#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pvt h LEU 2 N 0.00 0.00 -0.53 1.04 3.38 -1.62 0.59 115.31 118.16 2pvt h LEU 2 Ca 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 2pvt h LEU 2 Cb 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 2pvt h LEU 2 CO 0.00 0.00 0.27 0.40 0.09 0.00 0.00 178.44 179.20 2pvt h ILE 3 N 0.00 1.20 0.14 1.22 1.08 -1.96 -1.21 117.51 117.98 2pvt h ILE 3 Ca 0.29 -0.54 -0.30 0.00 -0.39 0.00 0.00 64.86 63.92 2pvt h ILE 3 Cb 1.42 0.57 0.03 0.00 -3.07 0.00 0.00 36.82 35.77 2pvt h ILE 3 CO -0.00 0.22 -1.28 -0.33 -0.69 0.00 0.00 178.15 176.06 2pvt h GLU 4 N 0.72 0.59 0.02 2.37 3.07 -1.32 -2.98 114.58 117.06 2pvt h GLU 4 Ca 0.18 -0.83 0.02 0.00 -0.50 0.00 0.00 59.36 58.23 2pvt h GLU 4 Cb 0.10 0.28 -0.02 0.00 -0.84 0.00 0.00 28.75 28.27 2pvt h GLU 4 CO -0.02 1.38 -0.13 0.35 -1.40 0.00 0.00 179.01 179.19 2pvt h PHE 5 N 0.25 -0.33 -0.74 4.33 3.57 -1.14 -1.41 116.94 121.47 2pvt h PHE 5 Ca -0.20 0.01 0.16 0.00 3.53 0.00 0.00 57.97 61.48 2pvt h PHE 5 Cb 1.96 0.14 -0.13 0.00 2.79 0.00 0.00 35.95 40.71 2pvt h PHE 5 CO 0.11 -0.19 -0.04 0.78 -2.23 0.00 0.00 178.31 176.74 2pvt h GLY 6 N -0.23 0.75 1.04 2.40 0.00 -1.32 -0.57 103.07 105.14 2pvt h GLY 6 Ca 0.04 0.14 -0.10 0.00 0.00 0.00 0.00 47.33 47.41 2pvt h GLY 6 CO -0.11 -0.28 -0.09 1.70 0.00 0.00 0.00 176.54 177.76 2pvt h LYS 7 N 0.07 0.91 -0.16 4.80 3.64 -1.33 -2.09 116.57 122.42 2pvt h LYS 7 Ca 0.39 -0.33 0.01 0.00 -1.27 0.00 0.00 60.65 59.45 2pvt h LYS 7 Cb 0.67 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.42 2pvt h LYS 7 CO -0.68 0.98 0.06 0.52 -2.27 0.00 0.00 179.45 178.06 2pvt h MET 8 N 0.76 0.14 -0.25 1.90 2.86 -0.38 -1.28 114.93 118.68 2pvt h MET 8 Ca 0.13 -0.01 0.03 0.00 -2.06 0.00 0.00 59.70 57.79 2pvt h MET 8 Cb 0.63 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 32.23 2pvt h MET 8 CO 0.04 0.09 0.05 0.82 1.06 0.00 0.00 176.91 178.97 2pvt h ILE 9 N 0.14 0.89 -0.22 -1.22 2.04 -1.10 -0.21 117.51 117.84 2pvt h ILE 9 Ca 0.07 -0.05 0.00 0.00 1.00 0.00 0.00 64.86 65.87 2pvt h ILE 9 Cb 0.03 0.73 -0.01 0.00 -0.74 0.00 0.00 36.82 36.83 2pvt h ILE 9 CO -0.06 0.03 0.14 0.25 0.00 0.00 0.00 178.15 178.51 2pvt h LEU 10 N 0.15 0.26 -0.50 1.44 5.85 -1.27 0.31 115.31 121.54 2pvt h LEU 10 Ca 0.11 -0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.82 2pvt h LEU 10 Cb 0.11 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.04 2pvt h LEU 10 CO -0.14 0.21 0.32 -0.33 -0.34 0.00 0.00 178.44 178.16 2pvt h GLU 11 N 0.29 0.63 -0.13 1.25 5.08 -1.03 -0.04 114.58 120.62 2pvt h GLU 11 Ca 0.08 -0.04 -0.07 0.00 -1.00 0.00 0.00 59.36 58.33 2pvt h GLU 11 Cb -0.01 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.10 2pvt h GLU 11 CO -0.02 0.42 -0.20 0.93 -1.00 0.00 0.00 179.01 179.14 2pvt h GLU 12 N 0.65 0.37 0.00 2.33 4.39 -0.71 -3.39 114.58 118.22 2pvt h GLU 12 Ca 0.19 -0.22 0.00 0.00 0.34 0.00 0.00 59.36 59.67 2pvt h GLU 12 Cb -0.05 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.62 2pvt h GLU 12 CO -0.06 0.80 -1.47 0.25 -1.16 0.00 0.00 179.01 177.38 2pvt n THR 13 N -4.50 0.00 -1.01 1.13 -2.24 0.07 -4.87 114.28 102.85 2pvt n THR 13 Ca -0.07 -0.28 -0.00 0.00 -2.27 0.00 0.00 64.05 61.43 2pvt n THR 13 Cb 0.41 0.30 -0.00 0.00 -2.10 0.00 0.00 70.33 68.93 2pvt n THR 13 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2pvt n GLY 14 N 1.72 0.47 3.39 3.38 0.00 -0.03 -5.03 105.19 109.09 2pvt n GLY 14 Ca -0.02 -0.44 -0.30 0.00 0.00 0.00 0.00 46.02 45.26 2pvt n GLY 14 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2pvt s LYS 16 N -0.94 1.81 0.13 1.61 1.02 -1.26 -5.04 119.74 117.08 2pvt s LYS 16 Ca 0.00 -1.12 -0.30 0.00 0.02 0.00 0.00 55.97 54.57 2pvt s LYS 16 Cb 0.00 -2.03 -0.06 0.00 -0.52 0.00 0.00 37.83 35.21 2pvt s LYS 16 CO 0.00 0.51 1.03 -0.51 -0.92 0.00 0.00 175.35 175.46 2pvt s LEU 17 N -1.47 4.49 0.20 3.17 1.43 -1.26 -3.27 118.68 121.98 2pvt s LEU 17 Ca 0.13 1.92 -0.10 0.00 -1.03 0.00 0.00 54.13 55.06 2pvt s LEU 17 Cb -0.10 -3.59 0.25 0.00 0.03 0.00 0.00 46.19 42.77 2pvt s LEU 17 CO 0.04 -0.15 1.77 0.00 0.23 0.00 0.00 176.35 178.24 2pvt h ALA 18 N 5.46 0.79 -3.06 4.21 0.00 -1.93 -2.93 119.26 121.79 2pvt h ALA 18 Ca -0.43 0.06 -0.64 0.00 0.00 0.00 0.00 54.91 53.89 2pvt h ALA 18 Cb 1.21 -0.01 -0.22 0.00 0.00 0.00 0.00 17.79 18.77 2pvt h ALA 18 CO 0.73 -0.12 -0.63 0.42 0.00 0.00 0.00 179.25 179.65 2pvt s ILE 19 N -6.10 4.23 -2.61 0.00 1.01 -1.26 -0.28 121.20 116.20 2pvt s ILE 19 Ca -0.13 -0.21 0.24 0.00 0.00 0.00 0.00 60.65 60.55 2pvt s ILE 19 Cb 0.16 -2.94 0.37 0.00 0.01 0.00 0.00 42.46 40.06 2pvt s ILE 19 CO 0.75 0.39 1.37 -0.81 0.00 0.00 0.00 174.94 176.64 2pvt n PRO 20 N 4.46 2.48 -0.22 2.79 -0.04 -1.26 -4.95 135.00 138.26 2pvt n PRO 20 Ca -0.17 -2.21 -0.01 0.00 -0.04 0.00 0.00 63.50 61.07 2pvt n PRO 20 Cb 0.52 -1.50 0.21 0.00 -0.04 0.00 0.00 33.50 32.68 2pvt n PRO 20 CO 0.00 0.00 0.00 0.77 -0.04 0.00 0.00 175.50 176.23 2pvt h SER 21 N 4.56 0.89 -0.03 3.54 0.02 -1.42 -3.22 113.55 117.90 2pvt h SER 21 Ca 0.00 -0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.90 2pvt h SER 21 Cb 1.00 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 63.31 2pvt h SER 21 CO 0.00 0.69 0.00 -1.22 -1.14 0.00 0.00 176.83 175.16 2pvt n TYR 22 N -4.38 0.09 0.47 3.45 4.01 0.61 -4.56 117.16 116.85 2pvt n TYR 22 Ca 0.08 -0.89 0.05 0.00 -0.16 0.00 0.00 57.90 56.98 2pvt n TYR 22 Cb 0.07 -0.14 -0.06 0.00 -0.31 0.00 0.00 39.34 38.90 2pvt n TYR 22 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 2pvt n SER 23 N -1.14 0.55 -2.03 7.72 3.41 -1.03 -3.70 113.62 117.40 2pvt n SER 23 Ca 0.13 -0.72 0.02 0.00 -0.26 0.00 0.00 58.87 58.04 2pvt n SER 23 Cb 0.58 1.02 0.04 0.00 -0.26 0.00 0.00 64.21 65.59 2pvt n SER 23 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2pvt n SER 24 N -1.26 1.31 -4.71 4.04 3.41 -1.08 -3.97 113.62 111.35 2pvt n SER 24 Ca 0.02 -2.07 -0.36 0.00 -0.26 0.00 0.00 58.87 56.19 2pvt n SER 24 Cb 0.16 -0.38 -0.08 0.00 -0.26 0.00 0.00 64.21 63.66 2pvt n SER 24 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 2pvt s TYR 25 N -1.67 3.41 0.00 7.33 6.14 -0.94 -0.68 117.35 130.95 2pvt s TYR 25 Ca 0.31 0.44 0.00 0.00 0.64 0.00 0.00 57.07 58.46 2pvt s TYR 25 Cb 0.36 -2.28 0.00 0.00 0.42 0.00 0.00 41.96 40.46 2pvt s TYR 25 CO -0.11 0.21 0.00 0.41 0.64 0.00 0.00 175.55 176.69 2pvt n GLY 26 N 3.63 1.66 0.04 8.97 0.00 -0.41 -1.89 105.19 117.18 2pvt n GLY 26 Ca -0.14 -0.57 0.11 0.00 0.00 0.00 0.00 46.02 45.42 2pvt n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pvt n TYR 28 N -2.17 0.00 -2.58 0.00 4.02 -1.25 -3.46 117.16 111.72 2pvt n TYR 28 Ca -0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.47 2pvt n TYR 28 Cb 0.50 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.79 2pvt n TYR 28 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2pvt n GLY 30 N 5.18 1.30 2.76 0.00 0.00 -1.24 -2.21 105.19 110.97 2pvt n GLY 30 Ca 0.06 -0.76 -0.31 0.00 0.00 0.00 0.00 46.02 45.01 2pvt n GLY 30 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2pvt n GLY 31 N 0.00 5.46 0.00 -0.02 0.00 -1.26 -5.01 105.19 104.36 2pvt n GLY 31 Ca 0.00 -2.74 0.00 0.00 0.00 0.00 0.00 46.02 43.28 2pvt n GLY 31 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2pvt n GLY 32 N 0.22 -0.50 0.00 -0.02 0.00 -1.22 -4.84 105.19 98.83 2pvt n GLY 32 Ca 0.33 -1.72 0.00 0.00 0.00 0.00 0.00 46.02 44.63 2pvt n GLY 32 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2pvt n GLY 33 N 5.00 0.50 3.14 -0.02 0.00 -1.22 -4.93 105.19 107.66 2pvt n GLY 33 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 2pvt n GLY 33 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2pvt s LYS 34 N 0.00 0.55 0.19 1.61 -0.14 -1.26 -5.10 119.74 115.58 2pvt s LYS 34 Ca 0.00 -0.38 0.00 0.00 -1.36 0.00 0.00 55.97 54.23 2pvt s LYS 34 Cb 0.00 0.23 0.00 0.00 -1.68 0.00 0.00 37.83 36.38 2pvt s LYS 34 CO 0.00 -0.14 0.00 0.41 -0.76 0.00 0.00 175.35 174.86 2pvt n GLY 35 N 1.32 -2.78 3.78 -3.33 0.00 -1.22 -4.73 105.19 98.22 2pvt n GLY 35 Ca -0.22 -1.77 -0.38 0.00 0.00 0.00 0.00 46.02 43.65 2pvt n GLY 35 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2pvt s THR 36 N -0.67 5.04 0.40 2.61 2.01 -0.88 -4.38 115.64 119.78 2pvt s THR 36 Ca 0.00 0.96 -0.26 0.00 0.31 0.00 0.00 61.69 62.70 2pvt s THR 36 Cb 0.00 -3.79 -0.09 0.00 0.01 0.00 0.00 72.50 68.63 2pvt s THR 36 CO 0.00 0.47 1.27 -2.84 -0.69 0.00 0.00 174.62 172.82 2pvt s PRO 37 N -0.35 4.00 0.14 4.92 0.02 -1.26 -4.79 135.00 137.68 2pvt s PRO 37 Ca 0.26 2.08 0.04 0.00 0.02 0.00 0.00 61.00 63.40 2pvt s PRO 37 Cb -0.17 -2.75 -0.10 0.00 0.02 0.00 0.00 34.50 31.51 2pvt s PRO 37 CO 0.13 -0.44 1.32 0.87 -0.33 0.00 0.00 177.00 178.55 2pvt h LYS 38 N 2.69 0.10 0.00 5.54 1.79 -1.97 -3.47 116.57 121.25 2pvt h LYS 38 Ca -0.49 -0.13 -0.01 0.00 -2.18 0.00 0.00 60.65 57.83 2pvt h LYS 38 Cb 1.24 0.04 -0.00 0.00 -1.58 0.00 0.00 32.23 31.94 2pvt h LYS 38 CO 0.63 0.98 0.03 -0.40 -1.08 0.00 0.00 179.45 179.60 2pvt n ASP 39 N -3.52 -0.33 -0.21 0.86 5.75 -1.26 -5.03 116.55 112.81 2pvt n ASP 39 Ca -0.02 -1.27 -0.08 0.00 -0.01 0.00 0.00 54.79 53.41 2pvt n ASP 39 Cb 0.88 0.56 0.02 0.00 -1.03 0.00 0.00 41.12 41.56 2pvt n ASP 39 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2pvt h ALA 40 N 1.89 0.77 -0.48 2.12 0.00 -1.93 -0.40 119.26 121.23 2pvt h ALA 40 Ca -0.05 -0.21 0.03 0.00 0.00 0.00 0.00 54.91 54.67 2pvt h ALA 40 Cb 0.20 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 2pvt h ALA 40 CO 0.07 0.46 0.27 1.15 0.00 0.00 0.00 179.25 181.20 2pvt h THR 41 N 0.84 1.02 -0.51 0.00 2.02 -1.92 -1.16 112.91 113.21 2pvt h THR 41 Ca 0.19 -0.19 -0.03 0.00 0.77 0.00 0.00 66.41 67.15 2pvt h THR 41 Cb 0.32 0.44 -0.02 0.00 -1.74 0.00 0.00 68.15 67.14 2pvt h THR 41 CO -0.00 0.10 0.19 -0.78 0.37 0.00 0.00 175.52 175.40 2pvt h ASP 42 N 0.54 0.67 -0.30 4.18 3.58 -1.86 -1.96 116.42 121.26 2pvt h ASP 42 Ca 0.20 -0.08 -0.10 0.00 0.42 0.00 0.00 57.03 57.47 2pvt h ASP 42 Cb 0.04 -0.17 -0.02 0.00 1.72 0.00 0.00 39.33 40.91 2pvt h ASP 42 CO -0.10 0.61 -0.14 0.03 -2.88 0.00 0.00 179.24 176.76 2pvt h ARG 43 N 0.72 0.74 -0.48 0.28 3.08 -0.20 -1.39 114.38 117.13 2pvt h ARG 43 Ca 0.17 -0.25 0.07 0.00 0.07 0.00 0.00 59.98 60.04 2pvt h ARG 43 Cb 0.16 -0.06 -0.06 0.00 0.08 0.00 0.00 29.97 30.09 2pvt h ARG 43 CO -0.02 0.84 0.14 0.00 -1.07 0.00 0.00 179.97 179.87 2pvt h PHE 46 N 0.94 -0.04 -0.60 0.00 3.57 -0.90 0.20 116.94 120.12 2pvt h PHE 46 Ca 0.24 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.74 2pvt h PHE 46 Cb 0.09 0.04 -0.03 0.00 2.79 0.00 0.00 35.95 38.84 2pvt h PHE 46 CO 0.00 -0.04 0.35 0.28 -2.23 0.00 0.00 178.31 176.68 2pvt h VAL 47 N 0.03 1.18 -0.36 1.41 2.07 -1.07 -0.02 116.25 119.50 2pvt h VAL 47 Ca 0.06 -0.43 0.02 0.00 0.82 0.00 0.00 66.70 67.17 2pvt h VAL 47 Cb 0.09 0.38 -0.03 0.00 -1.52 0.00 0.00 31.29 30.21 2pvt h VAL 47 CO -0.12 0.19 0.19 -0.74 0.02 0.00 0.00 177.57 177.11 2pvt h HIS 48 N 0.82 0.35 -0.30 1.57 -0.00 -0.99 0.25 115.15 116.85 2pvt h HIS 48 Ca 0.21 0.01 0.05 0.00 -0.00 0.00 0.00 60.37 60.65 2pvt h HIS 48 Cb 0.00 -0.11 -0.04 0.00 -0.00 0.00 0.00 27.41 27.26 2pvt h HIS 48 CO -0.02 0.20 0.01 -0.44 -0.00 0.00 0.00 177.93 177.68 2pvt h ASP 49 N 0.39 -0.09 -0.96 3.26 5.19 -0.19 -2.25 116.42 121.78 2pvt h ASP 49 Ca 0.15 0.06 0.06 0.00 -0.62 0.00 0.00 57.03 56.68 2pvt h ASP 49 Cb 0.04 0.10 -0.06 0.00 0.18 0.00 0.00 39.33 39.59 2pvt h ASP 49 CO -0.09 -0.01 0.63 0.00 -3.12 0.00 0.00 179.24 176.65 2pvt h TYR 52 N 0.62 1.05 0.00 0.00 -1.99 -1.03 -1.39 116.97 114.22 2pvt h TYR 52 Ca 0.13 -0.07 -0.00 0.00 2.00 0.00 0.00 58.73 60.80 2pvt h TYR 52 Cb 0.44 -0.32 -0.00 0.00 2.00 0.00 0.00 36.73 38.85 2pvt h TYR 52 CO 0.03 0.79 -0.01 0.78 -0.00 0.00 0.00 178.16 179.76 2pvt h GLY 53 N 1.08 0.00 0.97 3.88 0.00 -0.36 0.34 103.07 108.98 2pvt h GLY 53 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.57 2pvt h GLY 53 CO -0.02 0.00 0.00 0.70 0.00 0.00 0.00 176.54 177.22 2pvt n ASN 54 N -3.21 0.00 -3.27 0.19 3.02 -0.52 -4.31 115.26 107.16 2pvt n ASN 54 Ca -0.02 -0.95 -0.25 0.00 -0.03 0.00 0.00 54.58 53.32 2pvt n ASN 54 Cb 0.12 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.22 2pvt n ASN 54 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2pvt n LEU 55 N -0.99 2.32 0.26 3.41 4.77 0.11 -4.96 117.00 121.92 2pvt n LEU 55 Ca 0.22 -5.17 0.15 0.00 -0.03 0.00 0.00 56.01 51.18 2pvt n LEU 55 Cb 0.10 -0.07 0.57 0.00 -2.33 0.00 0.00 43.42 41.69 2pvt n LEU 55 CO 0.16 2.11 0.93 1.55 -1.33 0.00 0.00 177.39 180.81 2pvt h PRO 56 N 3.89 0.00 -1.02 3.23 0.13 -1.76 -2.35 132.00 134.12 2pvt h PRO 56 Ca 0.14 0.00 -0.43 0.00 -0.87 0.00 0.00 66.00 64.84 2pvt h PRO 56 Cb 0.75 0.00 -0.25 0.00 0.13 0.00 0.00 31.00 31.63 2pvt h PRO 56 CO 0.67 0.05 0.55 -0.25 -0.23 0.00 0.00 178.00 178.80 2pvt n ASP 59 N -3.16 4.01 -4.59 1.44 8.00 -1.26 -4.89 116.55 116.10 2pvt n ASP 59 Ca 0.01 -3.32 -0.26 0.00 0.71 0.00 0.00 54.79 51.93 2pvt n ASP 59 Cb 0.36 -0.80 -0.10 0.00 -0.02 0.00 0.00 41.12 40.56 2pvt n ASP 59 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2pvt s ASN 67 N -3.67 3.37 0.55 0.00 0.01 -1.26 -5.00 114.94 108.93 2pvt s ASN 67 Ca 0.34 -3.51 0.31 0.00 -0.71 0.00 0.00 52.86 49.29 2pvt s ASN 67 Cb 0.04 -1.12 1.58 0.00 0.41 0.00 0.00 41.25 42.16 2pvt s ASN 67 CO 0.18 -0.12 2.10 1.55 -1.51 0.00 0.00 177.10 179.29 2pvt h PRO 68 N 5.51 0.00 0.00 -0.60 0.13 -1.92 -1.32 132.00 133.81 2pvt h PRO 68 Ca 0.20 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 65.20 2pvt h PRO 68 Cb 0.82 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.93 2pvt h PRO 68 CO 0.57 0.08 -0.59 0.87 -0.23 0.00 0.00 178.00 178.70 2pvt h LYS 69 N 0.00 0.00 0.00 0.86 1.57 -1.94 -3.17 116.57 113.89 2pvt h LYS 69 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2pvt h LYS 69 Cb 0.32 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.63 2pvt h LYS 69 CO 0.01 0.59 -0.71 -1.13 -0.57 0.00 0.00 179.45 177.64 2pvt n SER 70 N -3.44 2.99 -4.66 0.86 3.41 -1.02 -2.34 113.62 109.42 2pvt n SER 70 Ca 0.00 -0.19 -0.42 0.00 -0.26 0.00 0.00 58.87 58.00 2pvt n SER 70 Cb 0.69 1.05 -0.04 0.00 -0.26 0.00 0.00 64.21 65.65 2pvt n SER 70 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2pvt s ASP 71 N -1.80 6.98 0.17 4.04 2.15 -0.53 -4.75 116.67 122.93 2pvt s ASP 71 Ca -0.00 1.21 -0.17 0.00 0.43 0.00 0.00 52.55 54.01 2pvt s ASP 71 Cb 0.01 -2.47 -0.07 0.00 -0.30 0.00 0.00 42.92 40.08 2pvt s ASP 71 CO 0.06 -0.48 0.63 -0.13 -0.17 0.00 0.00 175.17 175.08 2pvt s ARG 72 N 2.51 4.12 0.35 4.34 0.52 -1.26 0.00 118.95 129.53 2pvt s ARG 72 Ca 0.39 0.68 0.04 0.00 -0.52 0.00 0.00 55.73 56.32 2pvt s ARG 72 Cb -0.16 -2.94 -0.05 0.00 0.52 0.00 0.00 34.95 32.32 2pvt s ARG 72 CO 0.10 0.46 0.07 1.52 0.02 0.00 0.00 175.30 177.48 2pvt s TYR 73 N -1.45 1.91 0.01 -0.53 -0.85 -1.26 -4.82 117.35 110.35 2pvt s TYR 73 Ca 0.39 -1.04 0.07 0.00 -0.52 0.00 0.00 57.07 55.97 2pvt s TYR 73 Cb -0.16 -1.26 -0.03 0.00 0.38 0.00 0.00 41.96 40.89 2pvt s TYR 73 CO 0.20 -0.07 -0.21 0.15 -1.52 0.00 0.00 175.55 174.10 2pvt s LYS 74 N -3.85 2.12 0.04 -3.49 -0.14 -1.26 -4.91 119.74 108.25 2pvt s LYS 74 Ca 0.32 -0.93 -0.01 0.00 -1.36 0.00 0.00 55.97 53.99 2pvt s LYS 74 Cb 0.07 -2.15 -0.03 0.00 -1.68 0.00 0.00 37.83 34.04 2pvt s LYS 74 CO 0.15 0.56 -0.01 1.52 -0.76 0.00 0.00 175.35 176.80 2pvt s TYR 75 N -0.77 0.42 0.33 3.18 -0.85 -1.26 -0.80 117.35 117.60 2pvt s TYR 75 Ca 0.12 -0.88 0.04 0.00 -0.52 0.00 0.00 57.07 55.83 2pvt s TYR 75 Cb -0.10 -0.31 -0.04 0.00 0.38 0.00 0.00 41.96 41.89 2pvt s TYR 75 CO 0.02 -0.34 0.15 -1.59 -1.52 0.00 0.00 175.55 172.27 2pvt s LYS 76 N -3.24 1.69 -0.12 -3.49 -2.85 0.17 -4.92 119.74 106.98 2pvt s LYS 76 Ca 0.01 -1.98 0.03 0.00 -1.00 0.00 0.00 55.97 53.02 2pvt s LYS 76 Cb 0.03 -0.26 0.00 0.00 -2.06 0.00 0.00 37.83 35.55 2pvt s LYS 76 CO -0.08 -0.45 -0.22 1.03 0.10 0.00 0.00 175.35 175.73 2pvt s ARG 77 N -3.77 3.05 -0.30 1.78 0.52 -1.26 -0.17 118.95 118.80 2pvt s ARG 77 Ca 0.33 -0.86 -0.03 0.00 -0.52 0.00 0.00 55.73 54.65 2pvt s ARG 77 Cb 0.04 -2.39 0.04 0.00 0.52 0.00 0.00 34.95 33.17 2pvt s ARG 77 CO 0.17 0.08 0.02 0.08 0.02 0.00 0.00 175.30 175.67 2pvt s VAL 78 N 0.59 3.22 -1.36 3.52 1.01 -0.63 -4.65 120.40 122.10 2pvt s VAL 78 Ca -0.12 -1.25 -0.09 0.00 0.00 0.00 0.00 61.98 60.52 2pvt s VAL 78 Cb -0.17 -2.81 0.01 0.00 0.00 0.00 0.00 36.38 33.41 2pvt s VAL 78 CO 0.03 -0.09 1.16 0.59 0.00 0.00 0.00 175.10 176.80 2pvt n ASN 79 N 4.69 -5.96 0.00 3.32 3.02 -1.26 -1.97 115.26 117.10 2pvt n ASN 79 Ca -0.13 -0.56 0.00 0.00 -0.03 0.00 0.00 54.58 53.85 2pvt n ASN 79 Cb 0.44 -4.96 0.00 0.00 -0.61 0.00 0.00 39.78 34.65 2pvt n ASN 79 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2pvt n GLY 80 N -1.93 2.91 3.81 7.41 0.00 -1.26 -5.02 105.19 111.12 2pvt n GLY 80 Ca -0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.64 2pvt n GLY 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pvt s ALA 81 N -1.77 3.45 0.02 4.61 0.00 -0.83 -4.98 121.76 122.25 2pvt s ALA 81 Ca 0.00 0.14 -0.30 0.00 0.00 0.00 0.00 51.96 51.80 2pvt s ALA 81 Cb 0.00 -2.79 -0.05 0.00 0.00 0.00 0.00 23.12 20.28 2pvt s ALA 81 CO 0.00 0.34 1.16 0.42 0.00 0.00 0.00 175.76 177.68 2pvt s ILE 82 N -1.45 4.24 -0.12 0.00 1.01 -1.26 -1.61 121.20 122.01 2pvt s ILE 82 Ca 0.41 1.60 -0.00 0.00 0.00 0.00 0.00 60.65 62.65 2pvt s ILE 82 Cb -0.17 -4.03 0.02 0.00 0.01 0.00 0.00 42.46 38.30 2pvt s ILE 82 CO 0.21 0.09 -0.09 -0.69 0.00 0.00 0.00 174.94 174.47 2pvt s VAL 83 N 1.32 1.16 -0.12 2.92 1.01 0.76 -4.93 120.40 122.52 2pvt s VAL 83 Ca 0.57 -0.38 -0.30 0.00 0.00 0.00 0.00 61.98 61.87 2pvt s VAL 83 Cb -0.27 -1.16 -0.02 0.00 0.00 0.00 0.00 36.38 34.93 2pvt s VAL 83 CO 0.27 0.38 1.21 0.00 0.00 0.00 0.00 175.10 176.96 2pvt s GLU 85 N 2.85 3.29 0.27 0.00 2.02 0.02 -4.96 118.70 122.19 2pvt s GLU 85 Ca 0.54 0.97 -0.29 0.00 0.02 0.00 0.00 54.97 56.21 2pvt s GLU 85 Cb -0.22 -2.04 -0.09 0.00 0.10 0.00 0.00 34.13 31.88 2pvt s GLU 85 CO 0.17 -0.82 1.14 0.34 0.02 0.00 0.00 175.26 176.12 2pvt s ASP 86 N -3.55 7.17 0.00 -0.19 -1.08 -1.26 -4.75 116.67 113.02 2pvt s ASP 86 Ca 0.59 2.32 0.00 0.00 -0.52 0.00 0.00 52.55 54.94 2pvt s ASP 86 Cb -0.13 -2.63 0.00 0.00 -1.46 0.00 0.00 42.92 38.70 2pvt s ASP 86 CO 0.48 -0.23 0.00 0.61 0.52 0.00 0.00 175.17 176.54 2pvt n GLY 88 N 1.29 4.27 3.75 2.66 0.00 -1.26 -4.94 105.19 110.95 2pvt n GLY 88 Ca -0.00 -0.72 -0.30 0.00 0.00 0.00 0.00 46.02 45.00 2pvt n GLY 88 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2pvt s THR 89 N -0.08 1.85 0.27 2.61 -4.23 -1.26 -4.81 115.64 109.99 2pvt s THR 89 Ca 0.00 0.00 0.04 0.00 -1.18 0.00 0.00 61.69 60.55 2pvt s THR 89 Cb 0.00 -2.71 0.03 0.00 1.34 0.00 0.00 72.50 71.15 2pvt s THR 89 CO 0.00 0.00 1.67 0.77 -0.54 0.00 0.00 174.62 176.52 2pvt h SER 90 N -1.96 0.36 -0.47 3.99 4.64 -2.01 -1.77 113.55 116.32 2pvt h SER 90 Ca -0.47 -0.15 -0.01 0.00 -0.47 0.00 0.00 61.79 60.69 2pvt h SER 90 Cb 1.29 -0.10 -0.02 0.00 -0.31 0.00 0.00 62.40 63.26 2pvt h SER 90 CO 0.45 0.73 0.26 0.00 -0.87 0.00 0.00 176.83 177.39 2pvt h GLN 92 N 0.62 1.12 -0.19 0.00 4.20 -1.81 0.12 115.11 119.18 2pvt h GLN 92 Ca 0.17 -0.07 -0.03 0.00 0.06 0.00 0.00 58.65 58.78 2pvt h GLN 92 Cb 0.05 -0.25 -0.01 0.00 0.30 0.00 0.00 27.48 27.57 2pvt h GLN 92 CO -0.03 0.74 0.02 -0.91 -0.67 0.00 0.00 178.83 177.98 2pvt h ASN 93 N 1.15 0.31 -0.13 1.46 2.35 -1.14 -0.50 115.58 119.09 2pvt h ASN 93 Ca 0.32 -0.28 -0.18 0.00 -0.55 0.00 0.00 56.30 55.61 2pvt h ASN 93 Cb -0.12 -0.08 -0.00 0.00 0.05 0.00 0.00 38.32 38.17 2pvt h ASN 93 CO -0.07 0.51 -0.57 0.03 -1.65 0.00 0.00 177.43 175.68 2pvt h ARG 94 N 0.10 0.73 0.10 0.81 3.08 -0.95 -2.46 114.38 115.79 2pvt h ARG 94 Ca 0.06 -0.47 -0.00 0.00 0.07 0.00 0.00 59.98 59.63 2pvt h ARG 94 Cb 0.34 0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.45 2pvt h ARG 94 CO 0.01 1.10 -0.05 0.82 -1.07 0.00 0.00 179.97 180.78 2pvt h ILE 95 N 0.55 0.97 -0.51 2.04 2.04 -0.71 -2.09 117.51 119.81 2pvt h ILE 95 Ca 0.01 -0.25 0.08 0.00 1.00 0.00 0.00 64.86 65.70 2pvt h ILE 95 Cb 1.15 1.13 -0.07 0.00 -0.74 0.00 0.00 36.82 38.30 2pvt h ILE 95 CO 0.12 0.06 0.12 0.00 0.00 0.00 0.00 178.15 178.45 2pvt h GLU 97 N 0.27 1.05 -0.53 0.00 4.39 -1.36 0.99 114.58 119.39 2pvt h GLU 97 Ca 0.25 -0.11 0.02 0.00 0.34 0.00 0.00 59.36 59.86 2pvt h GLU 97 Cb 0.33 -0.21 -0.03 0.00 -0.10 0.00 0.00 28.75 28.73 2pvt h GLU 97 CO -0.31 0.76 0.33 0.00 -1.16 0.00 0.00 179.01 178.62 2pvt h ASP 99 N 0.65 0.54 -0.58 0.00 3.32 -0.62 -2.43 116.42 117.30 2pvt h ASP 99 Ca 0.21 -0.66 0.12 0.00 0.02 0.00 0.00 57.03 56.71 2pvt h ASP 99 Cb 0.00 -0.16 -0.09 0.00 0.22 0.00 0.00 39.33 39.30 2pvt h ASP 99 CO -0.08 1.12 0.05 0.50 -1.72 0.00 0.00 179.24 179.10 2pvt h LYS 100 N -0.00 0.16 -0.43 3.56 3.64 -0.86 -1.29 116.57 121.34 2pvt h LYS 100 Ca -0.04 -0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.32 2pvt h LYS 100 Cb 1.12 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 32.88 2pvt h LYS 100 CO 0.09 0.11 0.23 0.00 -2.27 0.00 0.00 179.45 177.61 2pvt h ALA 101 N 1.50 0.56 -0.34 5.00 0.00 -1.43 -1.97 119.26 122.58 2pvt h ALA 101 Ca 0.30 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 55.15 2pvt h ALA 101 Cb 0.47 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 2pvt h ALA 101 CO -0.46 0.09 0.16 0.00 0.00 0.00 0.00 179.25 179.05 2pvt h ALA 102 N 1.08 0.42 -0.80 0.00 0.00 -1.01 0.19 119.26 119.13 2pvt h ALA 102 Ca 0.15 0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.10 2pvt h ALA 102 Cb 0.07 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 17.77 2pvt h ALA 102 CO -0.02 -0.21 0.52 0.00 0.00 0.00 0.00 179.25 179.54 2pvt h ALA 103 N 1.18 1.04 -0.34 0.00 0.00 -1.11 0.21 119.26 120.25 2pvt h ALA 103 Ca 0.15 -0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.89 2pvt h ALA 103 Cb 0.06 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.55 2pvt h ALA 103 CO -0.11 0.37 -0.26 0.82 0.00 0.00 0.00 179.25 180.08 2pvt h ILE 104 N 1.04 1.29 -0.38 0.00 2.04 -1.30 -1.22 117.51 118.98 2pvt h ILE 104 Ca 0.31 -1.41 0.05 0.00 1.00 0.00 0.00 64.86 64.81 2pvt h ILE 104 Cb -0.05 1.45 -0.05 0.00 -0.74 0.00 0.00 36.82 37.44 2pvt h ILE 104 CO -0.09 0.46 0.09 0.00 0.00 0.00 0.00 178.15 178.61 2pvt h PHE 106 N 0.22 0.62 -0.30 0.00 0.04 -0.45 -2.02 116.94 115.04 2pvt h PHE 106 Ca 0.18 0.03 -0.07 0.00 2.80 0.00 0.00 57.97 60.90 2pvt h PHE 106 Cb 0.20 -0.18 -0.02 0.00 2.20 0.00 0.00 35.95 38.15 2pvt h PHE 106 CO -0.18 0.28 -0.13 -0.09 -0.60 0.00 0.00 178.31 177.59 2pvt h ARG 107 N 0.62 0.52 0.00 1.51 9.65 -0.73 -2.08 114.38 123.86 2pvt h ARG 107 Ca 0.30 -0.15 -0.01 0.00 -1.10 0.00 0.00 59.98 59.01 2pvt h ARG 107 Cb 0.22 -0.05 -0.00 0.00 -1.39 0.00 0.00 29.97 28.75 2pvt h ARG 107 CO -0.20 0.64 -0.05 0.37 2.80 0.00 0.00 179.97 183.53 2pvt h GLN 108 N 0.48 0.00 0.00 0.20 4.15 -0.40 -3.19 115.11 116.36 2pvt h GLN 108 Ca 0.09 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.51 2pvt h GLN 108 Cb 0.51 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.20 2pvt h GLN 108 CO 0.03 0.05 -0.01 0.09 -1.93 0.00 0.00 178.83 177.06 2pvt n ASN 109 N -3.15 2.26 -0.27 -0.69 3.02 -0.85 -4.70 115.26 110.89 2pvt n ASN 109 Ca 0.01 -2.95 0.01 0.00 -0.03 0.00 0.00 54.58 51.62 2pvt n ASN 109 Cb 0.38 -0.38 0.14 0.00 -0.61 0.00 0.00 39.78 39.31 2pvt n ASN 109 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 2pvt h LEU 110 N 0.00 0.60 -2.00 3.41 3.38 -1.38 -1.96 115.31 117.36 2pvt h LEU 110 Ca 0.00 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.02 2pvt h LEU 110 Cb 0.96 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.64 2pvt h LEU 110 CO 0.00 0.35 0.04 0.71 0.09 0.00 0.00 178.44 179.63 2pvt h THR 111 N 0.73 0.00 -0.19 0.22 1.35 -1.85 -1.97 112.91 111.20 2pvt h THR 111 Ca 0.36 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.22 2pvt h THR 111 Cb 0.32 0.67 0.00 0.00 -1.73 0.00 0.00 68.15 67.40 2pvt h THR 111 CO -0.24 0.00 0.00 0.35 -0.25 0.00 0.00 175.52 175.38 2pvt n THR 112 N -2.58 0.62 -1.68 6.82 -2.24 -0.75 -4.98 114.28 109.50 2pvt n THR 112 Ca -0.02 -0.81 -0.45 0.00 -2.27 0.00 0.00 64.05 60.49 2pvt n THR 112 Cb 0.09 0.76 -0.04 0.00 -2.10 0.00 0.00 70.33 69.04 2pvt n THR 112 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2pvt n TYR 113 N 0.43 2.41 -3.99 4.78 4.19 -0.74 -4.95 117.16 119.29 2pvt n TYR 113 Ca 0.08 0.08 -0.30 0.00 3.31 0.00 0.00 57.90 61.08 2pvt n TYR 113 Cb 0.34 -2.63 -0.16 0.00 0.49 0.00 0.00 39.34 37.38 2pvt n TYR 113 CO 0.00 0.00 0.00 0.45 0.91 0.00 0.00 176.86 178.22 2pvt s SER 114 N 2.12 3.10 0.50 2.98 0.15 -1.26 -5.00 113.70 116.29 2pvt s SER 114 Ca 0.83 -0.73 0.27 0.00 0.70 0.00 0.00 55.95 57.01 2pvt s SER 114 Cb -0.62 -1.18 1.47 0.00 -1.71 0.00 0.00 66.02 63.98 2pvt s SER 114 CO 0.40 -0.12 1.80 -0.33 1.20 0.00 0.00 173.24 176.20 2pvt h GLU 115 N 8.02 0.00 0.00 5.44 5.08 -1.99 -0.91 114.58 130.22 2pvt h GLU 115 Ca -0.31 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.05 2pvt h GLU 115 Cb 1.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.36 2pvt h GLU 115 CO 0.48 0.00 0.00 1.57 -1.00 0.00 0.00 179.01 180.06 2pvt h LYS 116 N 0.00 0.00 -0.01 2.33 2.10 -2.00 -2.57 116.57 116.42 2pvt h LYS 116 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2pvt h LYS 116 Cb 0.34 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.67 2pvt h LYS 116 CO 0.00 0.00 -0.23 0.66 -2.00 0.00 0.00 179.45 177.88 2pvt n TYR 117 N -2.53 0.00 -2.18 0.07 4.01 -0.34 -4.81 117.16 111.38 2pvt n TYR 117 Ca 0.00 0.00 -0.39 0.00 -0.16 0.00 0.00 57.90 57.35 2pvt n TYR 117 Cb 0.16 -0.07 -0.01 0.00 -0.31 0.00 0.00 39.34 39.11 2pvt n TYR 117 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 2pvt s GLU 118 N -2.36 4.04 -1.59 -0.72 2.02 -0.97 -1.28 118.70 117.83 2pvt s GLU 118 Ca 0.26 2.00 -0.16 0.00 0.02 0.00 0.00 54.97 57.10 2pvt s GLU 118 Cb 0.19 -2.74 0.12 0.00 0.10 0.00 0.00 34.13 31.80 2pvt s GLU 118 CO 0.48 -0.38 0.82 1.28 0.02 0.00 0.00 175.26 177.47 2pvt n LEU 119 N 0.16 -1.98 -4.75 1.80 4.77 0.15 -4.87 117.00 112.27 2pvt n LEU 119 Ca 0.04 -0.84 -0.41 0.00 -0.03 0.00 0.00 56.01 54.76 2pvt n LEU 119 Cb 0.45 -2.26 -0.02 0.00 -2.33 0.00 0.00 43.42 39.26 2pvt n LEU 119 CO 0.54 0.33 1.14 -0.47 -1.33 0.00 0.00 177.39 177.60 2pvt s TYR 120 N -3.23 2.89 0.16 -1.77 5.04 -1.12 -4.92 117.35 114.40 2pvt s TYR 120 Ca 0.68 1.00 -0.30 0.00 -2.44 0.00 0.00 57.07 56.01 2pvt s TYR 120 Cb -0.36 -3.91 -0.07 0.00 0.35 0.00 0.00 41.96 37.98 2pvt s TYR 120 CO 0.83 -2.92 1.08 -1.25 -1.34 0.00 0.00 175.55 171.95 2pvt s PRO 121 N -0.72 4.61 0.21 4.97 0.05 -1.26 -4.90 135.00 137.96 2pvt s PRO 121 Ca 0.59 1.67 -0.13 0.00 0.05 0.00 0.00 61.00 63.18 2pvt s PRO 121 Cb -0.44 -3.30 0.25 0.00 0.05 0.00 0.00 34.50 31.06 2pvt s PRO 121 CO 0.48 0.09 1.65 0.22 0.05 0.00 0.00 177.00 179.49 2pvt h ASP 122 N 5.26 -0.40 0.30 6.66 1.82 -1.94 -2.09 116.42 126.03 2pvt h ASP 122 Ca -0.44 0.16 0.00 0.00 -0.39 0.00 0.00 57.03 56.36 2pvt h ASP 122 Cb 1.21 0.31 0.00 0.00 0.68 0.00 0.00 39.33 41.53 2pvt h ASP 122 CO 0.73 -0.15 0.00 2.19 -1.61 0.00 0.00 179.24 180.39 2pvt h PHE 124 N 0.06 0.00 -0.00 0.28 -0.00 -2.03 -1.40 116.94 113.84 2pvt h PHE 124 Ca 0.30 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 58.27 2pvt h PHE 124 Cb 0.47 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 36.42 2pvt h PHE 124 CO -0.42 0.00 -0.04 1.28 -0.00 0.00 0.00 178.31 179.13 2pvt n LEU 125 N -2.35 0.28 -4.46 2.10 4.77 -0.78 -4.57 117.00 111.99 2pvt n LEU 125 Ca -0.00 0.04 -0.44 0.00 -0.03 0.00 0.00 56.01 55.58 2pvt n LEU 125 Cb 0.12 -0.14 -0.02 0.00 -2.33 0.00 0.00 43.42 41.05 2pvt n LEU 125 CO 0.15 0.05 1.11 0.00 -1.33 0.00 0.00 177.39 177.36 2pvt s LYS 127 N 2.59 1.75 0.00 0.00 1.02 -1.26 -4.07 119.74 119.76 2pvt s LYS 127 Ca 0.36 -1.16 0.00 0.00 0.02 0.00 0.00 55.97 55.19 2pvt s LYS 127 Cb -0.04 -2.02 0.00 0.00 -0.52 0.00 0.00 37.83 35.25 2pvt s LYS 127 CO -0.07 0.50 0.00 0.41 -0.92 0.00 0.00 175.35 175.26 2pvt n GLY 128 N 1.39 0.58 2.90 -3.33 0.00 -1.26 -2.07 105.19 103.40 2pvt n GLY 128 Ca -0.17 -2.32 -0.12 0.00 0.00 0.00 0.00 46.02 43.41 2pvt n GLY 128 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2pvt s LYS 129 N -0.56 0.04 -0.25 1.61 2.20 -1.26 -3.41 119.74 118.11 2pvt s LYS 129 Ca 0.00 0.08 -0.06 0.00 -0.36 0.00 0.00 55.97 55.63 2pvt s LYS 129 Cb 0.00 -0.01 0.13 0.00 -1.51 0.00 0.00 37.83 36.44 2pvt s LYS 129 CO 0.00 -0.03 0.51 -1.50 -0.36 0.00 0.00 175.35 173.97 2pvt s ILE 130 N 0.17 -0.80 0.32 5.43 2.07 -1.26 -4.84 121.20 122.29 2pvt s ILE 130 Ca -0.01 0.05 -0.14 0.00 -1.41 0.00 0.00 60.65 59.14 2pvt s ILE 130 Cb -0.02 -0.84 -0.09 0.00 0.13 0.00 0.00 42.46 41.64 2pvt s ILE 130 CO -0.00 0.00 0.72 -0.75 -1.91 0.00 0.00 174.94 173.00 2pvt s LYS 131 N 2.72 3.96 0.00 3.50 2.20 -1.26 -5.01 119.74 125.85 2pvt s LYS 131 Ca 0.04 0.61 0.19 0.00 -0.36 0.00 0.00 55.97 56.44 2pvt s LYS 131 Cb -0.13 -2.45 1.12 0.00 -1.51 0.00 0.00 37.83 34.86 2pvt s LYS 131 CO -0.16 0.15 1.51 0.00 -0.36 0.00 0.00 175.35 176.49