cb 0.44 0.32 -0.02 0.00 0.10 0.00 0.00 66.02 66.85 1l7y s SER 57 CO -0.00 -0.48 0.15 0.00 0.98 0.00 0.00 173.24 173.88 1l7y s ALA 58 N -1.61 0.24 -0.13 5.32 0.00 0.09 -4.63 121.76 121.03 1l7y s ALA 58 Ca -0.12 -1.01 0.01 0.00 0.00 0.00 0.00 51.96 50.84 1l7y s ALA 58 Cb -0.04 0.66 0.02 0.00 0.00 0.00 0.00 23.12 23.76 1l7y s ALA 58 CO 0.02 -0.52 -0.16 0.42 0.00 0.00 0.00 175.76 175.52 1l7y s ILE 59 N -3.95 1.60 0.44 0.00 1.01 -1.06 -0.72 121.20 118.53 1l7y s ILE 59 Ca 0.14 -0.68 0.08 0.00 0.00 0.00 0.00 60.65 60.19 1l7y s ILE 59 Cb 0.06 -1.48 0.02 0.00 0.01 0.00 0.00 42.46 41.07 1l7y s ILE 59 CO -0.04 0.46 0.59 0.27 0.00 0.00 0.00 174.94 176.22 1l7y s ILE 60 N 1.20 2.86 0.23 2.92 -4.36 0.51 0.92 121.20 125.47 1l7y s ILE 60 Ca -0.01 -1.02 0.08 0.00 -0.26 0.00 0.00 60.65 59.43 1l7y s ILE 60 Cb -0.14 -2.88 -0.04 0.00 1.25 0.00 0.00 42.46 40.65 1l7y s ILE 60 CO -0.06 0.00 0.09 -0.89 0.24 0.00 0.00 174.94 174.32 1l7y s THR 61 N -2.40 3.99 0.56 8.37 2.01 -0.16 -0.69 115.64 127.32 1l7y s THR 61 Ca 0.55 -1.53 0.29 0.00 0.31 0.00 0.00 61.69 61.31 1l7y s THR 61 Cb -0.09 -3.10 0.41 0.00 0.01 0.00 0.00 72.50 69.72 1l7y s THR 61 CO 0.33 -0.28 1.93 0.78 -0.69 0.00 0.00 174.62 176.70 1l7y h ASN 62 N 1.97 0.00 0.26 3.53 4.21 -1.92 -0.83 115.58 122.80 1l7y h ASN 62 Ca -0.47 0.00 -0.30 0.00 1.21 0.00 0.00 56.30 56.74 1l7y h ASN 62 Cb 1.23 0.00 0.03 0.00 -1.12 0.00 0.00 38.32 38.46 1l7y h ASN 62 CO 0.60 0.00 -1.29 0.44 -1.29 0.00 0.00 177.43 175.89 1l7y h ASP 63 N 0.00 0.78 0.00 5.81 3.32 -1.94 -3.48 116.42 120.91 1l7y h ASP 63 Ca 0.27 -0.76 0.00 0.00 0.02 0.00 0.00 57.03 56.56 1l7y h ASP 63 Cb 1.22 -0.25 0.00 0.00 0.22 0.00 0.00 39.33 40.52 1l7y h ASP 63 CO -0.00 1.58 0.00 0.61 -1.72 0.00 0.00 179.24 179.70 1l7y n GLY 64 N 1.46 0.55 3.09 2.75 0.00 -0.32 -5.14 105.19 107.59 1l7y n GLY 64 Ca -0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.24 1.91 -1.07 1.61 1.01 -1.25 -4.88 120.40 117.49 1l7y s VAL 65 Ca 0.00 -0.84 -0.23 0.00 0.00 0.00 0.00 61.98 60.91 1l7y s VAL 65 Cb 0.00 -1.74 -0.02 0.00 0.00 0.00 0.00 36.38 34.62 1l7y s VAL 65 CO 0.00 0.51 1.81 -0.83 0.00 0.00 0.00 175.10 176.60 1l7y s GLY 66 N 1.33 0.62 0.15 4.51 0.00 -1.26 -0.99 107.32 111.68 1l7y s GLY 66 Ca 0.05 -2.06 -0.31 0.00 0.00 0.00 0.00 44.72 42.39 1l7y s GLY 66 CO -0.12 3.23 1.53 0.14 0.00 0.00 0.00 173.10 177.88 1l7y s VAL 67 N 8.42 2.80 0.30 1.40 1.01 0.26 -4.90 120.40 129.69 1l7y s VAL 67 Ca 0.62 0.57 0.09 0.00 0.00 0.00 0.00 61.98 63.26 1l7y s VAL 67 Cb -0.02 -3.36 -0.04 0.00 0.00 0.00 0.00 36.38 32.95 1l7y s VAL 67 CO 0.03 0.04 0.06 0.20 0.00 0.00 0.00 175.10 175.43 1l7y s ASN 68 N 1.18 4.63 -1.34 3.32 0.01 -1.26 -2.55 114.94 118.93 1l7y s ASN 68 Ca 0.69 -0.69 -0.14 0.00 -0.71 0.00 0.00 52.86 52.01 1l7y s ASN 68 Cb -0.42 -0.82 -0.03 0.00 0.41 0.00 0.00 41.25 40.40 1l7y s ASN 68 CO 0.31 -0.13 2.31 -0.81 -1.51 0.00 0.00 177.10 177.27 1l7y n PRO 69 N -1.01 2.73 0.00 -0.60 -0.04 -1.26 -4.03 135.00 130.78 1l7y n PRO 69 Ca -0.05 -2.32 0.00 0.00 -0.04 0.00 0.00 63.50 61.09 1l7y n PRO 69 Cb 0.60 -3.08 0.00 0.00 -0.04 0.00 0.00 33.50 30.98 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 5.74 2.27 -1.98 0.55 0.00 -1.26 -4.23 120.51 121.59 1l7y n ALA 70 Ca 0.56 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.71 1l7y n ALA 70 Cb 0.35 0.11 0.02 0.00 0.00 0.00 0.00 19.45 19.93 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 -1.43 3.28 0.52 0.00 1.11 -1.26 -4.77 119.66 117.11 1l7y s GLN 71 Ca 0.00 0.45 -0.18 0.00 0.01 0.00 0.00 55.36 55.64 1l7y s GLN 71 Cb 0.00 -2.15 -0.07 0.00 -1.01 0.00 0.00 33.01 29.78 1l7y s GLN 71 CO 0.00 -0.65 1.02 -1.25 0.01 0.00 0.00 175.29 174.42 1l7y s PRO 72 N -5.12 3.74 0.32 2.91 0.04 -1.26 -0.49 135.00 135.15 1l7y s PRO 72 Ca 0.54 1.16 0.06 0.00 0.04 0.00 0.00 61.00 62.80 1l7y s PRO 72 Cb -0.11 -2.10 0.73 0.00 0.04 0.00 0.00 34.50 33.06 1l7y s PRO 72 CO 0.50 -0.46 1.83 0.00 0.04 0.00 0.00 177.00 178.92 1l7y h ALA 73 N 1.05 1.71 -0.23 8.56 0.00 -1.16 0.20 119.26 129.40 1l7y h ALA 73 Ca -0.48 0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.48 1l7y h ALA 73 Cb 1.20 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 1l7y h ALA 73 CO 0.59 0.00 0.11 0.78 0.00 0.00 0.00 179.25 180.74 1l7y h GLY 74 N 0.79 0.30 1.32 0.00 0.00 -1.79 -0.88 103.07 102.81 1l7y h GLY 74 Ca 0.51 -0.08 -0.13 0.00 0.00 0.00 0.00 47.33 47.63 1l7y h GLY 74 CO -0.28 0.07 -0.30 3.43 0.00 0.00 0.00 176.54 179.46 1l7y h ASN 75 N 0.24 0.80 -0.85 0.19 4.21 -1.60 -1.67 115.58 116.90 1l7y h ASN 75 Ca 0.09 -0.32 0.01 0.00 1.21 0.00 0.00 56.30 57.29 1l7y h ASN 75 Cb 0.02 -0.22 -0.04 0.00 -1.12 0.00 0.00 38.32 36.96 1l7y h ASN 75 CO -0.06 1.04 0.55 0.40 -1.29 0.00 0.00 177.43 178.07 1l7y h ILE 76 N 0.65 1.22 -0.18 2.81 1.08 -0.60 0.79 117.51 123.28 1l7y h ILE 76 Ca 0.07 -0.42 -0.21 0.00 -0.39 0.00 0.00 64.86 63.91 1l7y h ILE 76 Cb 0.83 -0.02 0.01 0.00 -3.07 0.00 0.00 36.82 34.57 1l7y h ILE 76 CO 0.07 0.22 -0.72 0.15 -0.69 0.00 0.00 178.15 177.17 1l7y h PHE 77 N 1.16 1.04 -0.38 1.37 3.04 -1.04 0.10 116.94 122.24 1l7y h PHE 77 Ca 0.31 -0.44 -0.11 0.00 3.98 0.00 0.00 57.97 61.71 1l7y h PHE 77 Cb -0.12 -0.17 -0.02 0.00 2.56 0.00 0.00 35.95 38.21 1l7y h PHE 77 CO -0.01 1.27 -0.20 -0.07 -2.02 0.00 0.00 178.31 177.27 1l7y h LEU 78 N 0.55 0.74 0.00 0.59 3.38 -0.92 -2.29 115.31 117.35 1l7y h LEU 78 Ca -0.04 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 57.67 1l7y h LEU 78 Cb 1.34 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.89 1l7y h LEU 78 CO 0.15 0.93 -0.42 0.11 0.09 0.00 0.00 178.44 179.30 1l7y h LYS 79 N 0.64 0.00 0.00 1.13 1.57 -0.87 -3.44 116.57 115.61 1l7y h LYS 79 Ca 0.09 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 1l7y h LYS 79 Cb 0.69 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.00 1l7y h LYS 79 CO 0.05 0.06 -0.24 0.45 -0.57 0.00 0.00 179.45 179.20 1l7y h HIS 80 N -1.00 0.00 0.00 -1.35 3.86 -0.99 -3.51 115.15 112.16 1l7y h HIS 80 Ca -0.02 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.19 1l7y h HIS 80 Cb 0.44 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.91 1l7y h HIS 80 CO -0.15 0.00 0.00 0.41 0.86 0.00 0.00 177.93 179.05 1l7y n GLY 81 N 1.71 0.35 1.21 2.45 0.00 -0.54 -4.89 105.19 105.48 1l7y n GLY 81 Ca -0.03 -1.18 0.00 0.00 0.00 0.00 0.00 46.02 44.81 1l7y n GLY 81 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1l7y n SER 82 N 0.00 0.07 -4.61 1.61 3.41 -1.26 -4.04 113.62 108.80 1l7y n SER 82 Ca 0.00 0.02 -0.43 0.00 -0.26 0.00 0.00 58.87 58.20 1l7y n SER 82 Cb 0.00 -0.02 -0.03 0.00 -0.26 0.00 0.00 64.21 63.91 1l7y n SER 82 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 1l7y s GLU 83 N -2.00 3.32 0.28 4.33 2.56 -1.26 -0.31 118.70 125.61 1l7y s GLU 83 Ca 0.00 1.90 0.02 0.00 0.00 0.00 0.00 54.97 56.89 1l7y s GLU 83 Cb 0.00 -4.29 -0.05 0.00 2.00 0.00 0.00 34.13 31.80 1l7y s GLU 83 CO 0.00 -1.89 0.12 -0.51 -0.56 0.00 0.00 175.26 172.42 1l7y s LEU 84 N 7.40 1.66 0.08 2.70 1.43 0.10 -3.68 118.68 128.37 1l7y s LEU 84 Ca 0.92 -1.45 0.06 0.00 -1.03 0.00 0.00 54.13 52.63 1l7y s LEU 84 Cb -0.31 0.07 -0.03 0.00 0.03 0.00 0.00 46.19 45.96 1l7y s LEU 84 CO 0.35 -0.79 -0.16 -0.13 0.23 0.00 0.00 176.35 175.86 1l7y s ARG 85 N -3.95 0.89 -0.18 1.70 0.52 0.14 -1.97 118.95 116.09 1l7y s ARG 85 Ca 0.37 -1.01 -0.08 0.00 -0.52 0.00 0.00 55.73 54.49 1l7y s ARG 85 Cb 0.07 -0.95 -0.04 0.00 0.52 0.00 0.00 34.95 34.55 1l7y s ARG 85 CO 0.15 0.21 0.07 -1.17 0.02 0.00 0.00 175.30 174.58 1l7y s LEU 86 N -1.82 3.86 0.07 2.53 0.20 -0.49 -0.37 118.68 122.68 1l7y s LEU 86 Ca 0.00 0.11 0.05 0.00 0.69 0.00 0.00 54.13 54.98 1l7y s LEU 86 Cb -0.10 -1.98 -0.03 0.00 -0.43 0.00 0.00 46.19 43.66 1l7y s LEU 86 CO 0.03 0.18 -0.13 0.27 -0.29 0.00 0.00 176.35 176.41 1l7y s ILE 87 N 0.32 1.04 -0.84 6.68 -4.36 0.10 -4.05 121.20 120.09 1l7y s ILE 87 Ca 0.04 -1.34 -0.25 0.00 -0.26 0.00 0.00 60.65 58.83 1l7y s ILE 87 Cb -0.12 -1.08 0.01 0.00 1.25 0.00 0.00 42.46 42.53 1l7y s ILE 87 CO -0.00 -0.29 1.57 -2.16 0.24 0.00 0.00 174.94 174.30 1l7y s PRO 88 N -1.89 3.09 -0.09 0.37 0.04 -1.26 -0.73 135.00 134.52 1l7y s PRO 88 Ca -0.01 -0.38 0.04 0.00 0.04 0.00 0.00 61.00 60.69 1l7y s PRO 88 Cb -0.09 -4.77 0.00 0.00 0.04 0.00 0.00 34.50 29.68 1l7y s PRO 88 CO 0.02 -2.52 -0.21 0.50 0.04 0.00 0.00 177.00 174.84 1l7y s ARG 89 N 5.99 2.61 0.48 4.56 3.52 -1.20 -4.91 118.95 130.01 1l7y s ARG 89 Ca 0.51 -0.74 -0.22 0.00 -0.13 0.00 0.00 55.73 55.15 1l7y s ARG 89 Cb -0.06 -2.02 -0.07 0.00 -1.56 0.00 0.00 34.95 31.24 1l7y s ARG 89 CO 0.05 0.15 1.19 0.16 -0.81 0.00 0.00 175.30 176.04 1l7y s ASP 90 N 0.40 5.96 -0.33 -2.12 1.47 -1.26 -0.98 116.67 119.81 1l7y s ASP 90 Ca -0.17 2.36 -0.16 0.00 1.18 0.00 0.00 52.55 55.76 1l7y s ASP 90 Cb -0.17 -2.61 -0.02 0.00 -0.34 0.00 0.00 42.92 39.79 1l7y s ASP 90 CO 0.07 -1.06 0.42 -0.60 0.68 0.00 0.00 175.17 174.67 1l7y s ARG 91 N -2.80 3.69 -0.95 2.11 6.06 -0.97 -4.87 118.95 121.21 1l7y s ARG 91 Ca 0.66 -0.22 -0.08 0.00 -2.50 0.00 0.00 55.73 53.59 1l7y s ARG 91 Cb -0.30 -3.77 0.24 0.00 0.06 0.00 0.00 34.95 31.18 1l7y s ARG 91 CO 0.36 -0.50 0.89 0.08 -2.50 0.00 0.00 175.30 173.63 1l7y s VAL 92 N 2.15 5.33 -0.63 7.11 1.01 -1.26 -4.88 120.40 129.23 1l7y s VAL 92 Ca 0.15 -3.26 0.02 0.00 0.00 0.00 0.00 61.98 58.88 1l7y s VAL 92 Cb -0.16 -4.26 0.39 0.00 0.00 0.00 0.00 36.38 32.35 1l7y s VAL 92 CO 0.12 -1.10 1.58 0.61 0.00 0.00 0.00 175.10 176.31 1l7y n GLY 93 N 2.98 5.80 0.00 4.51 0.00 -1.26 -5.29 105.19 111.93 1l7y n GLY 93 Ca 0.19 -2.61 0.00 0.00 0.00 0.00 0.00 46.02 43.60 1l7y n GLY 93 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93