#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2vne s THR 41 N 0.00 0.83 -0.01 0.44 -4.23 -1.26 -4.35 115.64 107.07 2vne s THR 41 Ca 0.00 -0.64 -0.21 0.00 -1.18 0.00 0.00 61.69 59.67 2vne s THR 41 Cb 0.00 -0.73 -0.05 0.00 1.34 0.00 0.00 72.50 73.05 2vne s THR 41 CO 0.00 0.10 0.59 -0.69 -0.54 0.00 0.00 174.62 174.08 2vne s VAL 42 N -0.51 4.93 -0.16 2.29 1.01 0.10 -4.82 120.40 123.24 2vne s VAL 42 Ca 0.02 1.24 -0.17 0.00 0.00 0.00 0.00 61.98 63.08 2vne s VAL 42 Cb -0.05 -3.93 -0.04 0.00 0.00 0.00 0.00 36.38 32.35 2vne s VAL 42 CO 0.00 0.41 0.42 -0.89 0.00 0.00 0.00 175.10 175.04 2vne s THR 43 N -0.12 5.21 0.03 3.92 2.01 -1.26 -0.79 115.64 124.64 2vne s THR 43 Ca 0.31 0.79 0.07 0.00 0.31 0.00 0.00 61.69 63.17 2vne s THR 43 Cb -0.18 -3.75 -0.02 0.00 0.01 0.00 0.00 72.50 68.55 2vne s THR 43 CO 0.17 0.30 -0.21 -0.54 -0.69 0.00 0.00 174.62 173.64 2vne s LYS 44 N 0.92 1.51 -0.05 4.92 -0.14 0.04 -5.00 119.74 121.95 2vne s LYS 44 Ca 0.21 -0.92 -0.01 0.00 -1.36 0.00 0.00 55.97 53.90 2vne s LYS 44 Cb -0.15 -1.59 0.03 0.00 -1.68 0.00 0.00 37.83 34.44 2vne s LYS 44 CO 0.08 0.41 0.02 0.08 -0.76 0.00 0.00 175.35 175.18 2vne s VAL 45 N -0.73 0.20 0.15 3.17 1.01 -1.26 -0.59 120.40 122.35 2vne s VAL 45 Ca 0.08 0.19 0.09 0.00 0.00 0.00 0.00 61.98 62.34 2vne s VAL 45 Cb -0.09 -0.36 -0.04 0.00 0.00 0.00 0.00 36.38 35.89 2vne s VAL 45 CO 0.01 0.21 -0.14 0.27 0.00 0.00 0.00 175.10 175.46 2vne s ILE 46 N 1.75 3.03 0.15 2.22 -4.36 -0.58 -4.99 121.20 118.42 2vne s ILE 46 Ca 0.01 -1.59 0.07 0.00 -0.26 0.00 0.00 60.65 58.88 2vne s ILE 46 Cb -0.13 -2.45 -0.04 0.00 1.25 0.00 0.00 42.46 41.09 2vne s ILE 46 CO -0.04 -0.01 -0.16 -1.00 0.24 0.00 0.00 174.94 173.97 2vne s HIS 47 N -1.46 1.60 -0.10 1.37 3.76 -1.26 -1.87 115.29 117.32 2vne s HIS 47 Ca 0.22 -0.53 -0.09 0.00 -0.15 0.00 0.00 55.06 54.51 2vne s HIS 47 Cb -0.10 -0.81 0.03 0.00 1.11 0.00 0.00 32.58 32.81 2vne s HIS 47 CO 0.13 0.24 0.27 -1.58 -0.85 0.00 0.00 174.74 172.94 2vne s HIS 48 N -2.23 -0.30 0.08 1.40 5.04 0.11 -4.96 115.29 114.44 2vne s HIS 48 Ca 0.13 0.72 0.07 0.00 -1.54 0.00 0.00 55.06 54.44 2vne s HIS 48 Cb -0.05 0.10 -0.03 0.00 0.04 0.00 0.00 32.58 32.64 2vne s HIS 48 CO 0.05 -0.14 -0.18 -1.21 -2.34 0.00 0.00 174.74 170.91 2vne s GLU 49 N 0.17 1.02 -0.21 2.88 2.02 -1.26 -1.09 118.70 122.24 2vne s GLU 49 Ca -0.00 -1.06 -0.04 0.00 0.02 0.00 0.00 54.97 53.89 2vne s GLU 49 Cb -0.02 -1.17 0.10 0.00 0.10 0.00 0.00 34.13 33.14 2vne s GLU 49 CO 0.00 0.27 0.31 -1.17 0.02 0.00 0.00 175.26 174.69 2vne s LEU 50 N -1.77 -0.39 0.15 1.80 1.98 -1.00 -4.96 118.68 114.49 2vne s LEU 50 Ca 0.03 0.20 -0.30 0.00 -2.89 0.00 0.00 54.13 51.17 2vne s LEU 50 Cb -0.10 0.80 -0.07 0.00 0.66 0.00 0.00 46.19 47.49 2vne s LEU 50 CO 0.03 -0.29 1.09 -1.61 -1.89 0.00 0.00 176.35 173.68 2vne s GLU 51 N 2.45 4.59 -0.03 1.98 8.01 -1.26 -1.16 118.70 133.28 2vne s GLU 51 Ca 0.08 1.68 0.01 0.00 0.01 0.00 0.00 54.97 56.75 2vne s GLU 51 Cb -0.15 -3.31 0.01 0.00 -4.31 0.00 0.00 34.13 26.38 2vne s GLU 51 CO -0.13 0.05 -0.05 0.54 0.01 0.00 0.00 175.26 175.68 2vne s VAL 52 N -0.01 0.52 0.00 2.63 0.11 -0.41 -4.99 120.40 118.26 2vne s VAL 52 Ca 0.50 -0.18 -0.04 0.00 -2.93 0.00 0.00 61.98 59.33 2vne s VAL 52 Cb -0.28 -0.51 -0.20 0.00 -1.53 0.00 0.00 36.38 33.86 2vne s VAL 52 CO 0.33 0.19 2.83 0.00 -3.33 0.00 0.00 175.10 175.12 2vne n ALA 53 N 3.61 5.00 -2.47 1.54 0.00 -1.26 -2.29 120.51 124.65 2vne n ALA 53 Ca -0.21 -1.36 -0.08 0.00 0.00 0.00 0.00 53.44 51.79 2vne n ALA 53 Cb 0.53 -2.30 -0.08 0.00 0.00 0.00 0.00 19.45 17.60 2vne n ALA 53 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2vne s ALA 54 N 1.50 -0.04 0.40 0.00 0.00 -0.99 -4.86 121.76 117.77 2vne s ALA 54 Ca 0.50 -0.74 -0.26 0.00 0.00 0.00 0.00 51.96 51.46 2vne s ALA 54 Cb 0.24 0.41 -0.09 0.00 0.00 0.00 0.00 23.12 23.68 2vne s ALA 54 CO 0.00 -0.45 1.29 -1.54 0.00 0.00 0.00 175.76 175.06 2vne s SER 55 N -2.79 6.37 0.32 0.00 1.04 -1.23 -2.85 113.70 114.56 2vne s SER 55 Ca 0.04 2.63 0.09 0.00 0.48 0.00 0.00 55.95 59.20 2vne s SER 55 Cb 0.05 -2.64 0.85 0.00 0.10 0.00 0.00 66.02 64.38 2vne s SER 55 CO -0.10 -0.81 1.75 0.00 0.98 0.00 0.00 173.24 175.06 2vne h ALA 56 N 2.73 1.78 -0.74 5.32 0.00 -1.88 -1.40 119.26 125.08 2vne h ALA 56 Ca -0.49 0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.48 2vne h ALA 56 Cb 1.24 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.98 2vne h ALA 56 CO 0.63 -0.22 0.30 -0.44 0.00 0.00 0.00 179.25 179.52 2vne h ASP 57 N 0.63 1.01 -0.04 0.00 5.19 -1.94 0.65 116.42 121.92 2vne h ASP 57 Ca 0.62 -0.15 -0.01 0.00 -0.62 0.00 0.00 57.03 56.87 2vne h ASP 57 Cb 1.13 -0.26 -0.00 0.00 0.18 0.00 0.00 39.33 40.38 2vne h ASP 57 CO -0.43 0.89 -0.02 0.44 -3.12 0.00 0.00 179.24 177.00 2vne h ASP 58 N 1.07 0.08 -0.24 6.45 3.32 -1.64 -1.88 116.42 123.58 2vne h ASP 58 Ca 0.25 -0.41 -0.01 0.00 0.02 0.00 0.00 57.03 56.88 2vne h ASP 58 Cb 0.20 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 2vne h ASP 58 CO -0.02 0.47 0.13 0.40 -1.72 0.00 0.00 179.24 178.50 2vne h ILE 59 N -0.30 1.10 -0.07 0.35 5.03 -1.36 -3.10 117.51 119.17 2vne h ILE 59 Ca 0.01 -0.30 -0.20 0.00 -0.12 0.00 0.00 64.86 64.25 2vne h ILE 59 Cb 0.44 0.75 -0.00 0.00 -3.03 0.00 0.00 36.82 34.98 2vne h ILE 59 CO 0.01 0.12 -0.79 -0.25 -0.68 0.00 0.00 178.15 176.56 2vne h TRP 60 N 0.39 0.62 -0.93 1.37 2.91 -0.69 -2.97 115.95 116.65 2vne h TRP 60 Ca 0.10 -0.29 0.04 0.00 1.13 0.00 0.00 58.89 59.88 2vne h TRP 60 Cb 0.05 -0.09 -0.06 0.00 -0.51 0.00 0.00 29.16 28.56 2vne h TRP 60 CO 0.00 1.07 0.61 1.79 -1.03 0.00 0.00 178.44 180.88 2vne h THR 61 N 0.29 1.13 -0.37 2.65 1.35 -1.26 -1.47 112.91 115.24 2vne h THR 61 Ca -0.04 -0.39 -0.12 0.00 -0.55 0.00 0.00 66.41 65.31 2vne h THR 61 Cb 1.38 -0.10 -0.01 0.00 -1.73 0.00 0.00 68.15 67.69 2vne h THR 61 CO 0.14 0.21 -0.22 0.58 -0.25 0.00 0.00 175.52 175.97 2vne h VAL 62 N 1.14 1.28 -0.35 6.82 2.07 -1.62 -0.98 116.25 124.62 2vne h VAL 62 Ca 0.38 -1.37 -0.05 0.00 0.82 0.00 0.00 66.70 66.48 2vne h VAL 62 Cb 0.06 1.37 -0.02 0.00 -1.52 0.00 0.00 31.29 31.19 2vne h VAL 62 CO -0.12 0.45 0.00 1.88 0.02 0.00 0.00 177.57 179.80 2vne h TYR 63 N 0.59 0.56 0.00 1.57 -1.99 -1.27 -2.94 116.97 113.49 2vne h TYR 63 Ca 0.08 -0.06 0.00 0.00 2.00 0.00 0.00 58.73 60.75 2vne h TYR 63 Cb 0.78 -0.16 0.00 0.00 2.00 0.00 0.00 36.73 39.35 2vne h TYR 63 CO 0.06 0.55 -0.70 -1.13 -0.00 0.00 0.00 178.16 176.94 2vne n SER 64 N -4.28 0.69 -4.63 3.88 3.41 -0.60 -4.94 113.62 107.16 2vne n SER 64 Ca 0.02 -0.54 -0.43 0.00 -0.26 0.00 0.00 58.87 57.66 2vne n SER 64 Cb 0.25 0.54 -0.03 0.00 -0.26 0.00 0.00 64.21 64.71 2vne n SER 64 CO 0.00 0.00 0.00 0.86 -0.16 0.00 0.00 175.04 175.74 2vne s TRP 65 N -3.00 1.56 0.51 7.33 -0.00 -0.37 -4.88 118.94 120.08 2vne s TRP 65 Ca 0.10 0.28 0.41 0.00 -0.00 0.00 0.00 56.10 56.89 2vne s TRP 65 Cb 0.17 -4.04 2.12 0.00 -0.00 0.00 0.00 33.47 31.72 2vne s TRP 65 CO 0.77 -4.02 2.26 -1.00 -0.00 0.00 0.00 176.95 174.96 2vne h PRO 66 N 12.24 0.00 0.00 5.86 0.13 -1.89 -0.16 132.00 148.19 2vne h PRO 66 Ca -0.40 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.73 2vne h PRO 66 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2vne h PRO 66 CO 0.97 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 179.16 2vne n GLY 67 N -0.78 -1.51 0.35 1.56 0.00 -1.26 -3.92 105.19 99.63 2vne n GLY 67 Ca -0.02 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.95 2vne n GLY 67 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2vne h LEU 68 N 0.00 0.87 -0.50 0.99 5.85 -1.33 -3.07 115.31 118.13 2vne h LEU 68 Ca 0.00 -0.02 0.09 0.00 0.84 0.00 0.00 57.88 58.79 2vne h LEU 68 Cb 0.55 -0.22 -0.07 0.00 0.37 0.00 0.00 40.66 41.28 2vne h LEU 68 CO 0.00 0.63 0.06 0.00 -0.34 0.00 0.00 178.44 178.80 2vne h ALA 69 N 1.53 0.53 0.00 1.25 0.00 -1.76 -0.22 119.26 120.58 2vne h ALA 69 Ca 0.28 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.31 2vne h ALA 69 Cb -0.12 0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.85 2vne h ALA 69 CO -0.06 -0.34 0.00 0.36 0.00 0.00 0.00 179.25 179.21 2vne n LYS 70 N -5.16 0.54 -0.08 0.00 2.85 -1.16 -2.83 118.16 112.31 2vne n LYS 70 Ca 0.06 0.03 0.07 0.00 -1.05 0.00 0.00 58.31 57.42 2vne n LYS 70 Cb 0.26 -1.50 0.11 0.00 -0.65 0.00 0.00 35.03 33.25 2vne n LYS 70 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 2vne n HIS 71 N -1.18 0.22 -0.32 5.58 8.25 -0.14 -4.64 115.22 122.98 2vne n HIS 71 Ca 0.15 -0.18 0.02 0.00 -0.26 0.00 0.00 57.72 57.45 2vne n HIS 71 Cb 0.16 -0.01 0.20 0.00 1.12 0.00 0.00 29.99 31.47 2vne n HIS 71 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 2vne h LEU 72 N 2.76 0.98 -1.76 2.41 3.38 -1.27 -0.16 115.31 121.66 2vne h LEU 72 Ca 0.00 -0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.93 2vne h LEU 72 Cb 0.67 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 41.21 2vne h LEU 72 CO 0.00 0.65 -0.17 -0.65 0.09 0.00 0.00 178.44 178.36 2vne h PRO 73 N 1.12 0.00 -0.39 1.13 0.11 -1.84 -0.29 132.00 131.84 2vne h PRO 73 Ca 0.39 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 66.34 2vne h PRO 73 Cb 0.10 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.21 2vne h PRO 73 CO -0.13 0.17 -0.39 -0.44 -0.21 0.00 0.00 178.00 177.00 2vne h ASP 74 N 0.00 1.00 0.40 -2.05 3.32 -1.38 -3.03 116.42 114.69 2vne h ASP 74 Ca -0.00 -0.46 -0.21 0.00 0.02 0.00 0.00 57.03 56.38 2vne h ASP 74 Cb 0.37 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.64 2vne h ASP 74 CO 0.02 1.26 -0.90 -0.07 -1.72 0.00 0.00 179.24 177.83 2vne h LEU 75 N 0.76 0.44 -5.92 1.55 3.38 -1.16 -3.38 115.31 110.98 2vne h LEU 75 Ca 0.06 -0.35 -0.61 0.00 0.09 0.00 0.00 57.88 57.08 2vne h LEU 75 Cb 0.98 -0.13 -0.41 0.00 0.09 0.00 0.00 40.66 41.18 2vne h LEU 75 CO 0.10 1.14 -0.53 0.18 0.09 0.00 0.00 178.44 179.42 2vne n LEU 76 N -3.73 4.17 -4.71 1.67 4.77 -0.14 -4.87 117.00 114.17 2vne n LEU 76 Ca -0.05 -5.52 -0.43 0.00 -0.03 0.00 0.00 56.01 49.97 2vne n LEU 76 Cb 0.81 -0.66 -0.03 0.00 -2.33 0.00 0.00 43.42 41.21 2vne n LEU 76 CO 0.50 2.15 1.23 -2.65 -1.33 0.00 0.00 177.39 177.29 2vne n PRO 77 N 0.48 2.50 -0.85 3.23 -0.02 -1.15 -1.70 135.00 137.50 2vne n PRO 77 Ca 0.30 0.90 0.00 0.00 -2.02 0.00 0.00 63.50 62.68 2vne n PRO 77 Cb 0.40 -2.67 0.00 0.00 -0.02 0.00 0.00 33.50 31.20 2vne n PRO 77 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2vne n GLY 78 N 2.94 0.61 0.16 -1.23 0.00 -1.26 -4.87 105.19 101.54 2vne n GLY 78 Ca 0.13 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.01 2vne n GLY 78 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2vne h ALA 79 N 0.00 0.35 -3.35 4.61 0.00 -1.68 -3.45 119.26 115.73 2vne h ALA 79 Ca 0.00 -0.71 -0.65 0.00 0.00 0.00 0.00 54.91 53.55 2vne h ALA 79 Cb 0.05 -0.01 -0.19 0.00 0.00 0.00 0.00 17.79 17.64 2vne h ALA 79 CO 0.00 0.81 -0.65 -0.06 0.00 0.00 0.00 179.25 179.36 2vne s PHE 80 N -3.26 3.07 -0.02 0.00 0.08 -1.26 -4.48 117.98 112.11 2vne s PHE 80 Ca -0.06 -0.08 -0.21 0.00 0.12 0.00 0.00 56.93 56.69 2vne s PHE 80 Cb 0.09 -1.89 -0.26 0.00 -0.57 0.00 0.00 43.02 40.39 2vne s PHE 80 CO 0.87 0.17 1.02 1.49 -0.10 0.00 0.00 175.22 178.67 2vne h GLU 81 N 6.10 0.32 -2.63 0.44 4.81 -1.66 -3.47 114.58 118.49 2vne h GLU 81 Ca -0.39 -0.40 -0.11 0.00 -0.13 0.00 0.00 59.36 58.33 2vne h GLU 81 Cb 1.19 0.12 -0.27 0.00 0.63 0.00 0.00 28.75 30.42 2vne h GLU 81 CO 0.60 1.10 -0.30 0.21 -0.73 0.00 0.00 179.01 179.89 2vne s LYS 82 N -2.96 0.39 -0.20 1.92 2.20 -1.00 -5.05 119.74 115.04 2vne s LYS 82 Ca -0.14 0.81 -0.01 0.00 -0.36 0.00 0.00 55.97 56.27 2vne s LYS 82 Cb 0.02 -0.00 0.06 0.00 -1.51 0.00 0.00 37.83 36.40 2vne s LYS 82 CO 0.80 -0.17 -0.02 -1.17 -0.36 0.00 0.00 175.35 174.44 2vne s LEU 83 N 1.49 1.80 -0.22 5.43 1.98 -1.26 -1.85 118.68 126.05 2vne s LEU 83 Ca -0.09 -0.91 -0.11 0.00 -2.89 0.00 0.00 54.13 50.12 2vne s LEU 83 Cb -0.09 -0.88 -0.05 0.00 0.66 0.00 0.00 46.19 45.83 2vne s LEU 83 CO -0.13 -0.25 0.19 -0.70 -1.89 0.00 0.00 176.35 173.57 2vne s GLU 84 N 1.63 4.12 -0.24 1.98 2.12 -0.53 -4.97 118.70 122.80 2vne s GLU 84 Ca -0.02 -0.19 -0.05 0.00 0.36 0.00 0.00 54.97 55.07 2vne s GLU 84 Cb -0.17 -3.51 -0.00 0.00 0.26 0.00 0.00 34.13 30.71 2vne s GLU 84 CO -0.07 0.11 0.00 0.42 -0.54 0.00 0.00 175.26 175.19 2vne s ILE 85 N 0.90 3.63 -0.38 -3.70 1.01 -1.26 -0.87 121.20 120.52 2vne s ILE 85 Ca 0.09 -0.53 -0.09 0.00 0.00 0.00 0.00 60.65 60.12 2vne s ILE 85 Cb -0.13 -2.73 0.05 0.00 0.01 0.00 0.00 42.46 39.66 2vne s ILE 85 CO 0.03 0.31 0.20 -0.63 0.00 0.00 0.00 174.94 174.85 2vne s ILE 86 N 1.49 4.25 0.00 2.92 1.01 -0.26 -5.00 121.20 125.61 2vne s ILE 86 Ca 0.05 -1.11 0.00 0.00 0.00 0.00 0.00 60.65 59.59 2vne s ILE 86 Cb -0.15 -3.45 0.00 0.00 0.01 0.00 0.00 42.46 38.86 2vne s ILE 86 CO -0.01 -0.31 0.00 0.61 0.00 0.00 0.00 174.94 175.23 2vne n GLY 87 N 4.92 1.62 0.43 6.18 0.00 -1.26 -1.19 105.19 115.88 2vne n GLY 87 Ca -0.11 -2.24 0.09 0.00 0.00 0.00 0.00 46.02 43.77 2vne n GLY 87 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2vne n ASP 88 N 0.00 1.28 0.00 1.61 5.68 -1.26 -4.90 116.55 118.96 2vne n ASP 88 Ca 0.00 -1.68 0.00 0.00 -0.50 0.00 0.00 54.79 52.61 2vne n ASP 88 Cb 0.00 -0.09 0.00 0.00 -1.14 0.00 0.00 41.12 39.89 2vne n ASP 88 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2vne n GLY 89 N 1.03 0.85 1.29 6.12 0.00 -1.26 -4.56 105.19 108.67 2vne n GLY 89 Ca 0.15 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.08 2vne n GLY 89 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vne n GLY 90 N -2.00 0.14 3.76 -0.02 0.00 -1.26 -4.46 105.19 101.35 2vne n GLY 90 Ca 0.00 -1.89 -0.39 0.00 0.00 0.00 0.00 46.02 43.74 2vne n GLY 90 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2vne s VAL 91 N -1.20 2.37 0.00 1.61 -7.23 -1.26 -1.81 120.40 112.88 2vne s VAL 91 Ca 0.23 0.31 0.00 0.00 -1.81 0.00 0.00 61.98 60.71 2vne s VAL 91 Cb -0.01 -3.18 0.00 0.00 0.56 0.00 0.00 36.38 33.75 2vne s VAL 91 CO 0.16 0.03 0.00 0.61 -0.31 0.00 0.00 175.10 175.59 2vne n GLY 92 N 0.63 3.08 3.68 2.32 0.00 0.17 -5.02 105.19 110.05 2vne n GLY 92 Ca 0.06 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.62 2vne n GLY 92 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2vne n THR 93 N -0.38 0.08 -4.33 2.61 -1.04 -0.75 -4.70 114.28 105.77 2vne n THR 93 Ca 0.00 -0.02 -0.35 0.00 -2.04 0.00 0.00 64.05 61.64 2vne n THR 93 Cb 0.00 -1.59 -0.10 0.00 -1.82 0.00 0.00 70.33 66.82 2vne n THR 93 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 2vne s ILE 94 N 0.85 4.34 -0.16 12.58 1.01 -0.33 -0.76 121.20 138.73 2vne s ILE 94 Ca 0.77 -0.23 0.01 0.00 0.00 0.00 0.00 60.65 61.21 2vne s ILE 94 Cb -0.65 -2.85 0.02 0.00 0.01 0.00 0.00 42.46 38.98 2vne s ILE 94 CO 0.38 0.58 -0.20 -0.76 0.00 0.00 0.00 174.94 174.94 2vne s LEU 95 N -0.61 2.06 0.71 2.97 1.02 0.10 -1.10 118.68 123.83 2vne s LEU 95 Ca 0.10 -0.61 0.02 0.00 0.02 0.00 0.00 54.13 53.66 2vne s LEU 95 Cb -0.12 -1.42 0.13 0.00 0.02 0.00 0.00 46.19 44.80 2vne s LEU 95 CO 0.02 0.02 0.97 -0.62 0.02 0.00 0.00 176.35 176.76 2vne s ASP 96 N 1.18 4.40 0.00 2.29 -1.08 -0.05 -0.35 116.67 123.05 2vne s ASP 96 Ca 0.01 -0.53 0.00 0.00 -0.52 0.00 0.00 52.55 51.51 2vne s ASP 96 Cb -0.14 0.18 0.00 0.00 -1.46 0.00 0.00 42.92 41.51 2vne s ASP 96 CO -0.09 -1.83 0.00 1.07 0.52 0.00 0.00 175.17 174.83 2vne n THR 98 N -2.76 0.00 -3.70 1.71 5.66 -0.77 -1.45 114.28 112.98 2vne n THR 98 Ca 0.16 0.00 -0.21 0.00 -3.05 0.00 0.00 64.05 60.95 2vne n THR 98 Cb 0.61 0.00 -0.03 0.00 -1.55 0.00 0.00 70.33 69.36 2vne n THR 98 CO 0.00 0.00 0.00 -0.36 -3.05 0.00 0.00 175.07 171.66 2vne s PHE 99 N -0.49 2.82 0.42 1.09 0.08 0.48 -1.90 117.98 120.48 2vne s PHE 99 Ca 0.00 -0.39 -0.25 0.00 0.12 0.00 0.00 56.93 56.42 2vne s PHE 99 Cb 0.00 -1.97 -0.08 0.00 -0.57 0.00 0.00 43.02 40.40 2vne s PHE 99 CO 0.00 0.05 1.16 0.54 -0.10 0.00 0.00 175.22 176.87 2vne s VAL 100 N -2.38 3.17 0.22 -0.44 0.11 -1.26 -4.69 120.40 115.13 2vne s VAL 100 Ca 0.44 0.95 -0.30 0.00 -2.93 0.00 0.00 61.98 60.14 2vne s VAL 100 Cb -0.05 -3.52 -0.16 0.00 -1.53 0.00 0.00 36.38 31.13 2vne s VAL 100 CO 0.27 0.06 0.94 -2.65 -3.33 0.00 0.00 175.10 170.38 2vne n PRO 101 N -0.08 0.90 0.00 1.54 -0.02 -1.26 -2.69 135.00 133.38 2vne n PRO 101 Ca 0.05 0.32 0.00 0.00 -2.02 0.00 0.00 63.50 61.85 2vne n PRO 101 Cb 0.47 -1.64 0.00 0.00 -0.02 0.00 0.00 33.50 32.31 2vne n PRO 101 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2vne n GLY 102 N 1.66 3.10 3.71 -1.23 0.00 -1.26 -5.06 105.19 106.11 2vne n GLY 102 Ca 0.14 -0.85 -0.38 0.00 0.00 0.00 0.00 46.02 44.93 2vne n GLY 102 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2vne n GLU 103 N 0.00 1.33 0.00 1.61 -0.58 -1.09 -5.05 120.64 116.85 2vne n GLU 103 Ca 0.00 0.50 0.00 0.00 -0.42 0.00 0.00 57.16 57.24 2vne n GLU 103 Cb 0.00 -2.48 0.00 0.00 -0.57 0.00 0.00 31.44 28.39 2vne n GLU 103 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 2vne n PHE 104 N -1.49 0.00 0.00 -0.32 7.35 -1.26 -4.11 117.46 117.64 2vne n PHE 104 Ca 0.13 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.82 2vne n PHE 104 Cb 0.46 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.29 2vne n PHE 104 CO 0.00 0.00 0.00 -2.30 -0.76 0.00 0.00 176.76 173.70 2vne n PRO 105 N 0.00 0.00 -0.30 -7.13 -0.02 -1.26 -4.81 135.00 121.48 2vne n PRO 105 Ca 0.00 0.00 -0.05 0.00 -2.02 0.00 0.00 63.50 61.43 2vne n PRO 105 Cb 0.00 0.00 0.07 0.00 -0.02 0.00 0.00 33.50 33.55 2vne n PRO 105 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2vne h HIS 106 N 0.00 1.22 -2.26 6.00 2.76 -1.93 -3.41 115.15 117.53 2vne h HIS 106 Ca 0.00 -0.07 -0.05 0.00 -2.20 0.00 0.00 60.37 58.04 2vne h HIS 106 Cb 0.00 -0.37 -0.23 0.00 1.55 0.00 0.00 27.41 28.36 2vne h HIS 106 CO 0.00 0.90 -0.05 -2.00 -1.30 0.00 0.00 177.93 175.48 2vne s GLU 107 N -5.63 0.65 0.02 5.26 2.12 -1.26 -0.39 118.70 119.47 2vne s GLU 107 Ca -0.12 0.95 -0.18 0.00 0.36 0.00 0.00 54.97 55.97 2vne s GLU 107 Cb 0.16 0.21 0.04 0.00 0.26 0.00 0.00 34.13 34.80 2vne s GLU 107 CO 0.84 -0.12 0.41 1.52 -0.54 0.00 0.00 175.26 177.37 2vne s TYR 108 N 0.93 -0.28 0.26 5.30 1.13 -1.26 -1.49 117.35 121.94 2vne s TYR 108 Ca -0.05 0.32 -0.01 0.00 -1.41 0.00 0.00 57.07 55.92 2vne s TYR 108 Cb -0.05 0.20 -0.04 0.00 -1.10 0.00 0.00 41.96 40.97 2vne s TYR 108 CO -0.08 -0.53 0.47 0.15 -2.51 0.00 0.00 175.55 173.05 2vne s LYS 109 N -2.08 3.54 -0.00 -3.49 1.02 0.49 -4.47 119.74 114.75 2vne s LYS 109 Ca -0.08 -0.26 -0.02 0.00 0.02 0.00 0.00 55.97 55.63 2vne s LYS 109 Cb -0.02 -2.75 -0.00 0.00 -0.52 0.00 0.00 37.83 34.54 2vne s LYS 109 CO 0.00 0.30 0.04 -1.21 -0.92 0.00 0.00 175.35 173.56 2vne s GLU 110 N -3.62 0.24 -0.11 1.68 2.02 0.52 -1.95 118.70 117.48 2vne s GLU 110 Ca 0.40 -0.27 0.02 0.00 0.02 0.00 0.00 54.97 55.14 2vne s GLU 110 Cb -0.11 0.10 0.01 0.00 0.10 0.00 0.00 34.13 34.23 2vne s GLU 110 CO 0.31 -0.05 -0.17 0.21 0.02 0.00 0.00 175.26 175.58 2vne s LYS 111 N -0.80 2.41 -0.73 1.61 2.20 0.24 0.02 119.74 124.69 2vne s LYS 111 Ca -0.09 -0.64 -0.26 0.00 -0.36 0.00 0.00 55.97 54.62 2vne s LYS 111 Cb -0.05 -1.98 -0.01 0.00 -1.51 0.00 0.00 37.83 34.27 2vne s LYS 111 CO -0.00 -0.01 1.76 0.12 -0.36 0.00 0.00 175.35 176.87 2vne s PHE 112 N 0.83 1.85 -0.13 4.03 2.19 0.06 -1.44 117.98 125.37 2vne s PHE 112 Ca -0.09 0.51 -0.00 0.00 0.33 0.00 0.00 56.93 57.67 2vne s PHE 112 Cb -0.16 -4.20 -0.24 0.00 -1.31 0.00 0.00 43.02 37.11 2vne s PHE 112 CO 0.01 -2.12 0.34 1.51 1.83 0.00 0.00 175.22 176.79 2vne n ILE 113 N 7.22 1.69 -3.74 3.12 0.13 -0.64 0.46 119.36 127.60 2vne n ILE 113 Ca 0.23 -0.68 -0.13 0.00 -1.10 0.00 0.00 62.75 61.07 2vne n ILE 113 Cb 0.50 -1.49 -0.10 0.00 -0.84 0.00 0.00 39.64 37.72 2vne n ILE 113 CO 0.00 0.00 0.00 -0.22 2.80 0.00 0.00 176.55 179.13 2vne s LEU 114 N -6.70 0.52 -0.01 9.51 0.20 -1.12 -4.77 118.68 116.30 2vne s LEU 114 Ca -0.20 0.71 0.02 0.00 0.69 0.00 0.00 54.13 55.35 2vne s LEU 114 Cb 0.07 1.36 0.00 0.00 -0.43 0.00 0.00 46.19 47.20 2vne s LEU 114 CO 0.76 -0.18 -0.06 0.54 -0.29 0.00 0.00 176.35 177.12 2vne s VAL 115 N -0.00 0.49 -0.31 1.68 0.11 -1.26 -1.77 120.40 119.34 2vne s VAL 115 Ca -0.02 -0.23 -0.01 0.00 -2.93 0.00 0.00 61.98 58.79 2vne s VAL 115 Cb -0.03 -0.44 0.10 0.00 -1.53 0.00 0.00 36.38 34.48 2vne s VAL 115 CO 0.01 0.16 0.11 -0.62 -3.33 0.00 0.00 175.10 171.43 2vne s ASP 116 N 0.09 3.91 0.25 3.54 -1.08 0.37 -5.01 116.67 118.74 2vne s ASP 116 Ca -0.01 -1.62 0.05 0.00 -0.52 0.00 0.00 52.55 50.46 2vne s ASP 116 Cb -0.05 -0.77 0.31 0.00 -1.46 0.00 0.00 42.92 40.96 2vne s ASP 116 CO -0.00 -0.41 1.60 0.78 0.52 0.00 0.00 175.17 177.66 2vne h ASN 117 N 8.08 0.25 -0.30 -0.34 2.35 -1.96 0.13 115.58 123.80 2vne h ASN 117 Ca -0.14 -0.13 -0.08 0.00 -0.55 0.00 0.00 56.30 55.40 2vne h ASN 117 Cb 1.01 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 39.30 2vne h ASN 117 CO 0.46 0.75 -0.14 -0.08 -1.65 0.00 0.00 177.43 176.78 2vne h GLU 118 N 0.17 0.61 -0.00 0.81 4.81 -1.96 -2.94 114.58 116.08 2vne h GLU 118 Ca 0.00 -0.27 0.00 0.00 -0.13 0.00 0.00 59.36 58.96 2vne h GLU 118 Cb 1.03 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.39 2vne h GLU 118 CO 0.08 0.84 -0.29 0.72 -0.73 0.00 0.00 179.01 179.63 2vne n HIS 119 N -4.41 0.00 -3.40 0.92 8.25 -1.20 -4.97 115.22 110.41 2vne n HIS 119 Ca -0.03 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.23 2vne n HIS 119 Cb 0.37 -0.25 0.05 0.00 1.12 0.00 0.00 29.99 31.28 2vne n HIS 119 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 2vne n ARG 120 N -1.20 -1.77 -4.31 -0.41 1.74 0.24 -4.58 116.66 106.37 2vne n ARG 120 Ca 0.09 0.78 -0.18 0.00 -0.77 0.00 0.00 57.85 57.77 2vne n ARG 120 Cb 0.33 -5.12 -0.14 0.00 -1.02 0.00 0.00 32.46 26.50 2vne n ARG 120 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 2vne s LEU 121 N -5.63 2.04 -0.06 0.55 0.20 0.07 -1.74 118.68 114.11 2vne s LEU 121 Ca 0.41 -0.20 -0.02 0.00 0.69 0.00 0.00 54.13 55.01 2vne s LEU 121 Cb -0.09 -0.42 0.04 0.00 -0.43 0.00 0.00 46.19 45.29 2vne s LEU 121 CO 0.79 0.08 0.12 -0.75 -0.29 0.00 0.00 176.35 176.30 2vne s LYS 122 N -0.35 0.04 -0.16 1.98 2.20 -0.23 -0.48 119.74 122.76 2vne s LYS 122 Ca 0.02 0.38 0.01 0.00 -0.36 0.00 0.00 55.97 56.02 2vne s LYS 122 Cb -0.04 -0.23 0.00 0.00 -1.51 0.00 0.00 37.83 36.05 2vne s LYS 122 CO -0.00 -0.21 -0.17 0.15 -0.36 0.00 0.00 175.35 174.76 2vne s LYS 123 N 1.46 3.16 -0.11 4.03 1.02 -0.73 -0.54 119.74 128.03 2vne s LYS 123 Ca -0.06 -0.77 0.02 0.00 0.02 0.00 0.00 55.97 55.18 2vne s LYS 123 Cb -0.12 -2.60 0.01 0.00 -0.52 0.00 0.00 37.83 34.61 2vne s LYS 123 CO -0.05 -0.02 -0.17 0.14 -0.92 0.00 0.00 175.35 174.33 2vne s VAL 124 N 0.89 1.60 0.00 3.17 -7.23 -0.37 -1.63 120.40 116.82 2vne s VAL 124 Ca -0.04 -0.71 0.00 0.00 -1.81 0.00 0.00 61.98 59.42 2vne s VAL 124 Cb -0.15 -1.44 0.00 0.00 0.56 0.00 0.00 36.38 35.35 2vne s VAL 124 CO -0.02 0.46 0.00 1.67 -0.31 0.00 0.00 175.10 176.90 2vne n GLN 125 N 4.12 3.13 0.00 4.82 7.27 -0.52 -1.06 117.38 135.14 2vne n GLN 125 Ca -0.19 0.00 0.00 0.00 0.07 0.00 0.00 57.00 56.88 2vne n GLN 125 Cb 0.51 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.16 2vne n GLN 125 CO 0.00 0.00 0.00 0.44 0.07 0.00 0.00 177.06 177.57 2vne n ILE 127 N 0.00 0.00 -3.65 1.69 -5.35 -0.82 -0.59 119.36 110.64 2vne n ILE 127 Ca 0.00 0.00 -0.13 0.00 -0.27 0.00 0.00 62.75 62.35 2vne n ILE 127 Cb 0.00 0.00 -0.08 0.00 -1.74 0.00 0.00 39.64 37.82 2vne n ILE 127 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 2vne s GLU 128 N 0.00 0.77 1.91 6.28 2.12 -1.25 -4.97 118.70 123.55 2vne s GLU 128 Ca 0.00 0.96 0.00 0.00 0.36 0.00 0.00 54.97 56.29 2vne s GLU 128 Cb 0.00 0.35 0.00 0.00 0.26 0.00 0.00 34.13 34.74 2vne s GLU 128 CO 0.00 -0.10 0.00 0.41 -0.54 0.00 0.00 175.26 175.03 2vne n GLY 129 N 2.91 -1.22 7.00 -1.50 0.00 -1.26 -0.38 105.19 110.74 2vne n GLY 129 Ca -0.15 -1.24 0.00 0.00 0.00 0.00 0.00 46.02 44.64 2vne n GLY 129 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2vne n GLY 130 N 0.00 3.18 0.27 -0.02 0.00 -0.56 -2.06 105.19 106.01 2vne n GLY 130 Ca 0.00 -0.04 0.18 0.00 0.00 0.00 0.00 46.02 46.15 2vne n GLY 130 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2vne h TYR 131 N 0.00 0.00 0.00 1.61 0.05 -1.93 -2.47 116.97 114.24 2vne h TYR 131 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 2vne h TYR 131 Cb 0.00 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.74 2vne h TYR 131 CO 0.00 0.00 0.00 1.28 -1.05 0.00 0.00 178.16 178.39 2vne n LEU 132 N -2.94 0.32 -1.25 3.88 4.77 -0.87 -0.65 117.00 120.26 2vne n LEU 132 Ca -0.00 0.59 0.09 0.00 -0.03 0.00 0.00 56.01 56.65 2vne n LEU 132 Cb 0.23 -0.55 0.28 0.00 -2.33 0.00 0.00 43.42 41.05 2vne n LEU 132 CO 0.24 -0.45 0.73 0.47 -1.33 0.00 0.00 177.39 177.06 2vne n ASP 133 N -1.86 3.64 -2.71 -1.43 8.00 -0.93 -4.44 116.55 116.82 2vne n ASP 133 Ca 0.02 -2.20 -0.07 0.00 0.71 0.00 0.00 54.79 53.25 2vne n ASP 133 Cb 0.17 -0.47 0.04 0.00 -0.02 0.00 0.00 41.12 40.84 2vne n ASP 133 CO 0.00 0.00 0.00 -0.11 -0.39 0.00 0.00 177.20 176.70 2vne n LEU 134 N 1.05 1.37 0.00 0.64 7.94 0.18 -4.97 117.00 123.20 2vne n LEU 134 Ca 0.21 -3.52 0.00 0.00 -1.11 0.00 0.00 56.01 51.59 2vne n LEU 134 Cb 0.64 0.43 0.00 0.00 0.53 0.00 0.00 43.42 45.02 2vne n LEU 134 CO 0.17 1.43 0.00 0.61 -1.11 0.00 0.00 177.39 178.49 2vne n GLY 135 N -0.23 0.83 3.70 -3.96 0.00 -1.24 -4.89 105.19 99.40 2vne n GLY 135 Ca 0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.73 2vne n GLY 135 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2vne s VAL 136 N -3.37 5.26 -1.30 1.61 1.01 -1.15 -1.87 120.40 120.60 2vne s VAL 136 Ca 0.00 0.62 0.15 0.00 0.00 0.00 0.00 61.98 62.75 2vne s VAL 136 Cb 0.00 -3.67 -0.02 0.00 0.00 0.00 0.00 36.38 32.68 2vne s VAL 136 CO 0.00 0.34 0.79 0.35 0.00 0.00 0.00 175.10 176.58 2vne n THR 137 N 3.88 0.00 -3.65 3.92 -2.24 0.40 -4.24 114.28 112.35 2vne n THR 137 Ca -0.10 -0.32 -0.12 0.00 -2.27 0.00 0.00 64.05 61.23 2vne n THR 137 Cb 0.52 1.16 -0.08 0.00 -2.10 0.00 0.00 70.33 69.83 2vne n THR 137 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 2vne s TYR 138 N -1.86 -0.80 0.01 4.78 6.14 -1.24 -4.95 117.35 119.43 2vne s TYR 138 Ca 0.12 1.84 -0.17 0.00 0.64 0.00 0.00 57.07 59.49 2vne s TYR 138 Cb 0.12 0.33 0.03 0.00 0.42 0.00 0.00 41.96 42.86 2vne s TYR 138 CO 0.40 -0.39 0.38 -0.47 0.64 0.00 0.00 175.55 176.11 2vne s TYR 139 N 0.66 -0.24 -0.22 4.97 5.04 -1.26 -2.06 117.35 124.24 2vne s TYR 139 Ca -0.02 0.29 -0.15 0.00 -2.44 0.00 0.00 57.07 54.75 2vne s TYR 139 Cb -0.05 0.16 0.06 0.00 0.35 0.00 0.00 41.96 42.49 2vne s TYR 139 CO -0.04 -0.48 0.55 -0.51 -1.34 0.00 0.00 175.55 173.73 2vne s ASP 141 N -1.63 -0.68 -0.10 4.32 1.01 -0.22 -4.47 116.67 114.90 2vne s ASP 141 Ca -0.09 1.18 0.03 0.00 0.71 0.00 0.00 52.55 54.38 2vne s ASP 141 Cb -0.03 1.10 -0.01 0.00 1.01 0.00 0.00 42.92 45.00 2vne s ASP 141 CO 0.02 -0.21 -0.21 -0.89 0.21 0.00 0.00 175.17 174.08 2vne s THR 142 N 1.06 2.32 -0.14 -1.27 2.01 0.07 -1.24 115.64 118.46 2vne s THR 142 Ca -0.06 -0.94 0.02 0.00 0.31 0.00 0.00 61.69 61.02 2vne s THR 142 Cb -0.06 -1.90 0.00 0.00 0.01 0.00 0.00 72.50 70.55 2vne s THR 142 CO -0.10 0.55 -0.19 -0.63 -0.69 0.00 0.00 174.62 173.56 2vne s ILE 143 N 0.23 2.34 -0.12 1.82 1.09 0.30 -1.23 121.20 125.63 2vne s ILE 143 Ca -0.14 -0.89 -0.01 0.00 -1.10 0.00 0.00 60.65 58.51 2vne s ILE 143 Cb -0.17 -1.95 0.04 0.00 -1.06 0.00 0.00 42.46 39.32 2vne s ILE 143 CO 0.07 0.54 -0.01 -2.28 -0.10 0.00 0.00 174.94 173.15 2vne s HIS 144 N 0.71 1.04 -0.44 3.97 2.46 -0.54 -1.06 115.29 121.43 2vne s HIS 144 Ca -0.09 -0.55 -0.15 0.00 0.47 0.00 0.00 55.06 54.75 2vne s HIS 144 Cb -0.16 -1.00 0.05 0.00 -0.13 0.00 0.00 32.58 31.33 2vne s HIS 144 CO 0.01 -0.46 0.35 0.08 -2.47 0.00 0.00 174.74 172.25 2vne s VAL 145 N 1.85 5.24 -0.18 0.89 1.01 -0.71 0.16 120.40 128.66 2vne s VAL 145 Ca 0.03 -0.85 -0.02 0.00 0.00 0.00 0.00 61.98 61.14 2vne s VAL 145 Cb -0.14 -4.03 -0.01 0.00 0.00 0.00 0.00 36.38 32.21 2vne s VAL 145 CO -0.07 -0.44 -0.08 0.54 0.00 0.00 0.00 175.10 175.04 2vne s VAL 146 N 1.67 3.20 0.47 2.92 0.11 -0.34 -4.73 120.40 123.70 2vne s VAL 146 Ca 0.05 -0.57 -0.23 0.00 -2.93 0.00 0.00 61.98 58.30 2vne s VAL 146 Cb -0.22 -2.41 -0.07 0.00 -1.53 0.00 0.00 36.38 32.16 2vne s VAL 146 CO 0.08 0.47 1.20 -2.16 -3.33 0.00 0.00 175.10 171.37 2vne s PRO 147 N 0.97 3.65 -0.04 1.54 0.04 -1.26 -0.31 135.00 139.59 2vne s PRO 147 Ca -0.01 1.85 -0.05 0.00 0.04 0.00 0.00 61.00 62.83 2vne s PRO 147 Cb -0.15 -2.38 -0.02 0.00 0.04 0.00 0.00 34.50 32.00 2vne s PRO 147 CO -0.00 -0.66 -0.10 2.41 0.04 0.00 0.00 177.00 178.69 2vne n THR 148 N -0.58 0.58 -3.34 1.26 -1.04 -0.23 -4.82 114.28 106.10 2vne n THR 148 Ca 0.08 0.29 0.00 0.00 -2.04 0.00 0.00 64.05 62.38 2vne n THR 148 Cb 0.48 -1.66 0.00 0.00 -1.82 0.00 0.00 70.33 67.33 2vne n THR 148 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2vne n GLY 149 N 2.12 3.00 0.17 3.41 0.00 -1.23 -4.99 105.19 107.66 2vne n GLY 149 Ca -0.04 -2.15 -0.04 0.00 0.00 0.00 0.00 46.02 43.78 2vne n GLY 149 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2vne h LYS 150 N 0.00 0.10 -0.59 1.61 1.63 -1.99 -3.18 116.57 114.15 2vne h LYS 150 Ca 0.00 -0.01 -0.43 0.00 -0.85 0.00 0.00 60.65 59.36 2vne h LYS 150 Cb 0.00 -0.02 -0.34 0.00 -0.60 0.00 0.00 32.23 31.26 2vne h LYS 150 CO 0.00 0.07 -0.76 -0.25 -3.45 0.00 0.00 179.45 175.06 2vne n ASP 151 N -5.20 4.22 -3.91 4.20 10.43 -1.26 -4.71 116.55 120.33 2vne n ASP 151 Ca 0.03 -3.74 -0.10 0.00 2.57 0.00 0.00 54.79 53.55 2vne n ASP 151 Cb 0.21 -0.38 -0.09 0.00 1.84 0.00 0.00 41.12 42.70 2vne n ASP 151 CO 0.00 0.00 0.00 -0.94 -1.07 0.00 0.00 177.20 175.19 2vne s SER 152 N -3.53 0.14 0.21 -2.24 1.04 -1.18 -2.34 113.70 105.80 2vne s SER 152 Ca 0.48 -0.48 -0.18 0.00 0.48 0.00 0.00 55.95 56.26 2vne s SER 152 Cb 0.40 0.24 0.03 0.00 0.10 0.00 0.00 66.02 66.79 2vne s SER 152 CO 0.02 -0.51 0.54 0.00 0.98 0.00 0.00 173.24 174.26 2vne s VAL 154 N -3.89 4.28 -0.43 0.00 1.01 0.57 -1.29 120.40 120.66 2vne s VAL 154 Ca 0.10 -0.56 -0.12 0.00 0.00 0.00 0.00 61.98 61.40 2vne s VAL 154 Cb -0.01 -2.92 0.06 0.00 0.00 0.00 0.00 36.38 33.51 2vne s VAL 154 CO -0.01 0.37 0.30 -0.63 0.00 0.00 0.00 175.10 175.13 2vne s ILE 155 N -1.11 4.75 -0.65 2.22 1.01 -0.31 -1.20 121.20 125.91 2vne s ILE 155 Ca 0.20 -1.12 -0.18 0.00 0.00 0.00 0.00 60.65 59.55 2vne s ILE 155 Cb -0.12 -3.81 0.12 0.00 0.01 0.00 0.00 42.46 38.67 2vne s ILE 155 CO 0.11 -0.47 0.73 -0.54 0.00 0.00 0.00 174.94 174.78 2vne s LYS 156 N 1.55 3.16 -0.17 2.79 1.02 0.12 -2.37 119.74 125.85 2vne s LYS 156 Ca 0.03 -1.55 -0.07 0.00 0.02 0.00 0.00 55.97 54.40 2vne s LYS 156 Cb -0.22 -4.36 -0.04 0.00 -0.52 0.00 0.00 37.83 32.69 2vne s LYS 156 CO 0.05 -1.51 0.08 -1.12 -0.92 0.00 0.00 175.35 171.92 2vne s SER 157 N 3.45 5.78 0.07 2.83 0.01 -0.25 -1.47 113.70 124.12 2vne s SER 157 Ca 0.13 0.16 0.00 0.00 1.31 0.00 0.00 55.95 57.56 2vne s SER 157 Cb -0.21 -1.95 -0.04 0.00 0.21 0.00 0.00 66.02 64.03 2vne s SER 157 CO 0.02 0.23 -0.05 -0.94 0.41 0.00 0.00 173.24 172.91 2vne s SER 158 N 0.05 0.78 -0.03 2.44 1.04 -0.36 0.08 113.70 117.69 2vne s SER 158 Ca 0.06 -0.93 0.01 0.00 0.48 0.00 0.00 55.95 55.57 2vne s SER 158 Cb -0.12 0.14 0.02 0.00 0.10 0.00 0.00 66.02 66.16 2vne s SER 158 CO 0.00 -0.49 -0.02 0.42 0.98 0.00 0.00 173.24 174.14 2vne s THR 159 N -3.42 0.29 -0.08 2.02 -4.23 -0.78 -0.75 115.64 108.69 2vne s THR 159 Ca 0.06 0.01 0.02 0.00 -1.18 0.00 0.00 61.69 60.60 2vne s THR 159 Cb 0.04 -0.35 -0.02 0.00 1.34 0.00 0.00 72.50 73.50 2vne s THR 159 CO -0.06 0.16 -0.12 -0.70 -0.54 0.00 0.00 174.62 173.36 2vne s GLU 160 N 0.91 2.85 0.05 3.99 2.12 -1.26 -1.53 118.70 125.83 2vne s GLU 160 Ca -0.10 -0.66 -0.01 0.00 0.36 0.00 0.00 54.97 54.56 2vne s GLU 160 Cb -0.13 -2.51 -0.04 0.00 0.26 0.00 0.00 34.13 31.71 2vne s GLU 160 CO -0.01 0.49 -0.03 1.52 -0.54 0.00 0.00 175.26 176.69 2vne s TYR 161 N -0.37 0.52 -0.15 5.30 1.13 0.24 -4.13 117.35 119.88 2vne s TYR 161 Ca 0.04 -0.98 0.02 0.00 -1.41 0.00 0.00 57.07 54.74 2vne s TYR 161 Cb -0.12 -0.37 0.01 0.00 -1.10 0.00 0.00 41.96 40.37 2vne s TYR 161 CO 0.02 -0.33 -0.20 -1.01 -2.51 0.00 0.00 175.55 171.52 2vne s HIS 162 N -3.55 2.72 -0.02 -3.49 3.76 -0.88 -0.78 115.29 113.05 2vne s HIS 162 Ca 0.04 -1.35 0.05 0.00 -0.15 0.00 0.00 55.06 53.65 2vne s HIS 162 Cb 0.05 -1.86 -0.01 0.00 1.11 0.00 0.00 32.58 31.87 2vne s HIS 162 CO -0.08 -0.63 -0.18 0.14 -0.85 0.00 0.00 174.74 173.14 2vne s VAL 163 N 0.93 1.43 0.35 -0.90 -7.23 0.03 -0.45 120.40 114.56 2vne s VAL 163 Ca -0.04 -0.76 -0.28 0.00 -1.81 0.00 0.00 61.98 59.09 2vne s VAL 163 Cb -0.15 -1.20 -0.12 0.00 0.56 0.00 0.00 36.38 35.47 2vne s VAL 163 CO -0.04 0.41 1.37 0.29 -0.31 0.00 0.00 175.10 176.82 2vne n LYS 164 N 2.76 2.32 -0.11 4.82 5.02 -0.78 0.02 118.16 132.21 2vne n LYS 164 Ca -0.16 0.81 0.12 0.00 -2.02 0.00 0.00 58.31 57.07 2vne n LYS 164 Cb 0.54 -2.45 0.49 0.00 -0.02 0.00 0.00 35.03 33.58 2vne n LYS 164 CO 0.00 0.00 0.00 -1.35 -0.52 0.00 0.00 177.40 175.53 2vne h PRO 165 N 2.83 0.42 -0.20 1.97 0.11 -1.93 -0.59 132.00 134.60 2vne h PRO 165 Ca -0.48 -0.03 0.01 0.00 0.11 0.00 0.00 66.00 65.62 2vne h PRO 165 Cb 1.27 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.27 2vne h PRO 165 CO 0.64 0.28 0.13 0.93 -0.21 0.00 0.00 178.00 179.77 2vne h GLU 166 N 0.43 0.22 -0.02 1.05 3.07 -1.96 -3.02 114.58 114.35 2vne h GLU 166 Ca 0.30 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.15 2vne h GLU 166 Cb 0.59 -0.05 0.00 0.00 -0.84 0.00 0.00 28.75 28.45 2vne h GLU 166 CO -0.09 0.14 -0.29 1.19 -1.40 0.00 0.00 179.01 178.56 2vne n PHE 167 N -4.51 0.00 -0.35 4.33 3.01 -0.26 -4.57 117.46 115.11 2vne n PHE 167 Ca 0.00 0.00 0.03 0.00 1.01 0.00 0.00 57.45 58.49 2vne n PHE 167 Cb 0.11 0.00 0.19 0.00 -0.01 0.00 0.00 39.48 39.77 2vne n PHE 167 CO 0.00 0.00 0.00 -0.39 1.01 0.00 0.00 176.76 177.38 2vne h VAL 168 N 2.69 1.08 0.00 -4.37 -1.51 -1.34 -1.52 116.25 111.29 2vne h VAL 168 Ca 0.00 -0.39 -0.17 0.00 -1.23 0.00 0.00 66.70 64.91 2vne h VAL 168 Cb 0.72 -0.16 -0.03 0.00 -2.13 0.00 0.00 31.29 29.70 2vne h VAL 168 CO 0.00 0.21 -0.87 0.11 -1.23 0.00 0.00 177.57 175.79 2vne h LYS 169 N 1.14 0.00 0.00 5.19 6.56 -1.80 -2.46 116.57 125.20 2vne h LYS 169 Ca 0.42 0.00 -0.11 0.00 -1.06 0.00 0.00 60.65 59.90 2vne h LYS 169 Cb 0.18 0.00 -0.02 0.00 -0.57 0.00 0.00 32.23 31.82 2vne h LYS 169 CO -0.17 0.76 -0.54 0.82 -2.06 0.00 0.00 179.45 178.26 2vne h ILE 170 N 0.00 1.33 0.00 1.86 2.04 -1.71 -3.37 117.51 117.67 2vne h ILE 170 Ca -0.03 -1.87 0.00 0.00 1.00 0.00 0.00 64.86 63.96 2vne h ILE 170 Cb 1.63 2.02 0.00 0.00 -0.74 0.00 0.00 36.82 39.74 2vne h ILE 170 CO 0.10 0.53 -1.28 0.55 0.00 0.00 0.00 178.15 178.05 2vne n VAL 171 N -3.82 0.00 0.13 1.67 3.14 -0.62 -4.52 118.33 114.30 2vne n VAL 171 Ca -0.01 -0.26 -0.01 0.00 -2.96 0.00 0.00 64.34 61.09 2vne n VAL 171 Cb 0.56 0.43 0.13 0.00 -1.06 0.00 0.00 33.84 33.90 2vne n VAL 171 CO 0.00 0.00 0.00 1.05 -6.46 0.00 0.00 176.83 171.42 2vne h GLU 172 N 0.00 0.00 0.00 1.45 4.11 -1.60 -1.90 114.58 116.64 2vne h GLU 172 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2vne h GLU 172 Cb 0.47 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.72 2vne h GLU 172 CO 0.00 0.65 0.00 -2.30 0.07 0.00 0.00 179.01 177.43 2vne n PRO 173 N -3.65 0.07 -0.11 1.06 -0.02 -1.26 -3.94 135.00 127.16 2vne n PRO 173 Ca -0.01 0.13 -0.24 0.00 -2.02 0.00 0.00 63.50 61.37 2vne n PRO 173 Cb 0.67 -1.50 -0.11 0.00 -0.02 0.00 0.00 33.50 32.54 2vne n PRO 173 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2vne n LEU 174 N -1.45 2.31 -4.67 2.45 4.77 -0.92 -4.89 117.00 114.60 2vne n LEU 174 Ca 0.06 0.21 -0.43 0.00 -0.03 0.00 0.00 56.01 55.83 2vne n LEU 174 Cb 0.22 -0.92 -0.02 0.00 -2.33 0.00 0.00 43.42 40.37 2vne n LEU 174 CO 0.18 0.65 1.03 -0.63 -1.33 0.00 0.00 177.39 177.30 2vne s ILE 175 N -2.49 4.32 0.31 -0.08 1.01 -0.76 -5.00 121.20 118.51 2vne s ILE 175 Ca -0.33 1.61 0.05 0.00 0.00 0.00 0.00 60.65 61.97 2vne s ILE 175 Cb 0.10 -4.04 -0.02 0.00 0.01 0.00 0.00 42.46 38.52 2vne s ILE 175 CO 0.58 -0.11 0.17 0.35 0.00 0.00 0.00 174.94 175.93 2vne n THR 176 N 5.19 0.00 1.36 2.92 -2.24 -1.26 -4.90 114.28 115.34 2vne n THR 176 Ca 0.13 -2.02 0.10 0.00 -2.27 0.00 0.00 64.05 59.99 2vne n THR 176 Cb 0.45 0.85 0.39 0.00 -2.10 0.00 0.00 70.33 69.92 2vne n THR 176 CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 2vne n THR 177 N -0.67 0.18 -0.21 4.28 5.66 -1.26 -4.60 114.28 117.67 2vne n THR 177 Ca 0.00 -0.29 -0.12 0.00 -3.05 0.00 0.00 64.05 60.59 2vne n THR 177 Cb 0.51 0.24 -0.09 0.00 -1.55 0.00 0.00 70.33 69.44 2vne n THR 177 CO 0.00 0.00 0.00 1.23 -3.05 0.00 0.00 175.07 173.25 2vne h GLY 178 N 5.11 -0.89 1.59 1.09 0.00 -1.97 -0.62 103.07 107.37 2vne h GLY 178 Ca 0.00 0.71 -0.00 0.00 0.00 0.00 0.00 47.33 48.04 2vne h GLY 178 CO 0.00 -0.09 0.25 -2.55 0.00 0.00 0.00 176.54 174.15 2vne h PRO 179 N -0.29 0.55 -0.08 4.80 0.11 -2.00 -1.31 132.00 133.77 2vne h PRO 179 Ca 0.11 -0.04 -0.12 0.00 0.11 0.00 0.00 66.00 66.06 2vne h PRO 179 Cb 0.56 -0.12 0.01 0.00 0.11 0.00 0.00 31.00 31.55 2vne h PRO 179 CO -0.68 0.39 -0.40 -0.07 -0.21 0.00 0.00 178.00 177.03 2vne h LEU 180 N 0.56 0.50 -1.63 2.35 4.07 -1.78 -3.22 115.31 116.16 2vne h LEU 180 Ca 0.15 -0.64 0.06 0.00 0.08 0.00 0.00 57.88 57.53 2vne h LEU 180 Cb -0.02 -0.15 -0.03 0.00 1.08 0.00 0.00 40.66 41.54 2vne h LEU 180 CO -0.03 1.06 0.35 0.00 -1.08 0.00 0.00 178.44 178.74 2vne h ALA 181 N 0.45 1.91 0.00 1.53 0.00 -0.86 -1.65 119.26 120.63 2vne h ALA 181 Ca -0.03 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2vne h ALA 181 Cb 1.05 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.73 2vne h ALA 181 CO 0.08 -0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.33 2vne n ALA 182 N -2.50 1.75 0.00 0.00 0.00 -0.52 -1.40 120.51 117.84 2vne n ALA 182 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 2vne n ALA 182 Cb 0.26 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.71 2vne n ALA 182 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2vne n ALA 184 N 0.60 0.00 -0.14 0.00 0.00 -0.62 -2.03 120.51 118.32 2vne n ALA 184 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.44 2vne n ALA 184 Cb 0.15 0.00 0.26 0.00 0.00 0.00 0.00 19.45 19.86 2vne n ALA 184 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 2vne h ASP 185 N 0.00 0.75 -0.02 0.00 3.32 -1.51 -0.76 116.42 118.20 2vne h ASP 185 Ca 0.00 -0.07 -0.03 0.00 0.02 0.00 0.00 57.03 56.95 2vne h ASP 185 Cb 0.00 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.36 2vne h ASP 185 CO 0.00 0.62 -0.11 0.00 -1.72 0.00 0.00 179.24 178.04 2vne h ALA 186 N 1.50 0.04 -0.48 3.45 0.00 -1.67 -2.72 119.26 119.37 2vne h ALA 186 Ca 0.21 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 2vne h ALA 186 Cb 0.06 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2vne h ALA 186 CO -0.03 -0.05 0.24 0.82 0.00 0.00 0.00 179.25 180.24 2vne h ILE 187 N -0.54 1.18 -0.17 0.00 2.04 -1.80 -1.81 117.51 116.42 2vne h ILE 187 Ca -0.01 -0.49 0.04 0.00 1.00 0.00 0.00 64.86 65.40 2vne h ILE 187 Cb 0.79 0.63 -0.07 0.00 -0.74 0.00 0.00 36.82 37.43 2vne h ILE 187 CO 0.02 0.20 -0.47 0.28 0.00 0.00 0.00 178.15 178.18 2vne h SER 188 N 0.63 -1.49 -0.49 1.72 0.02 -1.20 -1.85 113.55 110.90 2vne h SER 188 Ca 0.17 0.19 -0.12 0.00 -0.84 0.00 0.00 61.79 61.19 2vne h SER 188 Cb 0.09 0.60 -0.02 0.00 0.14 0.00 0.00 62.40 63.22 2vne h SER 188 CO -0.02 -0.44 -0.15 0.11 -1.14 0.00 0.00 176.83 175.19 2vne h LYS 189 N -0.51 0.98 0.00 3.45 1.57 -1.32 -0.33 116.57 120.42 2vne h LYS 189 Ca 0.07 -0.38 -0.03 0.00 -1.87 0.00 0.00 60.65 58.44 2vne h LYS 189 Cb 0.64 -0.05 -0.00 0.00 0.08 0.00 0.00 32.23 32.89 2vne h LYS 189 CO -0.44 1.05 -0.15 1.25 -0.57 0.00 0.00 179.45 180.60 2vne h LEU 190 N 0.86 0.00 0.00 2.94 7.12 -1.22 -2.93 115.31 122.09 2vne h LEU 190 Ca 0.13 0.00 -0.04 0.00 0.13 0.00 0.00 57.88 58.10 2vne h LEU 190 Cb 0.71 0.00 -0.01 0.00 -0.53 0.00 0.00 40.66 40.83 2vne h LEU 190 CO 0.05 0.15 -1.23 0.52 -0.13 0.00 0.00 178.44 177.80 2vne n VAL 191 N -4.30 0.69 -0.64 1.05 0.31 -0.71 -4.26 118.33 110.46 2vne n VAL 191 Ca -0.03 -0.58 -0.04 0.00 -0.01 0.00 0.00 64.34 63.68 2vne n VAL 191 Cb 0.22 -0.39 -0.03 0.00 -0.91 0.00 0.00 33.84 32.73 2vne n VAL 191 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 2vne n LEU 192 N -2.68 5.43 -3.96 7.52 4.77 -0.20 -4.73 117.00 123.15 2vne n LEU 192 Ca -0.03 -2.65 -0.31 0.00 -0.03 0.00 0.00 56.01 52.99 2vne n LEU 192 Cb 0.62 -1.18 -0.15 0.00 -2.33 0.00 0.00 43.42 40.38 2vne n LEU 192 CO 0.41 1.17 -0.37 -1.61 -1.33 0.00 0.00 177.39 175.66 2vne s GLU 193 N 0.04 1.52 0.00 3.23 0.41 -1.26 -5.02 118.70 117.61 2vne s GLU 193 Ca 0.16 -1.44 0.28 0.00 -0.41 0.00 0.00 54.97 53.56 2vne s GLU 193 Cb 0.09 -2.80 1.66 0.00 -1.78 0.00 0.00 34.13 31.29 2vne s GLU 193 CO -0.00 -0.80 2.00 -2.39 -0.49 0.00 0.00 175.26 173.58