#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1npp s LEU 9 N 0.00 4.37 0.07 -4.62 2.01 -1.26 -4.95 118.68 114.31 1npp s LEU 9 Ca 0.00 2.77 -0.30 0.00 0.01 0.00 0.00 54.13 56.61 1npp s LEU 9 Cb 0.00 -3.60 -0.05 0.00 0.01 0.00 0.00 46.19 42.55 1npp s LEU 9 CO 0.00 -0.92 1.10 -1.61 1.01 0.00 0.00 176.35 175.93 1npp s GLU 10 N 1.25 4.52 0.35 1.70 0.41 -1.26 -5.04 118.70 120.62 1npp s GLU 10 Ca 0.73 1.64 -0.06 0.00 -0.41 0.00 0.00 54.97 56.88 1npp s GLU 10 Cb -0.47 -3.37 -0.05 0.00 -1.78 0.00 0.00 34.13 28.46 1npp s GLU 10 CO 0.32 -0.10 0.64 0.15 -0.49 0.00 0.00 175.26 175.77 1npp s LYS 11 N 0.70 3.64 0.23 1.61 1.02 -1.26 -4.83 119.74 120.85 1npp s LYS 11 Ca 0.54 0.12 0.08 0.00 0.02 0.00 0.00 55.97 56.73 1npp s LYS 11 Cb -0.27 -2.55 -0.05 0.00 -0.52 0.00 0.00 37.83 34.45 1npp s LYS 11 CO 0.30 0.09 -0.13 0.15 -0.92 0.00 0.00 175.35 174.84 1npp s LYS 12 N -3.87 1.42 0.10 1.68 1.02 -0.02 -4.75 119.74 115.32 1npp s LYS 12 Ca 0.46 -1.66 -0.27 0.00 0.02 0.00 0.00 55.97 54.52 1npp s LYS 12 Cb -0.10 -1.20 -0.06 0.00 -0.52 0.00 0.00 37.83 35.94 1npp s LYS 12 CO 0.33 0.16 0.82 -1.58 -0.92 0.00 0.00 175.35 174.17 1npp s TRP 13 N -2.93 3.81 0.05 3.18 0.52 -1.26 -0.61 118.94 121.70 1npp s TRP 13 Ca 0.25 1.62 0.05 0.00 0.02 0.00 0.00 56.10 58.04 1npp s TRP 13 Cb -0.00 -2.87 -0.02 0.00 -1.15 0.00 0.00 33.47 29.42 1npp s TRP 13 CO 0.09 0.33 -0.15 0.71 0.02 0.00 0.00 176.95 177.95 1npp s TYR 14 N -0.39 1.28 -0.21 -1.98 2.02 0.15 0.48 117.35 118.71 1npp s TYR 14 Ca 0.40 -0.38 -0.09 0.00 -0.37 0.00 0.00 57.07 56.62 1npp s TYR 14 Cb -0.22 -0.75 -0.05 0.00 -0.40 0.00 0.00 41.96 40.55 1npp s TYR 14 CO 0.26 0.05 0.11 0.00 -1.57 0.00 0.00 175.55 174.40 1npp s ALA 15 N -0.97 3.55 -0.19 3.71 0.00 -1.26 -1.80 121.76 124.80 1npp s ALA 15 Ca 0.01 -0.77 -0.06 0.00 0.00 0.00 0.00 51.96 51.14 1npp s ALA 15 Cb -0.09 -2.11 -0.03 0.00 0.00 0.00 0.00 23.12 20.89 1npp s ALA 15 CO 0.02 0.06 0.02 -0.51 0.00 0.00 0.00 175.76 175.34 1npp s LEU 16 N 0.58 3.46 -0.07 0.00 1.43 0.25 -0.49 118.68 123.84 1npp s LEU 16 Ca 0.06 -0.09 -0.29 0.00 -1.03 0.00 0.00 54.13 52.78 1npp s LEU 16 Cb -0.12 -1.87 -0.02 0.00 0.03 0.00 0.00 46.19 44.21 1npp s LEU 16 CO 0.01 0.12 0.96 -1.10 0.23 0.00 0.00 176.35 176.56 1npp s GLN 17 N 0.70 4.47 0.28 1.70 -0.21 0.51 -1.96 119.66 125.15 1npp s GLN 17 Ca 0.01 1.34 0.02 0.00 0.02 0.00 0.00 55.36 56.76 1npp s GLN 17 Cb -0.14 -3.51 -0.06 0.00 1.00 0.00 0.00 33.01 30.31 1npp s GLN 17 CO 0.02 -0.19 0.08 0.14 -2.12 0.00 0.00 175.29 173.22 1npp s VAL 18 N 1.56 0.84 -0.13 1.09 -7.23 0.84 -0.64 120.40 116.74 1npp s VAL 18 Ca 0.48 -2.00 -0.29 0.00 -1.81 0.00 0.00 61.98 58.36 1npp s VAL 18 Cb -0.19 -2.68 -0.05 0.00 0.56 0.00 0.00 36.38 34.01 1npp s VAL 18 CO 0.21 -0.02 1.83 -0.70 -0.31 0.00 0.00 175.10 176.11 1npp s GLU 19 N -3.97 3.82 0.15 4.82 2.12 0.10 -4.34 118.70 121.40 1npp s GLU 19 Ca 0.37 2.06 -0.34 0.00 0.36 0.00 0.00 54.97 57.42 1npp s GLU 19 Cb 0.08 -4.12 -0.14 0.00 0.26 0.00 0.00 34.13 30.20 1npp s GLU 19 CO 0.14 -1.29 1.55 -2.30 -0.54 0.00 0.00 175.26 172.82 1npp n PRO 20 N 7.75 2.04 -0.39 4.30 -0.02 -1.26 -1.18 135.00 146.25 1npp n PRO 20 Ca 0.21 0.74 0.00 0.00 -2.02 0.00 0.00 63.50 62.42 1npp n PRO 20 Cb 0.44 -2.49 0.00 0.00 -0.02 0.00 0.00 33.50 31.43 1npp n PRO 20 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1npp n GLY 21 N 3.32 0.71 0.30 -1.23 0.00 -1.26 -4.87 105.19 102.16 1npp n GLY 21 Ca 0.17 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.22 1npp n GLY 21 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1npp n LYS 22 N -2.06 0.53 -0.17 1.61 4.76 -0.32 -4.90 118.16 117.60 1npp n LYS 22 Ca 0.00 -1.46 -0.02 0.00 -2.87 0.00 0.00 58.31 53.96 1npp n LYS 22 Cb 0.00 -0.83 0.07 0.00 -1.84 0.00 0.00 35.03 32.44 1npp n LYS 22 CO 0.00 0.00 0.00 0.93 -1.37 0.00 0.00 177.40 176.96 1npp h GLU 23 N 0.00 0.30 -0.71 1.97 3.07 -1.90 0.21 114.58 117.52 1npp h GLU 23 Ca 0.00 -0.02 -0.06 0.00 -0.50 0.00 0.00 59.36 58.78 1npp h GLU 23 Cb 1.20 -0.07 -0.03 0.00 -0.84 0.00 0.00 28.75 29.02 1npp h GLU 23 CO 0.00 0.20 0.21 -0.97 -1.40 0.00 0.00 179.01 177.05 1npp h ASN 24 N 0.31 1.05 -0.02 1.42 -0.73 -1.95 -1.28 115.58 114.37 1npp h ASN 24 Ca 0.26 -0.21 -0.07 0.00 1.87 0.00 0.00 56.30 58.14 1npp h ASN 24 Cb 0.31 -0.27 -0.01 0.00 0.27 0.00 0.00 38.32 38.62 1npp h ASN 24 CO -0.29 0.98 -0.17 -0.33 -0.37 0.00 0.00 177.43 177.25 1npp h GLU 25 N 1.06 0.36 -0.32 6.67 3.07 -1.80 0.05 114.58 123.66 1npp h GLU 25 Ca 0.23 -0.10 -0.04 0.00 -0.50 0.00 0.00 59.36 58.94 1npp h GLU 25 Cb 0.32 -0.04 -0.01 0.00 -0.84 0.00 0.00 28.75 28.18 1npp h GLU 25 CO -0.01 0.52 0.03 0.00 -1.40 0.00 0.00 179.01 178.16 1npp h ALA 26 N 1.50 0.43 -0.55 3.43 0.00 -0.09 -0.69 119.26 123.29 1npp h ALA 26 Ca 0.06 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 1npp h ALA 26 Cb 0.49 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 1npp h ALA 26 CO 0.03 0.15 0.32 -0.22 0.00 0.00 0.00 179.25 179.53 1npp h LYS 27 N 0.36 0.75 -0.70 0.00 3.64 -0.73 -0.04 116.57 119.85 1npp h LYS 27 Ca 0.10 -0.07 -0.07 0.00 -1.27 0.00 0.00 60.65 59.33 1npp h LYS 27 Cb 0.39 -0.15 -0.03 0.00 -0.41 0.00 0.00 32.23 32.03 1npp h LYS 27 CO 0.01 0.55 0.15 0.93 -2.27 0.00 0.00 179.45 178.82 1npp h GLU 28 N 0.74 1.13 -0.57 1.90 4.39 -0.86 -1.84 114.58 119.47 1npp h GLU 28 Ca 0.20 -0.28 -0.09 0.00 0.34 0.00 0.00 59.36 59.52 1npp h GLU 28 Cb 0.00 -0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 28.49 1npp h GLU 28 CO -0.04 1.01 -0.02 -0.91 -1.16 0.00 0.00 179.01 177.89 1npp h ASN 29 N 1.07 0.97 -0.38 1.42 2.35 -0.93 -2.67 115.58 117.41 1npp h ASN 29 Ca 0.22 -0.28 -0.01 0.00 -0.55 0.00 0.00 56.30 55.68 1npp h ASN 29 Cb 0.40 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.49 1npp h ASN 29 CO 0.01 1.04 0.21 0.25 -1.65 0.00 0.00 177.43 177.28 1npp h LEU 30 N 0.91 0.48 -1.09 1.61 5.85 -0.62 -0.17 115.31 122.28 1npp h LEU 30 Ca 0.16 -0.09 0.02 0.00 0.84 0.00 0.00 57.88 58.81 1npp h LEU 30 Cb 0.56 -0.12 -0.05 0.00 0.37 0.00 0.00 40.66 41.42 1npp h LEU 30 CO 0.03 0.43 0.62 -0.07 -0.34 0.00 0.00 178.44 179.11 1npp h LEU 31 N 0.49 1.05 -0.15 2.25 3.38 -1.26 0.67 115.31 121.73 1npp h LEU 31 Ca 0.13 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.05 1npp h LEU 31 Cb 0.06 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.55 1npp h LEU 31 CO -0.02 0.75 -0.02 0.50 0.09 0.00 0.00 178.44 179.74 1npp h LYS 32 N 1.23 0.28 -0.94 1.13 1.63 -1.11 -2.47 116.57 116.32 1npp h LYS 32 Ca 0.35 -0.10 0.06 0.00 -0.85 0.00 0.00 60.65 60.11 1npp h LYS 32 Cb -0.10 -0.02 -0.06 0.00 -0.60 0.00 0.00 32.23 31.45 1npp h LYS 32 CO -0.09 0.54 0.60 0.28 -3.45 0.00 0.00 179.45 177.33 1npp h VAL 33 N 0.00 1.08 -0.80 2.00 2.07 -0.62 0.07 116.25 120.05 1npp h VAL 33 Ca 0.04 -0.38 -0.02 0.00 0.82 0.00 0.00 66.70 67.16 1npp h VAL 33 Cb 0.42 -0.12 -0.04 0.00 -1.52 0.00 0.00 31.29 30.03 1npp h VAL 33 CO 0.01 0.20 0.44 -0.07 0.02 0.00 0.00 177.57 178.17 1npp h LEU 34 N 1.11 0.99 -0.16 2.57 3.38 -0.74 0.21 115.31 122.67 1npp h LEU 34 Ca 0.40 -0.08 -0.07 0.00 0.09 0.00 0.00 57.88 58.23 1npp h LEU 34 Cb 0.14 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.64 1npp h LEU 34 CO -0.16 0.80 -0.16 -0.08 0.09 0.00 0.00 178.44 178.92 1npp h GLU 35 N 1.12 0.39 -0.54 1.13 4.81 -0.86 0.72 114.58 121.34 1npp h GLU 35 Ca 0.28 -0.21 0.04 0.00 -0.13 0.00 0.00 59.36 59.35 1npp h GLU 35 Cb 0.02 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.37 1npp h GLU 35 CO -0.05 0.77 0.29 -0.07 -0.73 0.00 0.00 179.01 179.22 1npp h LEU 36 N 0.03 0.44 -0.09 1.64 3.38 -0.58 -2.56 115.31 117.56 1npp h LEU 36 Ca 0.02 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1npp h LEU 36 Cb 0.70 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.38 1npp h LEU 36 CO 0.04 0.30 -0.02 -0.62 0.09 0.00 0.00 178.44 178.23 1npp n GLU 37 N -4.84 0.79 -1.83 1.13 -0.58 0.68 -4.90 120.64 111.09 1npp n GLU 37 Ca 0.05 -0.09 -0.06 0.00 -0.42 0.00 0.00 57.16 56.64 1npp n GLU 37 Cb 0.13 -1.50 -0.01 0.00 -0.57 0.00 0.00 31.44 29.49 1npp n GLU 37 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1npp n GLY 38 N 1.15 0.34 0.70 0.62 0.00 -0.88 -4.95 105.19 102.18 1npp n GLY 38 Ca 0.19 -0.69 0.07 0.00 0.00 0.00 0.00 46.02 45.59 1npp n GLY 38 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1npp n LEU 39 N -0.79 2.73 -0.34 0.99 4.77 0.19 -4.68 117.00 119.88 1npp n LEU 39 Ca -0.07 -1.54 0.16 0.00 -0.03 0.00 0.00 56.01 54.53 1npp n LEU 39 Cb 0.44 -0.16 0.38 0.00 -2.33 0.00 0.00 43.42 41.75 1npp n LEU 39 CO 0.08 0.62 1.19 0.11 -1.33 0.00 0.00 177.39 178.06 1npp h LYS 40 N 2.68 0.62 0.00 3.23 1.57 -1.90 -0.35 116.57 122.43 1npp h LYS 40 Ca 0.00 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.74 1npp h LYS 40 Cb 0.70 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.87 1npp h LYS 40 CO 0.00 0.41 0.00 0.22 -0.57 0.00 0.00 179.45 179.51 1npp h ASP 41 N 0.64 0.00 0.25 0.86 3.58 -1.93 -1.93 116.42 117.89 1npp h ASP 41 Ca 0.60 0.00 0.00 0.00 0.42 0.00 0.00 57.03 58.05 1npp h ASP 41 Cb 1.10 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.15 1npp h ASP 41 CO -0.40 0.00 -0.20 0.18 -2.88 0.00 0.00 179.24 175.94 1npp n LEU 42 N -2.80 0.91 -3.95 2.28 4.32 -0.14 -4.84 117.00 112.78 1npp n LEU 42 Ca -0.02 -0.21 -0.27 0.00 -0.02 0.00 0.00 56.01 55.49 1npp n LEU 42 Cb 0.11 -0.13 -0.17 0.00 -1.62 0.00 0.00 43.42 41.61 1npp n LEU 42 CO 0.18 0.17 -0.45 -0.69 -1.22 0.00 0.00 177.39 175.38 1npp s VAL 43 N -2.46 1.17 -0.09 4.08 1.01 -0.73 -0.77 120.40 122.62 1npp s VAL 43 Ca 0.27 -0.39 0.15 0.00 0.00 0.00 0.00 61.98 62.00 1npp s VAL 43 Cb 0.20 -1.15 -0.23 0.00 0.00 0.00 0.00 36.38 35.20 1npp s VAL 43 CO 0.49 0.39 0.52 0.47 0.00 0.00 0.00 175.10 176.97 1npp n ASP 44 N 4.77 0.63 -3.74 3.32 8.00 0.64 -4.96 116.55 125.20 1npp n ASP 44 Ca -0.15 0.30 -0.14 0.00 0.71 0.00 0.00 54.79 55.51 1npp n ASP 44 Cb 0.50 0.27 -0.08 0.00 -0.02 0.00 0.00 41.12 41.79 1npp n ASP 44 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1npp s GLU 45 N -2.61 0.69 -0.16 -1.24 2.02 -1.21 -4.97 118.70 111.22 1npp s GLU 45 Ca -0.06 -0.14 -0.04 0.00 0.02 0.00 0.00 54.97 54.75 1npp s GLU 45 Cb 0.08 0.31 0.07 0.00 0.10 0.00 0.00 34.13 34.68 1npp s GLU 45 CO 0.83 -0.19 0.14 0.08 0.02 0.00 0.00 175.26 176.13 1npp s VAL 46 N -1.27 -0.19 0.05 2.63 1.01 -1.26 -1.03 120.40 120.34 1npp s VAL 46 Ca -0.13 -0.02 0.08 0.00 0.00 0.00 0.00 61.98 61.90 1npp s VAL 46 Cb -0.05 -0.53 -0.03 0.00 0.00 0.00 0.00 36.38 35.78 1npp s VAL 46 CO 0.05 -0.16 -0.21 -0.63 0.00 0.00 0.00 175.10 174.14 1npp s ILE 47 N 2.22 1.72 -0.26 2.22 1.01 0.64 -4.98 121.20 123.78 1npp s ILE 47 Ca 0.04 -1.25 -0.09 0.00 0.00 0.00 0.00 60.65 59.35 1npp s ILE 47 Cb -0.15 -1.50 -0.04 0.00 0.01 0.00 0.00 42.46 40.78 1npp s ILE 47 CO -0.09 0.20 0.12 -0.69 0.00 0.00 0.00 174.94 174.48 1npp s VAL 48 N -0.83 4.71 -1.15 2.92 1.01 -1.26 0.44 120.40 126.24 1npp s VAL 48 Ca 0.08 -0.03 -0.15 0.00 0.00 0.00 0.00 61.98 61.87 1npp s VAL 48 Cb -0.09 -3.22 -0.06 0.00 0.00 0.00 0.00 36.38 33.01 1npp s VAL 48 CO 0.02 0.30 2.19 -0.81 0.00 0.00 0.00 175.10 176.81 1npp n PRO 49 N 4.97 2.36 -3.85 2.72 -0.04 -1.26 -4.81 135.00 135.09 1npp n PRO 49 Ca -0.15 -2.12 -0.11 0.00 -0.04 0.00 0.00 63.50 61.08 1npp n PRO 49 Cb 0.52 -2.98 -0.09 0.00 -0.04 0.00 0.00 33.50 30.91 1npp n PRO 49 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1npp s ALA 50 N 3.76 -0.38 0.17 0.55 0.00 -1.26 -4.55 121.76 120.04 1npp s ALA 50 Ca 0.53 -0.16 -0.21 0.00 0.00 0.00 0.00 51.96 52.11 1npp s ALA 50 Cb 0.14 0.18 -0.08 0.00 0.00 0.00 0.00 23.12 23.37 1npp s ALA 50 CO -0.00 -0.28 0.70 -2.00 0.00 0.00 0.00 175.76 174.17 1npp s GLU 51 N -1.94 4.33 -0.16 0.00 2.12 -1.23 -4.82 118.70 116.99 1npp s GLU 51 Ca -0.10 0.91 -0.28 0.00 0.36 0.00 0.00 54.97 55.86 1npp s GLU 51 Cb -0.04 -3.08 -0.01 0.00 0.26 0.00 0.00 34.13 31.26 1npp s GLU 51 CO -0.01 0.51 0.94 -1.21 -0.54 0.00 0.00 175.26 174.96 1npp s GLU 52 N -1.52 4.33 0.25 4.30 2.02 -1.26 -0.75 118.70 126.07 1npp s GLU 52 Ca 0.37 1.23 0.09 0.00 0.02 0.00 0.00 54.97 56.68 1npp s GLU 52 Cb -0.19 -3.58 -0.05 0.00 0.10 0.00 0.00 34.13 30.41 1npp s GLU 52 CO 0.22 -0.39 -0.14 0.15 0.02 0.00 0.00 175.26 175.12 1npp s LYS 53 N 2.33 1.50 -0.23 1.61 1.02 0.59 -1.42 119.74 125.14 1npp s LYS 53 Ca 0.43 -1.69 -0.05 0.00 0.02 0.00 0.00 55.97 54.68 1npp s LYS 53 Cb -0.17 -1.35 -0.02 0.00 -0.52 0.00 0.00 37.83 35.77 1npp s LYS 53 CO 0.13 0.20 -0.01 0.08 -0.92 0.00 0.00 175.35 174.84 1npp s VAL 54 N -2.82 3.71 -0.21 3.17 1.01 0.23 -0.96 120.40 124.53 1npp s VAL 54 Ca 0.26 -0.38 -0.08 0.00 0.00 0.00 0.00 61.98 61.78 1npp s VAL 54 Cb -0.01 -2.70 -0.04 0.00 0.00 0.00 0.00 36.38 33.63 1npp s VAL 54 CO 0.11 0.40 0.09 -0.69 0.00 0.00 0.00 175.10 175.00 1npp s VAL 55 N 1.47 4.80 -0.12 2.92 1.01 0.82 -0.85 120.40 130.45 1npp s VAL 55 Ca 0.06 -0.02 0.01 0.00 0.00 0.00 0.00 61.98 62.02 1npp s VAL 55 Cb -0.15 -3.20 -0.01 0.00 0.00 0.00 0.00 36.38 33.02 1npp s VAL 55 CO -0.01 0.40 -0.15 -0.63 0.00 0.00 0.00 175.10 174.72 1npp s ILE 56 N 0.83 2.89 0.02 2.22 1.01 -0.38 -0.45 121.20 127.35 1npp s ILE 56 Ca 0.05 -0.72 0.06 0.00 0.00 0.00 0.00 60.65 60.04 1npp s ILE 56 Cb -0.13 -2.20 -0.02 0.00 0.01 0.00 0.00 42.46 40.12 1npp s ILE 56 CO 0.02 0.53 -0.19 0.00 0.00 0.00 0.00 174.94 175.31 1npp s ARG 57 N 0.33 1.38 -0.80 2.79 1.70 0.08 -0.48 118.95 123.95 1npp s ARG 57 Ca -0.12 -0.78 -0.02 0.00 -0.47 0.00 0.00 55.73 54.34 1npp s ARG 57 Cb -0.16 -1.40 0.20 0.00 -0.57 0.00 0.00 34.95 33.02 1npp s ARG 57 CO 0.06 0.37 0.65 0.00 -1.08 0.00 0.00 175.30 175.31 1npp s ALA 58 N -0.63 4.01 0.00 7.88 0.00 -0.86 -1.60 121.76 130.56 1npp s ALA 58 Ca 0.07 -3.64 0.00 0.00 0.00 0.00 0.00 51.96 48.38 1npp s ALA 58 Cb -0.08 -2.76 0.00 0.00 0.00 0.00 0.00 23.12 20.28 1npp s ALA 58 CO 0.01 -2.14 0.00 1.04 0.00 0.00 0.00 175.76 174.67 1npp n GLN 59 N 2.72 0.00 0.00 0.00 3.00 0.23 -3.56 117.38 119.77 1npp n GLN 59 Ca 0.17 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.16 1npp n GLN 59 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.61 1npp n GLN 59 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1npp n GLY 60 N 0.00 3.87 3.82 1.08 0.00 -1.26 -4.98 105.19 107.72 1npp n GLY 60 Ca 0.00 -0.92 -0.08 0.00 0.00 0.00 0.00 46.02 45.03 1npp n GLY 60 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1npp s LYS 61 N 0.00 2.01 0.01 1.61 -2.85 -1.23 -5.14 119.74 114.14 1npp s LYS 61 Ca 0.00 -1.25 -0.21 0.00 -1.00 0.00 0.00 55.97 53.51 1npp s LYS 61 Cb 0.00 0.59 -0.06 0.00 -2.06 0.00 0.00 37.83 36.30 1npp s LYS 61 CO 0.00 -0.94 0.61 -2.00 0.10 0.00 0.00 175.35 173.12 1npp s GLU 62 N -2.66 4.32 -0.11 1.78 2.12 -1.26 -2.03 118.70 120.86 1npp s GLU 62 Ca 0.15 0.76 0.07 0.00 0.36 0.00 0.00 54.97 56.31 1npp s GLU 62 Cb -0.05 -3.33 -0.11 0.00 0.26 0.00 0.00 34.13 30.90 1npp s GLU 62 CO 0.09 0.40 -0.00 1.63 -0.54 0.00 0.00 175.26 176.84 1npp n LYS 63 N 2.59 1.87 -3.81 4.30 4.76 0.37 -4.92 118.16 123.33 1npp n LYS 63 Ca -0.07 0.01 -0.12 0.00 -2.87 0.00 0.00 58.31 55.26 1npp n LYS 63 Cb 0.51 -1.26 -0.10 0.00 -1.84 0.00 0.00 35.03 32.35 1npp n LYS 63 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 1npp s TYR 64 N -2.24 -0.12 -0.31 2.13 2.02 -1.12 -5.00 117.35 112.71 1npp s TYR 64 Ca -0.08 0.22 -0.02 0.00 -0.37 0.00 0.00 57.07 56.82 1npp s TYR 64 Cb 0.03 0.05 0.10 0.00 -0.40 0.00 0.00 41.96 41.74 1npp s TYR 64 CO 0.38 -0.30 0.11 0.50 -1.57 0.00 0.00 175.55 174.67 1npp s ARG 65 N -1.02 0.59 0.15 -0.62 3.52 -1.25 -1.25 118.95 119.06 1npp s ARG 65 Ca -0.11 -0.96 0.11 0.00 -0.13 0.00 0.00 55.73 54.63 1npp s ARG 65 Cb -0.05 -1.77 -0.04 0.00 -1.56 0.00 0.00 34.95 31.53 1npp s ARG 65 CO 0.02 -1.01 -0.24 -0.51 -0.81 0.00 0.00 175.30 172.76 1npp s LEU 66 N 1.69 2.45 0.29 -0.88 1.43 -0.03 -4.91 118.68 118.73 1npp s LEU 66 Ca 0.10 -0.75 -0.30 0.00 -1.03 0.00 0.00 54.13 52.15 1npp s LEU 66 Cb -0.17 -1.28 -0.10 0.00 0.03 0.00 0.00 46.19 44.67 1npp s LEU 66 CO -0.27 0.16 1.45 -0.44 0.23 0.00 0.00 176.35 177.47 1npp s SER 67 N -2.32 6.59 0.04 2.29 0.01 -1.26 0.76 113.70 119.80 1npp s SER 67 Ca 0.17 2.76 -0.20 0.00 1.31 0.00 0.00 55.95 60.00 1npp s SER 67 Cb -0.09 -2.64 -0.15 0.00 0.21 0.00 0.00 66.02 63.35 1npp s SER 67 CO 0.08 -0.73 1.29 0.25 0.41 0.00 0.00 173.24 174.55 1npp h LEU 68 N 4.44 0.45 -9.94 2.44 5.85 -1.55 -3.44 115.31 113.57 1npp h LEU 68 Ca -0.47 -0.55 -0.47 0.00 0.84 0.00 0.00 57.88 57.24 1npp h LEU 68 Cb 1.22 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 42.11 1npp h LEU 68 CO 0.74 0.91 0.36 -0.54 -0.34 0.00 0.00 178.44 179.57 1npp s LYS 69 N -4.05 4.42 0.00 1.25 1.02 -1.26 -4.27 119.74 116.85 1npp s LYS 69 Ca -0.14 1.32 0.00 0.00 0.02 0.00 0.00 55.97 57.18 1npp s LYS 69 Cb 0.05 -2.61 0.00 0.00 -0.52 0.00 0.00 37.83 34.75 1npp s LYS 69 CO 0.78 0.12 0.00 0.41 -0.92 0.00 0.00 175.35 175.74 1npp n GLY 70 N 0.26 0.67 3.65 -3.33 0.00 -1.26 -5.04 105.19 100.13 1npp n GLY 70 Ca 0.04 -1.63 -0.30 0.00 0.00 0.00 0.00 46.02 44.13 1npp n GLY 70 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1npp s ASN 71 N 0.00 2.77 0.15 1.61 0.01 -1.26 -4.57 114.94 113.65 1npp s ASN 71 Ca 0.00 1.73 -0.31 0.00 -0.71 0.00 0.00 52.86 53.57 1npp s ASN 71 Cb 0.00 -2.35 -0.10 0.00 0.41 0.00 0.00 41.25 39.20 1npp s ASN 71 CO 0.00 -3.12 1.66 0.00 -1.51 0.00 0.00 177.10 174.13 1npp s ALA 72 N -2.73 3.80 -0.01 0.60 0.00 -1.26 -4.77 121.76 117.39 1npp s ALA 72 Ca 0.65 1.41 0.02 0.00 0.00 0.00 0.00 51.96 54.05 1npp s ALA 72 Cb -0.21 -3.67 -0.00 0.00 0.00 0.00 0.00 23.12 19.23 1npp s ALA 72 CO 0.59 -0.94 -0.07 1.03 0.00 0.00 0.00 175.76 176.37 1npp s ARG 73 N 1.64 0.64 -0.13 0.00 3.00 -0.20 -5.00 118.95 118.90 1npp s ARG 73 Ca 0.73 -0.26 -0.02 0.00 0.00 0.00 0.00 55.73 56.18 1npp s ARG 73 Cb -0.45 -0.62 -0.03 0.00 0.00 0.00 0.00 34.95 33.85 1npp s ARG 73 CO 0.32 0.14 -0.04 -0.51 0.00 0.00 0.00 175.30 175.21 1npp s ASP 74 N -0.08 4.79 -0.10 0.23 1.11 -1.26 -1.08 116.67 120.28 1npp s ASP 74 Ca 0.01 -0.08 0.01 0.00 0.18 0.00 0.00 52.55 52.68 1npp s ASP 74 Cb -0.04 -1.61 0.02 0.00 1.07 0.00 0.00 42.92 42.36 1npp s ASP 74 CO -0.00 0.24 -0.13 -0.63 1.18 0.00 0.00 175.17 175.83 1npp s ILE 75 N -0.04 1.30 -0.16 0.77 -1.09 0.28 -4.96 121.20 117.31 1npp s ILE 75 Ca 0.01 -0.52 -0.05 0.00 -2.23 0.00 0.00 60.65 57.86 1npp s ILE 75 Cb -0.13 -1.22 -0.03 0.00 -1.58 0.00 0.00 42.46 39.49 1npp s ILE 75 CO 0.03 0.40 0.01 -0.44 -1.23 0.00 0.00 174.94 173.72 1npp s SER 76 N 1.12 5.25 0.02 3.58 0.01 -1.26 -0.06 113.70 122.35 1npp s SER 76 Ca -0.05 -0.00 0.06 0.00 1.31 0.00 0.00 55.95 57.26 1npp s SER 76 Cb -0.14 -1.86 -0.02 0.00 0.21 0.00 0.00 66.02 64.21 1npp s SER 76 CO -0.03 0.19 -0.17 0.68 0.41 0.00 0.00 173.24 174.32 1npp s VAL 77 N 0.27 1.36 -0.20 3.43 -7.23 -0.34 -4.96 120.40 112.73 1npp s VAL 77 Ca 0.00 -0.95 -0.24 0.00 -1.81 0.00 0.00 61.98 58.98 1npp s VAL 77 Cb -0.13 -1.18 -0.01 0.00 0.56 0.00 0.00 36.38 35.62 1npp s VAL 77 CO 0.01 0.21 0.80 -0.22 -0.31 0.00 0.00 175.10 175.59 1npp s LEU 78 N -0.86 4.13 0.00 1.32 2.96 -1.26 -1.58 118.68 123.39 1npp s LEU 78 Ca 0.05 1.06 0.00 0.00 -0.22 0.00 0.00 54.13 55.03 1npp s LEU 78 Cb -0.08 -3.16 0.00 0.00 0.50 0.00 0.00 46.19 43.45 1npp s LEU 78 CO 0.01 -0.43 0.00 0.61 -1.32 0.00 0.00 176.35 175.22 1npp n GLY 79 N 3.64 2.75 0.25 7.98 0.00 0.16 -4.85 105.19 115.12 1npp n GLY 79 Ca 0.04 -1.93 -0.09 0.00 0.00 0.00 0.00 46.02 44.04 1npp n GLY 79 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1npp h LYS 80 N 0.00 0.77 0.00 1.61 3.64 -1.65 -3.36 116.57 117.57 1npp h LYS 80 Ca 0.00 -0.37 -0.02 0.00 -1.27 0.00 0.00 60.65 58.99 1npp h LYS 80 Cb 0.00 -0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 31.81 1npp h LYS 80 CO 0.00 0.99 -1.39 1.63 -2.27 0.00 0.00 179.45 178.40 1npp n LYS 81 N -4.07 0.62 0.00 1.90 5.02 -1.26 -5.09 118.16 115.29 1npp n LYS 81 Ca -0.01 -0.06 0.00 0.00 -2.02 0.00 0.00 58.31 56.21 1npp n LYS 81 Cb 0.50 -1.19 0.00 0.00 -0.02 0.00 0.00 35.03 34.31 1npp n LYS 81 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1npp n GLY 82 N 2.11 -0.94 3.73 0.72 0.00 -1.26 -5.06 105.19 104.50 1npp n GLY 82 Ca -0.03 -0.10 -0.35 0.00 0.00 0.00 0.00 46.02 45.54 1npp n GLY 82 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1npp s VAL 83 N -4.00 4.56 -0.13 1.61 1.01 -1.26 0.40 120.40 122.59 1npp s VAL 83 Ca 0.00 -0.22 0.02 0.00 0.00 0.00 0.00 61.98 61.78 1npp s VAL 83 Cb 0.00 -2.97 0.01 0.00 0.00 0.00 0.00 36.38 33.43 1npp s VAL 83 CO 0.00 0.55 -0.20 -0.89 0.00 0.00 0.00 175.10 174.57 1npp s THR 84 N -0.97 1.89 -0.18 3.92 2.01 -0.61 -3.65 115.64 118.04 1npp s THR 84 Ca 0.15 -0.87 -0.02 0.00 0.31 0.00 0.00 61.69 61.26 1npp s THR 84 Cb -0.12 -1.68 -0.01 0.00 0.01 0.00 0.00 72.50 70.70 1npp s THR 84 CO 0.05 0.52 -0.08 0.42 -0.69 0.00 0.00 174.62 174.84 1npp s THR 85 N 0.92 3.26 0.16 -0.82 -4.23 0.73 -1.20 115.64 114.47 1npp s THR 85 Ca -0.06 -0.55 0.04 0.00 -1.18 0.00 0.00 61.69 59.94 1npp s THR 85 Cb -0.15 -2.44 -0.04 0.00 1.34 0.00 0.00 72.50 71.21 1npp s THR 85 CO -0.03 0.47 0.20 -0.36 -0.54 0.00 0.00 174.62 174.36 1npp s PHE 86 N 1.00 3.28 -0.07 3.99 0.40 0.91 -1.36 117.98 126.13 1npp s PHE 86 Ca -0.00 0.03 0.02 0.00 -0.60 0.00 0.00 56.93 56.38 1npp s PHE 86 Cb -0.15 -1.57 0.01 0.00 0.51 0.00 0.00 43.02 41.83 1npp s PHE 86 CO -0.00 0.52 -0.14 0.50 0.70 0.00 0.00 175.22 176.79 1npp s ARG 87 N -3.21 1.92 -0.19 0.44 3.52 0.26 -0.56 118.95 121.13 1npp s ARG 87 Ca 0.32 -0.49 -0.02 0.00 -0.13 0.00 0.00 55.73 55.41 1npp s ARG 87 Cb -0.10 -1.56 -0.01 0.00 -1.56 0.00 0.00 34.95 31.72 1npp s ARG 87 CO 0.25 0.04 -0.08 0.42 -0.81 0.00 0.00 175.30 175.12 1npp s ILE 88 N 0.64 3.11 -0.19 4.11 1.01 -0.24 -1.56 121.20 128.08 1npp s ILE 88 Ca -0.15 -0.59 -0.28 0.00 0.00 0.00 0.00 60.65 59.63 1npp s ILE 88 Cb -0.16 -2.38 0.11 0.00 0.01 0.00 0.00 42.46 40.04 1npp s ILE 88 CO 0.04 0.46 0.92 -1.83 0.00 0.00 0.00 174.94 174.53 1npp s GLU 89 N 1.21 0.68 -1.38 2.79 -1.05 -0.77 -1.03 118.70 119.15 1npp s GLU 89 Ca 0.02 0.39 -0.08 0.00 -0.15 0.00 0.00 54.97 55.16 1npp s GLU 89 Cb -0.14 0.33 0.05 0.00 -0.44 0.00 0.00 34.13 33.92 1npp s GLU 89 CO -0.03 -0.17 0.53 0.09 0.95 0.00 0.00 175.26 176.64 1npp n ASN 90 N 1.41 -4.57 0.00 0.83 3.02 -1.26 -1.73 115.26 112.96 1npp n ASN 90 Ca -0.13 -0.35 0.00 0.00 -0.03 0.00 0.00 54.58 54.07 1npp n ASN 90 Cb 0.57 -3.74 0.00 0.00 -0.61 0.00 0.00 39.78 36.00 1npp n ASN 90 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1npp n GLY 91 N -1.30 0.53 3.42 7.41 0.00 -1.26 -5.01 105.19 108.98 1npp n GLY 91 Ca -0.05 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.76 1npp n GLY 91 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1npp s GLU 92 N -0.43 1.56 -0.01 1.61 -1.05 -0.71 -4.61 118.70 115.07 1npp s GLU 92 Ca 0.00 -1.83 0.07 0.00 -0.15 0.00 0.00 54.97 53.06 1npp s GLU 92 Cb 0.00 -0.94 -0.02 0.00 -0.44 0.00 0.00 34.13 32.74 1npp s GLU 92 CO 0.00 -0.09 -0.22 0.08 0.95 0.00 0.00 175.26 175.98 1npp s VAL 93 N -3.21 1.78 0.15 1.83 1.01 0.09 -1.84 120.40 120.20 1npp s VAL 93 Ca 0.32 -1.00 -0.07 0.00 0.00 0.00 0.00 61.98 61.24 1npp s VAL 93 Cb 0.07 -1.48 -0.02 0.00 0.00 0.00 0.00 36.38 34.95 1npp s VAL 93 CO 0.13 0.47 0.22 -1.59 0.00 0.00 0.00 175.10 174.33 1npp s LYS 94 N -0.61 1.06 -0.23 2.72 -2.85 -0.60 -1.23 119.74 117.98 1npp s LYS 94 Ca 0.09 -1.21 -0.13 0.00 -1.00 0.00 0.00 55.97 53.71 1npp s LYS 94 Cb -0.09 0.34 -0.04 0.00 -2.06 0.00 0.00 37.83 35.98 1npp s LYS 94 CO -0.01 -0.36 0.29 0.08 0.10 0.00 0.00 175.35 175.45 1npp s VAL 95 N -3.97 5.26 -0.10 1.79 1.01 -1.26 -0.58 120.40 122.55 1npp s VAL 95 Ca 0.17 0.45 0.16 0.00 0.00 0.00 0.00 61.98 62.75 1npp s VAL 95 Cb 0.04 -3.62 -0.20 0.00 0.00 0.00 0.00 36.38 32.60 1npp s VAL 95 CO -0.01 0.27 0.60 1.33 0.00 0.00 0.00 175.10 177.29 1npp n VAL 96 N 4.50 1.33 -3.59 2.92 0.24 -0.46 -4.60 118.33 118.66 1npp n VAL 96 Ca -0.11 -0.75 -0.14 0.00 -2.04 0.00 0.00 64.34 61.29 1npp n VAL 96 Cb 0.51 -0.77 -0.06 0.00 -1.47 0.00 0.00 33.84 32.05 1npp n VAL 96 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 1npp s GLU 97 N -2.75 0.83 0.04 7.34 2.12 -1.17 -5.00 118.70 120.12 1npp s GLU 97 Ca -0.05 0.62 -0.01 0.00 0.36 0.00 0.00 54.97 55.89 1npp s GLU 97 Cb 0.08 0.40 0.00 0.00 0.26 0.00 0.00 34.13 34.87 1npp s GLU 97 CO 0.83 -0.17 0.07 0.45 -0.54 0.00 0.00 175.26 175.89 1npp n SER 98 N 1.86 -0.19 -4.85 -1.70 2.88 -1.26 -0.19 113.62 110.17 1npp n SER 98 Ca -0.15 -1.21 -0.29 0.00 -1.33 0.00 0.00 58.87 55.89 1npp n SER 98 Cb 0.56 0.34 0.10 0.00 -0.75 0.00 0.00 64.21 64.46 1npp n SER 98 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 1npp s VAL 99 N -2.61 2.23 0.33 2.46 -7.23 -1.24 -4.92 120.40 109.41 1npp s VAL 99 Ca 0.03 0.07 -0.29 0.00 -1.81 0.00 0.00 61.98 59.98 1npp s VAL 99 Cb -0.00 -2.96 -0.11 0.00 0.56 0.00 0.00 36.38 33.87 1npp s VAL 99 CO 0.02 -0.10 1.50 -0.70 -0.31 0.00 0.00 175.10 175.52 1npp s GLU 100 N -5.42 4.15 0.00 4.82 2.12 -1.26 -1.90 118.70 121.22 1npp s GLU 100 Ca 0.62 2.52 0.00 0.00 0.36 0.00 0.00 54.97 58.47 1npp s GLU 100 Cb -0.13 -3.01 0.00 0.00 0.26 0.00 0.00 34.13 31.25 1npp s GLU 100 CO 0.51 -0.53 0.00 0.41 -0.54 0.00 0.00 175.26 175.12 1npp n GLY 101 N 1.28 3.36 3.48 -1.50 0.00 -1.26 -4.95 105.19 105.61 1npp n GLY 101 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 1npp n GLY 101 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1npp s ASP 102 N -1.03 6.19 0.00 1.61 1.01 -0.80 -4.76 116.67 118.90 1npp s ASP 102 Ca 0.00 -0.89 0.26 0.00 0.71 0.00 0.00 52.55 52.63 1npp s ASP 102 Cb 0.00 -2.46 1.30 0.00 1.01 0.00 0.00 42.92 42.77 1npp s ASP 102 CO 0.00 -1.54 1.87 0.35 0.21 0.00 0.00 175.17 176.06 1npp n THR 103 N 6.05 0.04 0.22 -1.27 -2.24 -1.26 -3.77 114.28 112.05 1npp n THR 103 Ca -0.00 -0.13 0.12 0.00 -2.27 0.00 0.00 64.05 61.77 1npp n THR 103 Cb 0.47 -0.02 0.64 0.00 -2.10 0.00 0.00 70.33 69.31 1npp n THR 103 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1npp h VAL 105 N 0.00 0.00 0.00 0.00 -1.51 -1.81 -2.27 116.25 110.65 1npp h VAL 105 Ca 0.00 -0.31 0.00 0.00 -1.23 0.00 0.00 66.70 65.16 1npp h VAL 105 Cb 0.33 1.16 0.00 0.00 -2.13 0.00 0.00 31.29 30.64 1npp h VAL 105 CO 0.00 0.00 -1.25 0.59 -1.23 0.00 0.00 177.57 175.68 1npp n ASN 106 N -2.67 0.58 -4.60 4.19 3.02 0.56 -4.67 115.26 111.67 1npp n ASN 106 Ca 0.01 0.11 -0.44 0.00 -0.03 0.00 0.00 54.58 54.22 1npp n ASN 106 Cb 0.23 0.91 -0.01 0.00 -0.61 0.00 0.00 39.78 40.30 1npp n ASN 106 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1npp n ALA 107 N -2.10 -0.02 -1.70 5.41 0.00 -0.86 -4.90 120.51 116.34 1npp n ALA 107 Ca -0.00 0.39 -0.35 0.00 0.00 0.00 0.00 53.44 53.47 1npp n ALA 107 Cb 0.52 -2.05 0.04 0.00 0.00 0.00 0.00 19.45 17.96 1npp n ALA 107 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1npp s PRO 108 N -1.60 2.93 0.48 0.00 0.02 -1.26 -4.77 135.00 130.80 1npp s PRO 108 Ca 0.58 1.76 -0.24 0.00 0.02 0.00 0.00 61.00 63.12 1npp s PRO 108 Cb -0.68 -1.93 -0.07 0.00 0.02 0.00 0.00 34.50 31.83 1npp s PRO 108 CO 0.60 -1.22 1.41 -2.14 -0.33 0.00 0.00 177.00 175.33 1npp s PRO 109 N -3.43 3.52 0.13 5.54 0.02 -1.26 -4.96 135.00 134.56 1npp s PRO 109 Ca 0.76 2.38 0.07 0.00 0.02 0.00 0.00 61.00 64.22 1npp s PRO 109 Cb -0.29 -2.54 -0.04 0.00 0.02 0.00 0.00 34.50 31.65 1npp s PRO 109 CO 0.34 -0.93 -0.05 0.96 -0.33 0.00 0.00 177.00 176.99 1npp s ILE 110 N -1.23 3.61 0.00 2.83 -4.36 -0.37 -4.86 121.20 116.83 1npp s ILE 110 Ca 0.64 -1.28 0.00 0.00 -0.26 0.00 0.00 60.65 59.75 1npp s ILE 110 Cb -0.43 -2.74 0.00 0.00 1.25 0.00 0.00 42.46 40.54 1npp s ILE 110 CO 0.54 0.03 0.00 -1.54 0.24 0.00 0.00 174.94 174.21 1npp n SER 111 N 0.38 0.00 -4.42 4.36 3.41 -1.26 -0.74 113.62 115.35 1npp n SER 111 Ca -0.11 -0.87 -0.32 0.00 -0.26 0.00 0.00 58.87 57.30 1npp n SER 111 Cb 0.53 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 64.34 1npp n SER 111 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1npp s LYS 112 N 0.00 2.48 0.14 4.33 1.02 -1.26 -5.01 119.74 121.44 1npp s LYS 112 Ca 0.00 -0.76 -0.33 0.00 0.02 0.00 0.00 55.97 54.91 1npp s LYS 112 Cb 0.00 -2.31 -0.17 0.00 -0.52 0.00 0.00 37.83 34.83 1npp s LYS 112 CO 0.00 0.57 0.84 -2.30 -0.92 0.00 0.00 175.35 173.54 1npp n PRO 113 N 2.46 0.30 0.00 -1.68 -0.02 -1.26 0.08 135.00 134.88 1npp n PRO 113 Ca -0.17 0.11 0.00 0.00 -2.02 0.00 0.00 63.50 61.42 1npp n PRO 113 Cb 0.52 -1.38 0.00 0.00 -0.02 0.00 0.00 33.50 32.62 1npp n PRO 113 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1npp n GLY 114 N 1.81 3.06 3.81 -1.23 0.00 0.43 -4.96 105.19 108.11 1npp n GLY 114 Ca 0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 1npp n GLY 114 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1npp s GLN 115 N -0.31 3.65 0.19 1.61 -0.21 0.11 -4.86 119.66 119.84 1npp s GLN 115 Ca 0.00 1.16 -0.14 0.00 0.02 0.00 0.00 55.36 56.39 1npp s GLN 115 Cb 0.00 -2.08 0.01 0.00 1.00 0.00 0.00 33.01 31.94 1npp s GLN 115 CO 0.00 -0.53 0.45 -1.59 -2.12 0.00 0.00 175.29 171.49 1npp s LYS 116 N -3.86 1.33 -0.06 2.91 -2.85 -1.26 -1.06 119.74 114.89 1npp s LYS 116 Ca 0.63 -1.00 0.02 0.00 -1.00 0.00 0.00 55.97 54.62 1npp s LYS 116 Cb -0.14 0.47 0.02 0.00 -2.06 0.00 0.00 37.83 36.12 1npp s LYS 116 CO 0.31 -0.54 -0.09 0.42 0.10 0.00 0.00 175.35 175.54 1npp s ILE 117 N -3.92 0.92 -0.12 3.79 1.01 0.01 -5.00 121.20 117.89 1npp s ILE 117 Ca 0.13 -0.35 0.03 0.00 0.00 0.00 0.00 60.65 60.45 1npp s ILE 117 Cb 0.00 -0.87 0.01 0.00 0.01 0.00 0.00 42.46 41.61 1npp s ILE 117 CO -0.01 0.31 -0.21 -0.89 0.00 0.00 0.00 174.94 174.14 1npp s THR 118 N 0.76 1.93 -0.61 2.92 2.01 -1.26 -2.21 115.64 119.18 1npp s THR 118 Ca -0.13 -0.91 -0.10 0.00 0.31 0.00 0.00 61.69 60.86 1npp s THR 118 Cb -0.15 -1.71 0.16 0.00 0.01 0.00 0.00 72.50 70.81 1npp s THR 118 CO 0.02 0.53 0.50 0.00 -0.69 0.00 0.00 174.62 174.98 1npp h LYS 120 N 7.97 0.88 -0.13 0.00 1.57 -1.94 0.33 116.57 125.24 1npp h LYS 120 Ca -0.09 -0.08 -0.12 0.00 -1.87 0.00 0.00 60.65 58.49 1npp h LYS 120 Cb 1.04 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 33.17 1npp h LYS 120 CO 0.81 0.64 -0.39 0.93 -0.57 0.00 0.00 179.45 180.87 1npp h GLU 121 N 0.89 0.49 -0.01 3.15 4.39 -1.93 -3.24 114.58 118.33 1npp h GLU 121 Ca 0.23 -0.36 0.00 0.00 0.34 0.00 0.00 59.36 59.57 1npp h GLU 121 Cb 0.00 0.06 0.00 0.00 -0.10 0.00 0.00 28.75 28.71 1npp h GLU 121 CO -0.04 0.98 -0.28 -1.71 -1.16 0.00 0.00 179.01 176.80 1npp n ASN 122 N -4.31 0.93 -3.49 1.42 5.15 -1.18 -4.60 115.26 109.18 1npp n ASN 122 Ca -0.07 -0.79 -0.18 0.00 -0.60 0.00 0.00 54.58 52.94 1npp n ASN 122 Cb 0.53 0.14 0.08 0.00 -0.53 0.00 0.00 39.78 40.00 1npp n ASN 122 CO 0.00 0.00 0.00 0.29 1.40 0.00 0.00 177.26 178.95 1npp n LYS 123 N -0.77 -6.14 -4.43 1.20 4.76 0.11 -1.79 118.16 111.09 1npp n LYS 123 Ca 0.11 0.80 -0.21 0.00 -2.87 0.00 0.00 58.31 56.15 1npp n LYS 123 Cb 0.34 -5.71 -0.11 0.00 -1.84 0.00 0.00 35.03 27.72 1npp n LYS 123 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 1npp s THR 124 N -3.43 1.07 -0.22 -0.18 -4.23 -0.86 -0.61 115.64 107.19 1npp s THR 124 Ca 0.01 -2.00 -0.36 0.00 -1.18 0.00 0.00 61.69 58.16 1npp s THR 124 Cb -0.00 -2.76 0.14 0.00 1.34 0.00 0.00 72.50 71.22 1npp s THR 124 CO 0.75 0.00 1.26 -1.83 -0.54 0.00 0.00 174.62 174.26 1npp s GLU 125 N -3.92 0.23 -0.00 3.99 -1.05 -0.62 -1.17 118.70 116.16 1npp s GLU 125 Ca 0.37 -0.08 0.07 0.00 -0.15 0.00 0.00 54.97 55.17 1npp s GLU 125 Cb 0.09 0.11 -0.02 0.00 -0.44 0.00 0.00 34.13 33.86 1npp s GLU 125 CO 0.15 -0.10 -0.21 0.00 0.95 0.00 0.00 175.26 176.05 1npp s ALA 126 N -2.31 1.79 -0.01 -0.84 0.00 -0.94 -0.74 121.76 118.72 1npp s ALA 126 Ca 0.10 -0.96 0.01 0.00 0.00 0.00 0.00 51.96 51.10 1npp s ALA 126 Cb -0.01 -0.43 0.01 0.00 0.00 0.00 0.00 23.12 22.68 1npp s ALA 126 CO -0.04 0.43 -0.02 0.21 0.00 0.00 0.00 175.76 176.35 1npp s LYS 127 N -0.66 0.22 -0.11 0.00 2.20 0.41 -0.81 119.74 120.99 1npp s LYS 127 Ca 0.08 -0.04 -0.19 0.00 -0.36 0.00 0.00 55.97 55.47 1npp s LYS 127 Cb -0.08 -0.27 -0.04 0.00 -1.51 0.00 0.00 37.83 35.92 1npp s LYS 127 CO -0.00 0.00 0.50 0.42 -0.36 0.00 0.00 175.35 175.91 1npp s ILE 128 N 0.25 5.17 0.08 5.43 -1.09 -0.22 -0.13 121.20 130.69 1npp s ILE 128 Ca -0.02 1.00 -0.04 0.00 -2.23 0.00 0.00 60.65 59.36 1npp s ILE 128 Cb -0.05 -3.84 -0.03 0.00 -1.58 0.00 0.00 42.46 36.97 1npp s ILE 128 CO -0.01 0.32 0.07 0.68 -1.23 0.00 0.00 174.94 174.77 1npp s VAL 129 N 0.61 0.17 -0.20 2.92 -7.23 -0.13 -0.43 120.40 116.12 1npp s VAL 129 Ca 0.27 -1.61 -0.16 0.00 -1.81 0.00 0.00 61.98 58.67 1npp s VAL 129 Cb -0.15 -1.56 -0.04 0.00 0.56 0.00 0.00 36.38 35.19 1npp s VAL 129 CO 0.11 -0.78 0.42 -0.76 -0.31 0.00 0.00 175.10 173.78 1npp s LEU 130 N -2.92 4.16 -0.69 1.32 1.43 -1.26 -0.30 118.68 120.42 1npp s LEU 130 Ca 0.09 0.55 -0.20 0.00 -1.03 0.00 0.00 54.13 53.54 1npp s LEU 130 Cb 0.07 -2.55 0.10 0.00 0.03 0.00 0.00 46.19 43.83 1npp s LEU 130 CO -0.08 -0.09 0.90 -0.62 0.23 0.00 0.00 176.35 176.69 1npp s ASP 131 N 1.04 6.27 -0.87 2.29 -1.08 0.07 -4.95 116.67 119.45 1npp s ASP 131 Ca 0.20 -1.38 -0.08 0.00 -0.52 0.00 0.00 52.55 50.77 1npp s ASP 131 Cb -0.15 -2.37 0.22 0.00 -1.46 0.00 0.00 42.92 39.16 1npp s ASP 131 CO 0.08 -1.24 0.79 0.21 0.52 0.00 0.00 175.17 175.53 1npp s ASN 132 N 3.62 6.44 0.00 -0.34 3.84 -1.26 -3.57 114.94 123.67 1npp s ASN 132 Ca 0.20 -3.15 0.00 0.00 0.21 0.00 0.00 52.86 50.13 1npp s ASN 132 Cb -0.17 -2.08 0.00 0.00 -0.55 0.00 0.00 41.25 38.45 1npp s ASN 132 CO 0.05 -0.39 0.00 0.29 -2.79 0.00 0.00 177.10 174.26 1npp n LYS 133 N 3.24 1.90 -0.09 0.43 5.02 -1.26 -4.51 118.16 122.90 1npp n LYS 133 Ca 0.17 0.00 -0.21 0.00 -2.02 0.00 0.00 58.31 56.24 1npp n LYS 133 Cb 0.41 -0.85 -0.12 0.00 -0.02 0.00 0.00 35.03 34.45 1npp n LYS 133 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 1npp h ILE 134 N 0.00 0.93 -2.16 -0.18 2.04 -1.91 -3.44 117.51 112.80 1npp h ILE 134 Ca 0.00 -2.21 -0.55 0.00 1.00 0.00 0.00 64.86 63.10 1npp h ILE 134 Cb 0.00 2.33 -0.41 0.00 -0.74 0.00 0.00 36.82 38.00 1npp h ILE 134 CO 0.00 0.41 -0.87 0.49 0.00 0.00 0.00 178.15 178.17 1npp n PHE 135 N -4.32 2.33 -1.95 1.37 3.72 -1.26 -5.05 117.46 112.31 1npp n PHE 135 Ca -0.31 -3.92 -0.38 0.00 -0.05 0.00 0.00 57.45 52.80 1npp n PHE 135 Cb 0.72 -0.46 0.02 0.00 -0.94 0.00 0.00 39.48 38.82 1npp n PHE 135 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 176.76 175.46 1npp s PRO 136 N -2.88 3.32 0.00 -1.08 0.04 -1.26 -3.53 135.00 129.61 1npp s PRO 136 Ca 0.44 2.06 0.00 0.00 0.04 0.00 0.00 61.00 63.54 1npp s PRO 136 Cb 0.29 -2.28 0.00 0.00 0.04 0.00 0.00 34.50 32.55 1npp s PRO 136 CO -0.11 -0.99 0.00 0.41 0.04 0.00 0.00 177.00 176.35 1npp n GLY 137 N 0.63 0.60 3.06 0.56 0.00 -1.26 -4.91 105.19 103.86 1npp n GLY 137 Ca 0.10 -0.19 -0.15 0.00 0.00 0.00 0.00 46.02 45.78 1npp n GLY 137 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1npp s TYR 138 N -2.00 0.73 0.05 1.61 2.02 -1.23 -0.11 117.35 118.41 1npp s TYR 138 Ca 0.00 -0.39 0.00 0.00 -0.37 0.00 0.00 57.07 56.31 1npp s TYR 138 Cb 0.00 -0.44 -0.03 0.00 -0.40 0.00 0.00 41.96 41.09 1npp s TYR 138 CO 0.00 -0.04 -0.04 0.96 -1.57 0.00 0.00 175.55 174.85 1npp s ILE 139 N -1.03 0.32 0.05 2.71 -4.36 -0.83 -4.30 121.20 113.76 1npp s ILE 139 Ca -0.05 -1.47 0.07 0.00 -0.26 0.00 0.00 60.65 58.94 1npp s ILE 139 Cb -0.08 -1.05 -0.03 0.00 1.25 0.00 0.00 42.46 42.54 1npp s ILE 139 CO 0.00 -0.74 -0.17 -0.76 0.24 0.00 0.00 174.94 173.52 1npp s LEU 140 N -2.33 2.69 0.02 0.37 1.43 0.17 -0.59 118.68 120.45 1npp s LEU 140 Ca -0.01 -0.41 0.02 0.00 -1.03 0.00 0.00 54.13 52.70 1npp s LEU 140 Cb -0.00 -1.56 -0.02 0.00 0.03 0.00 0.00 46.19 44.64 1npp s LEU 140 CO -0.05 0.25 -0.07 0.27 0.23 0.00 0.00 176.35 176.97 1npp s ILE 141 N -0.97 0.53 -0.27 -0.59 -4.36 -0.74 -0.26 121.20 114.54 1npp s ILE 141 Ca 0.16 -0.76 -0.02 0.00 -0.26 0.00 0.00 60.65 59.76 1npp s ILE 141 Cb -0.11 -0.54 0.03 0.00 1.25 0.00 0.00 42.46 43.09 1npp s ILE 141 CO 0.06 -0.17 -0.02 -0.75 0.24 0.00 0.00 174.94 174.30 1npp s LYS 142 N -1.01 2.74 0.17 0.37 2.20 -0.20 -0.67 119.74 123.34 1npp s LYS 142 Ca -0.05 -1.05 -0.12 0.00 -0.36 0.00 0.00 55.97 54.39 1npp s LYS 142 Cb -0.07 -3.10 0.01 0.00 -1.51 0.00 0.00 37.83 33.16 1npp s LYS 142 CO 0.00 -0.47 0.35 0.00 -0.36 0.00 0.00 175.35 174.87 1npp s ALA 143 N 1.33 -0.35 -0.40 3.13 0.00 0.22 -0.26 121.76 125.43 1npp s ALA 143 Ca -0.01 -0.62 -0.16 0.00 0.00 0.00 0.00 51.96 51.17 1npp s ALA 143 Cb -0.18 0.82 0.01 0.00 0.00 0.00 0.00 23.12 23.77 1npp s ALA 143 CO -0.02 -0.68 0.36 -1.58 0.00 0.00 0.00 175.76 173.83 1npp s HIS 144 N -3.92 3.21 0.05 0.00 2.46 0.05 -0.84 115.29 116.30 1npp s HIS 144 Ca 0.13 -0.39 -0.26 0.00 0.47 0.00 0.00 55.06 55.01 1npp s HIS 144 Cb 0.02 -2.71 -0.05 0.00 -0.13 0.00 0.00 32.58 29.71 1npp s HIS 144 CO -0.02 -0.59 0.81 1.41 -2.47 0.00 0.00 174.74 173.88 1npp s MET 145 N 1.91 4.54 0.27 2.88 1.75 -1.26 -4.90 119.30 124.49 1npp s MET 145 Ca 0.09 1.15 -0.08 0.00 -1.25 0.00 0.00 55.69 55.60 1npp s MET 145 Cb -0.18 -3.37 -0.01 0.00 2.84 0.00 0.00 34.83 34.12 1npp s MET 145 CO 0.12 0.25 0.43 0.54 -0.65 0.00 0.00 175.02 175.71 1npp s ASN 146 N 0.01 0.27 0.20 1.11 4.22 -1.26 -5.04 114.94 114.45 1npp s ASN 146 Ca 0.41 -1.18 -0.11 0.00 -2.14 0.00 0.00 52.86 49.84 1npp s ASN 146 Cb -0.21 0.59 0.19 0.00 1.28 0.00 0.00 41.25 43.10 1npp s ASN 146 CO 0.24 -1.16 1.82 0.44 -2.04 0.00 0.00 177.10 176.40 1npp h ASP 147 N 2.26 0.56 -0.41 3.54 3.32 -1.99 -1.77 116.42 121.92 1npp h ASP 147 Ca -0.28 0.02 -0.05 0.00 0.02 0.00 0.00 57.03 56.73 1npp h ASP 147 Cb 1.25 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 40.68 1npp h ASP 147 CO 0.39 0.38 0.08 0.50 -1.72 0.00 0.00 179.24 178.87 1npp h LYS 148 N 0.69 0.76 -0.37 3.56 3.64 -1.99 -1.64 116.57 121.22 1npp h LYS 148 Ca 0.27 -0.16 -0.15 0.00 -1.27 0.00 0.00 60.65 59.34 1npp h LYS 148 Cb 0.11 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.82 1npp h LYS 148 CO -0.15 0.71 -0.34 1.25 -2.27 0.00 0.00 179.45 178.66 1npp h LEU 149 N 0.72 0.93 -0.68 5.20 6.46 -1.86 -1.79 115.31 124.29 1npp h LEU 149 Ca 0.16 -0.46 0.01 0.00 -0.12 0.00 0.00 57.88 57.47 1npp h LEU 149 Cb 0.33 -0.26 -0.04 0.00 -0.73 0.00 0.00 40.66 39.96 1npp h LEU 149 CO 0.00 1.20 0.44 0.25 -0.62 0.00 0.00 178.44 179.72 1npp h LEU 150 N 0.68 0.76 -0.54 2.25 5.85 -1.03 0.42 115.31 123.70 1npp h LEU 150 Ca 0.06 -0.01 -0.11 0.00 0.84 0.00 0.00 57.88 58.66 1npp h LEU 150 Cb 0.92 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.75 1npp h LEU 150 CO 0.09 0.54 -0.10 0.24 -0.34 0.00 0.00 178.44 178.87 1npp h MET 151 N 0.90 1.01 -0.59 1.25 2.86 -1.24 -0.77 114.93 118.35 1npp h MET 151 Ca 0.26 -0.37 -0.09 0.00 -2.06 0.00 0.00 59.70 57.44 1npp h MET 151 Cb -0.07 -0.07 -0.02 0.00 0.06 0.00 0.00 31.60 31.50 1npp h MET 151 CO -0.07 1.06 0.02 0.00 1.06 0.00 0.00 176.91 178.98 1npp h ALA 152 N 0.92 0.92 0.23 6.32 0.00 -0.95 -1.80 119.26 124.90 1npp h ALA 152 Ca 0.14 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 1npp h ALA 152 Cb 0.66 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 1npp h ALA 152 CO 0.05 0.65 -0.13 0.82 0.00 0.00 0.00 179.25 180.64 1npp h ILE 153 N 0.93 0.73 -0.55 0.00 2.04 -0.63 -2.81 117.51 117.22 1npp h ILE 153 Ca 0.17 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.10 1npp h ILE 153 Cb 0.51 0.73 -0.03 0.00 -0.74 0.00 0.00 36.82 37.29 1npp h ILE 153 CO 0.02 0.00 0.37 -0.33 0.00 0.00 0.00 178.15 178.21 1npp h GLU 154 N -0.34 0.49 -0.42 2.37 5.08 -0.91 -1.74 114.58 119.11 1npp h GLU 154 Ca -0.03 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1npp h GLU 154 Cb 0.27 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.41 1npp h GLU 154 CO 0.03 0.32 0.00 1.63 -1.00 0.00 0.00 179.01 180.00 1npp n LYS 155 N -4.47 2.03 -2.88 2.33 5.02 -0.70 -4.78 118.16 114.71 1npp n LYS 155 Ca 0.08 -1.60 -0.41 0.00 -2.02 0.00 0.00 58.31 54.36 1npp n LYS 155 Cb 0.25 -1.36 -0.04 0.00 -0.02 0.00 0.00 35.03 33.86 1npp n LYS 155 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1npp s THR 156 N -1.44 4.94 0.36 -0.18 2.01 -0.66 -4.99 115.64 115.68 1npp s THR 156 Ca 0.31 1.75 -0.29 0.00 0.31 0.00 0.00 61.69 63.77 1npp s THR 156 Cb 0.16 -4.18 -0.11 0.00 0.01 0.00 0.00 72.50 68.38 1npp s THR 156 CO 0.22 0.22 1.52 -2.65 -0.69 0.00 0.00 174.62 173.24 1npp n PRO 157 N 3.76 2.69 -0.92 4.92 -0.02 -1.26 -1.67 135.00 142.49 1npp n PRO 157 Ca 0.02 0.95 0.00 0.00 -2.02 0.00 0.00 63.50 62.45 1npp n PRO 157 Cb 0.51 -2.70 0.00 0.00 -0.02 0.00 0.00 33.50 31.29 1npp n PRO 157 CO 0.00 0.00 0.00 0.72 1.98 0.00 0.00 175.50 178.20 1npp n HIS 158 N 0.90 0.00 -4.56 6.00 8.25 -1.26 -4.61 115.22 119.94 1npp n HIS 158 Ca 0.03 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.16 1npp n HIS 158 Cb 0.38 -0.17 -0.13 0.00 1.12 0.00 0.00 29.99 31.19 1npp n HIS 158 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 1npp s VAL 159 N -3.64 3.56 0.00 1.59 1.01 -0.67 -0.72 120.40 121.53 1npp s VAL 159 Ca 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 61.98 61.50 1npp s VAL 159 Cb 0.00 -2.53 0.00 0.00 0.00 0.00 0.00 36.38 33.85 1npp s VAL 159 CO 0.00 0.51 0.00 0.49 0.00 0.00 0.00 175.10 176.10 1npp n PHE 160 N 3.47 0.00 -3.66 5.22 3.72 0.19 -4.62 117.46 121.78 1npp n PHE 160 Ca -0.18 0.00 -0.03 0.00 -0.05 0.00 0.00 57.45 57.19 1npp n PHE 160 Cb 0.53 -0.20 -0.01 0.00 -0.94 0.00 0.00 39.48 38.86 1npp n PHE 160 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 176.76 175.73 1npp s ARG 161 N -0.62 0.82 0.75 -1.08 1.70 -1.19 -4.41 118.95 114.93 1npp s ARG 161 Ca 0.00 -0.42 -0.13 0.00 -0.47 0.00 0.00 55.73 54.71 1npp s ARG 161 Cb 0.00 0.30 0.05 0.00 -0.57 0.00 0.00 34.95 34.73 1npp s ARG 161 CO 0.00 -0.37 1.12 -1.25 -1.08 0.00 0.00 175.30 173.72 1npp s PRO 162 N -2.93 2.23 0.22 3.89 0.04 -1.26 -0.36 135.00 136.83 1npp s PRO 162 Ca 0.11 1.38 -0.30 0.00 0.04 0.00 0.00 61.00 62.24 1npp s PRO 162 Cb 0.01 -1.88 -0.09 0.00 0.04 0.00 0.00 34.50 32.58 1npp s PRO 162 CO -0.02 -1.69 1.25 0.08 0.04 0.00 0.00 177.00 176.65 1npp s VAL 163 N -2.55 3.31 0.16 -0.36 1.01 0.35 -4.77 120.40 117.56 1npp s VAL 163 Ca 0.66 1.13 0.08 0.00 0.00 0.00 0.00 61.98 63.86 1npp s VAL 163 Cb -0.21 -3.72 -0.04 0.00 0.00 0.00 0.00 36.38 32.41 1npp s VAL 163 CO 0.50 0.20 -0.09 -0.04 0.00 0.00 0.00 175.10 175.67 1npp s MET 164 N -0.52 2.10 -0.03 2.72 1.00 -1.26 -1.26 119.30 122.04 1npp s MET 164 Ca 0.53 -1.21 -0.01 0.00 0.00 0.00 0.00 55.69 55.01 1npp s MET 164 Cb -0.35 -2.20 0.03 0.00 0.00 0.00 0.00 34.83 32.31 1npp s MET 164 CO 0.40 0.45 0.04 0.08 0.00 0.00 0.00 175.02 175.99 1npp s VAL 165 N -1.61 -0.08 -1.58 -6.03 1.01 -0.18 -4.78 120.40 107.15 1npp s VAL 165 Ca 0.24 0.29 -0.15 0.00 0.00 0.00 0.00 61.98 62.36 1npp s VAL 165 Cb -0.09 -0.11 0.11 0.00 0.00 0.00 0.00 36.38 36.29 1npp s VAL 165 CO 0.15 0.12 0.92 0.61 0.00 0.00 0.00 175.10 176.90 1npp n GLY 166 N 4.55 -0.48 2.46 4.51 0.00 -1.26 -1.47 105.19 113.51 1npp n GLY 166 Ca -0.20 0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1npp n GLY 166 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1npp n GLY 167 N -1.60 1.02 3.14 -0.02 0.00 -1.26 -5.03 105.19 101.44 1npp n GLY 167 Ca 0.05 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.91 1npp n GLY 167 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1npp s LYS 168 N -0.18 0.75 0.33 1.61 1.02 -0.54 -5.10 119.74 117.62 1npp s LYS 168 Ca 0.00 -0.98 -0.28 0.00 0.02 0.00 0.00 55.97 54.72 1npp s LYS 168 Cb 0.00 -0.56 -0.13 0.00 -0.52 0.00 0.00 37.83 36.63 1npp s LYS 168 CO 0.00 0.10 1.28 -2.30 -0.92 0.00 0.00 175.35 173.52 1npp n PRO 169 N 1.04 2.06 -3.26 -1.68 -0.02 -1.26 -1.01 135.00 130.86 1npp n PRO 169 Ca -0.20 0.72 -0.40 0.00 -2.02 0.00 0.00 63.50 61.61 1npp n PRO 169 Cb 0.56 -2.30 -0.08 0.00 -0.02 0.00 0.00 33.50 31.66 1npp n PRO 169 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1npp s VAL 170 N -0.98 5.07 0.59 -1.45 0.11 -0.39 -4.72 120.40 118.62 1npp s VAL 170 Ca 0.57 0.69 -0.17 0.00 -2.93 0.00 0.00 61.98 60.13 1npp s VAL 170 Cb -0.59 -3.84 -0.04 0.00 -1.53 0.00 0.00 36.38 30.38 1npp s VAL 170 CO 0.61 0.02 1.11 -2.16 -3.33 0.00 0.00 175.10 171.34 1npp s PRO 171 N 2.30 3.17 -0.09 1.54 0.04 -1.26 -4.50 135.00 136.19 1npp s PRO 171 Ca 0.20 1.48 -0.01 0.00 0.04 0.00 0.00 61.00 62.70 1npp s PRO 171 Cb -0.16 -1.99 -0.03 0.00 0.04 0.00 0.00 34.50 32.36 1npp s PRO 171 CO 0.10 -0.97 -0.03 -0.51 0.04 0.00 0.00 177.00 175.63 1npp s LEU 172 N -4.25 3.36 0.62 -3.56 1.43 0.18 -4.99 118.68 111.47 1npp s LEU 172 Ca 0.69 0.03 -0.18 0.00 -1.03 0.00 0.00 54.13 53.63 1npp s LEU 172 Cb -0.21 -1.76 -0.02 0.00 0.03 0.00 0.00 46.19 44.22 1npp s LEU 172 CO 0.33 0.33 1.25 -0.54 0.23 0.00 0.00 176.35 177.94 1npp s LYS 173 N -0.58 2.78 0.34 1.70 -0.14 -1.26 -4.25 119.74 118.34 1npp s LYS 173 Ca 0.09 1.93 0.04 0.00 -1.36 0.00 0.00 55.97 56.67 1npp s LYS 173 Cb -0.12 -1.89 0.67 0.00 -1.68 0.00 0.00 37.83 34.81 1npp s LYS 173 CO 0.02 -1.38 1.96 1.49 -0.76 0.00 0.00 175.35 176.68 1npp h GLU 174 N 0.73 0.82 -0.44 1.68 4.57 -1.99 -1.74 114.58 118.21 1npp h GLU 174 Ca -0.51 -0.05 -0.04 0.00 -1.18 0.00 0.00 59.36 57.58 1npp h GLU 174 Cb 1.32 -0.19 -0.02 0.00 -0.16 0.00 0.00 28.75 29.70 1npp h GLU 174 CO 0.54 0.54 0.12 1.49 -1.18 0.00 0.00 179.01 180.52 1npp h GLU 175 N 0.85 0.70 -0.37 1.92 4.81 -1.99 -1.24 114.58 119.25 1npp h GLU 175 Ca 0.31 -0.16 0.05 0.00 -0.13 0.00 0.00 59.36 59.43 1npp h GLU 175 Cb 0.17 -0.09 -0.04 0.00 0.63 0.00 0.00 28.75 29.41 1npp h GLU 175 CO -0.10 0.69 0.11 1.49 -0.73 0.00 0.00 179.01 180.47 1npp h GLU 176 N 0.57 0.24 -0.45 1.92 4.81 -1.70 0.62 114.58 120.60 1npp h GLU 176 Ca 0.14 -0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.38 1npp h GLU 176 Cb 0.30 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.59 1npp h GLU 176 CO -0.00 0.16 0.25 0.28 -0.73 0.00 0.00 179.01 178.97 1npp h VAL 177 N 0.25 1.02 -0.75 0.32 2.07 -1.14 -1.20 116.25 116.82 1npp h VAL 177 Ca 0.17 -0.17 -0.06 0.00 0.82 0.00 0.00 66.70 67.46 1npp h VAL 177 Cb 0.17 0.47 -0.03 0.00 -1.52 0.00 0.00 31.29 30.39 1npp h VAL 177 CO -0.20 0.09 0.23 1.56 0.02 0.00 0.00 177.57 179.27 1npp h GLN 178 N 0.51 1.17 -0.74 1.57 1.08 -0.86 -1.17 115.11 116.66 1npp h GLN 178 Ca 0.18 -0.25 -0.02 0.00 -1.45 0.00 0.00 58.65 57.11 1npp h GLN 178 Cb 0.04 -0.17 -0.04 0.00 -0.05 0.00 0.00 27.48 27.27 1npp h GLN 178 CO -0.10 0.99 0.40 -0.91 -0.95 0.00 0.00 178.83 178.26 1npp h ASN 179 N 1.12 0.92 0.28 1.46 2.35 -0.35 0.30 115.58 121.66 1npp h ASN 179 Ca 0.24 -0.08 -0.01 0.00 -0.55 0.00 0.00 56.30 55.90 1npp h ASN 179 Cb 0.32 -0.23 0.00 0.00 0.05 0.00 0.00 38.32 38.46 1npp h ASN 179 CO -0.01 0.75 -0.14 0.40 -1.65 0.00 0.00 177.43 176.79 1npp h ILE 180 N 1.04 0.74 -0.58 2.81 2.04 -0.79 -2.24 117.51 120.53 1npp h ILE 180 Ca 0.26 -0.57 -0.01 0.00 1.00 0.00 0.00 64.86 65.54 1npp h ILE 180 Cb 0.04 1.04 -0.03 0.00 -0.74 0.00 0.00 36.82 37.13 1npp h ILE 180 CO -0.04 0.11 0.33 -0.07 0.00 0.00 0.00 178.15 178.49 1npp h LEU 181 N -0.70 0.69 -1.51 1.44 3.38 -1.06 -1.56 115.31 116.00 1npp h LEU 181 Ca -0.04 -0.04 -0.05 0.00 0.09 0.00 0.00 57.88 57.84 1npp h LEU 181 Cb 0.48 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.05 1npp h LEU 181 CO 0.06 0.54 -0.25 0.78 0.09 0.00 0.00 178.44 179.66 1npp h ASN 182 N 0.79 0.00 0.35 -0.43 2.35 -0.34 -0.98 115.58 117.33 1npp h ASN 182 Ca 0.21 0.00 -0.19 0.00 -0.55 0.00 0.00 56.30 55.77 1npp h ASN 182 Cb -0.01 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.35 1npp h ASN 182 CO -0.04 0.25 -0.79 -0.61 -1.65 0.00 0.00 177.43 174.60 1npp h GLN 183 N 0.00 0.34 -0.56 0.81 4.15 -0.66 -1.54 115.11 117.65 1npp h GLN 183 Ca -0.00 -0.31 -0.10 0.00 0.77 0.00 0.00 58.65 59.01 1npp h GLN 183 Cb 0.46 0.07 -0.02 0.00 0.21 0.00 0.00 27.48 28.21 1npp h GLN 183 CO 0.03 0.97 -0.04 0.82 -1.93 0.00 0.00 178.83 178.68 1npp h ILE 184 N 0.22 1.27 -0.88 2.39 1.08 -1.04 -2.94 117.51 117.61 1npp h ILE 184 Ca -0.04 -1.18 -0.01 0.00 -0.39 0.00 0.00 64.86 63.24 1npp h ILE 184 Cb 1.37 0.90 -0.04 0.00 -3.07 0.00 0.00 36.82 35.98 1npp h ILE 184 CO 0.13 0.42 0.52 0.11 -0.69 0.00 0.00 178.15 178.64 1npp h LYS 185 N 0.90 1.19 -0.03 2.37 1.57 -1.02 -1.99 116.57 119.57 1npp h LYS 185 Ca 0.15 -0.11 -0.00 0.00 -1.87 0.00 0.00 60.65 58.82 1npp h LYS 185 Cb 0.60 -0.25 -0.00 0.00 0.08 0.00 0.00 32.23 32.66 1npp h LYS 185 CO 0.04 0.84 0.01 0.00 -0.57 0.00 0.00 179.45 179.76 1npp h ARG 186 N 1.21 0.04 0.00 3.15 3.08 -1.11 -3.45 114.38 117.30 1npp h ARG 186 Ca 0.31 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.36 1npp h ARG 186 Cb -0.04 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.00 1npp h ARG 186 CO -0.06 0.04 0.00 0.41 -1.07 0.00 0.00 179.97 179.30 1npp n GLY 187 N -1.49 1.49 0.00 0.04 0.00 -0.75 -4.90 105.19 99.58 1npp n GLY 187 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1npp n GLY 187 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1npp n VAL 188 N -2.00 0.00 -1.56 1.61 3.14 -1.24 -4.68 118.33 113.60 1npp n VAL 188 Ca 0.00 0.00 -0.37 0.00 -2.96 0.00 0.00 64.34 61.01 1npp n VAL 188 Cb 0.00 0.00 -0.03 0.00 -1.06 0.00 0.00 33.84 32.75 1npp n VAL 188 CO 0.00 0.00 0.00 0.29 -6.46 0.00 0.00 176.83 170.66 1npp n LYS 189 N 0.00 1.17 -2.75 1.45 4.76 -1.26 -4.86 118.16 116.67 1npp n LYS 189 Ca 0.00 0.07 -0.43 0.00 -2.87 0.00 0.00 58.31 55.08 1npp n LYS 189 Cb 0.00 -3.43 -0.03 0.00 -1.84 0.00 0.00 35.03 29.73 1npp n LYS 189 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1npp s PRO 190 N 8.03 3.62 0.00 1.97 0.04 -1.26 -4.99 135.00 142.40 1npp s PRO 190 Ca 0.98 -1.49 0.00 0.00 0.04 0.00 0.00 61.00 60.53 1npp s PRO 190 Cb -0.19 -5.14 0.00 0.00 0.04 0.00 0.00 34.50 29.21 1npp s PRO 190 CO 0.27 -1.99 0.00 0.43 0.04 0.00 0.00 177.00 175.76 1npp n SER 191 N 7.65 0.00 0.07 6.66 7.64 -1.26 -4.93 113.62 129.44 1npp n SER 191 Ca 0.29 0.00 0.12 0.00 1.01 0.00 0.00 58.87 60.29 1npp n SER 191 Cb 0.50 0.00 0.16 0.00 -1.01 0.00 0.00 64.21 63.85 1npp n SER 191 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 1npp h LYS 192 N 0.00 0.00 0.00 1.43 6.56 -2.03 -3.47 116.57 119.06 1npp h LYS 192 Ca 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 1npp h LYS 192 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.66 1npp h LYS 192 CO 0.00 0.00 0.00 0.28 -2.06 0.00 0.00 179.45 177.67 1npp n VAL 193 N -2.21 0.00 -2.37 0.50 0.31 -1.26 -4.85 118.33 108.45 1npp n VAL 193 Ca 0.03 0.00 -0.36 0.00 -0.01 0.00 0.00 64.34 64.00 1npp n VAL 193 Cb 0.45 -0.60 -0.04 0.00 -0.91 0.00 0.00 33.84 32.74 1npp n VAL 193 CO 0.00 0.00 0.00 -1.83 -1.32 0.00 0.00 176.83 173.68 1npp s GLU 194 N -1.21 3.19 -0.68 5.55 1.03 -1.26 -3.53 118.70 121.80 1npp s GLU 194 Ca 0.00 -0.74 -0.02 0.00 0.03 0.00 0.00 54.97 54.24 1npp s GLU 194 Cb 0.00 -5.17 -0.03 0.00 -0.80 0.00 0.00 34.13 28.14 1npp s GLU 194 CO 0.00 -2.61 0.58 1.19 -1.33 0.00 0.00 175.26 173.09 1npp n PHE 195 N 10.73 -1.44 -2.71 4.83 3.72 -1.26 -4.99 117.46 126.34 1npp n PHE 195 Ca 0.33 0.54 -0.41 0.00 -0.05 0.00 0.00 57.45 57.87 1npp n PHE 195 Cb 0.50 -3.65 -0.05 0.00 -0.94 0.00 0.00 39.48 35.34 1npp n PHE 195 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 176.76 174.71 1npp s GLU 196 N -4.24 4.73 -0.04 -1.08 2.56 -1.23 -4.80 118.70 114.61 1npp s GLU 196 Ca 0.17 1.50 -0.36 0.00 0.00 0.00 0.00 54.97 56.28 1npp s GLU 196 Cb -0.02 -3.34 -0.14 0.00 2.00 0.00 0.00 34.13 32.63 1npp s GLU 196 CO 0.45 0.29 1.67 1.17 -0.56 0.00 0.00 175.26 178.28 1npp n LYS 197 N 2.35 1.74 0.00 4.30 4.81 -1.26 -1.06 118.16 129.04 1npp n LYS 197 Ca 0.01 0.63 0.00 0.00 -0.87 0.00 0.00 58.31 58.09 1npp n LYS 197 Cb 0.48 -2.39 0.00 0.00 0.02 0.00 0.00 35.03 33.15 1npp n LYS 197 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1npp n GLY 198 N 3.75 1.11 3.82 3.14 0.00 -0.94 -5.04 105.19 111.02 1npp n GLY 198 Ca 0.21 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.91 1npp n GLY 198 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1npp s ASP 199 N -1.83 5.93 -0.03 1.61 1.47 -0.22 -4.67 116.67 118.93 1npp s ASP 199 Ca 0.00 1.71 -0.14 0.00 1.18 0.00 0.00 52.55 55.30 1npp s ASP 199 Cb 0.00 -2.52 -0.05 0.00 -0.34 0.00 0.00 42.92 40.01 1npp s ASP 199 CO 0.00 -1.07 0.36 -1.10 0.68 0.00 0.00 175.17 174.05 1npp s GLN 200 N -4.28 3.86 0.35 2.11 -1.52 -1.26 -1.92 119.66 117.00 1npp s GLN 200 Ca 0.61 0.32 0.07 0.00 -1.95 0.00 0.00 55.36 54.41 1npp s GLN 200 Cb -0.14 -3.23 -0.03 0.00 -0.22 0.00 0.00 33.01 29.39 1npp s GLN 200 CO 0.39 0.68 0.25 1.33 -0.25 0.00 0.00 175.29 177.69 1npp n VAL 201 N 1.95 0.00 -3.90 1.09 0.24 -1.21 -1.18 118.33 115.33 1npp n VAL 201 Ca -0.15 -2.42 -0.11 0.00 -2.04 0.00 0.00 64.34 59.62 1npp n VAL 201 Cb 0.53 1.14 -0.12 0.00 -1.47 0.00 0.00 33.84 33.91 1npp n VAL 201 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 1npp s ARG 202 N -3.39 0.17 -0.02 7.34 3.52 -0.36 -3.65 118.95 122.56 1npp s ARG 202 Ca 0.36 -0.19 -0.21 0.00 -0.13 0.00 0.00 55.73 55.55 1npp s ARG 202 Cb 0.02 0.07 -0.05 0.00 -1.56 0.00 0.00 34.95 33.42 1npp s ARG 202 CO 0.25 -0.03 0.63 0.08 -0.81 0.00 0.00 175.30 175.42 1npp s VAL 203 N -0.56 4.93 -0.08 7.11 1.01 -1.14 -1.81 120.40 129.86 1npp s VAL 203 Ca -0.06 1.31 -0.03 0.00 0.00 0.00 0.00 61.98 63.20 1npp s VAL 203 Cb -0.04 -3.97 -0.03 0.00 0.00 0.00 0.00 36.38 32.34 1npp s VAL 203 CO -0.00 0.37 -0.09 2.30 0.00 0.00 0.00 175.10 177.68 1npp n ILE 204 N 3.02 0.41 -3.56 2.22 -5.35 0.37 0.17 119.36 116.64 1npp n ILE 204 Ca -0.05 -0.11 -0.38 0.00 -0.27 0.00 0.00 62.75 61.94 1npp n ILE 204 Cb 0.51 -1.47 -0.10 0.00 -1.74 0.00 0.00 39.64 36.84 1npp n ILE 204 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 1npp s GLU 205 N -2.14 4.02 0.00 6.28 -6.30 -1.10 -4.74 118.70 114.73 1npp s GLU 205 Ca -0.10 -0.19 0.00 0.00 -2.50 0.00 0.00 54.97 52.17 1npp s GLU 205 Cb 0.04 -3.61 0.00 0.00 0.00 0.00 0.00 34.13 30.56 1npp s GLU 205 CO 0.14 -0.11 0.00 0.41 0.02 0.00 0.00 175.26 175.72 1npp n GLY 206 N 4.64 0.13 0.00 -1.50 0.00 -1.26 -4.72 105.19 102.48 1npp n GLY 206 Ca -0.13 -2.29 0.15 0.00 0.00 0.00 0.00 46.02 43.75 1npp n GLY 206 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1npp n PRO 207 N -0.15 0.93 -0.19 1.61 -0.04 -1.26 -3.27 135.00 132.63 1npp n PRO 207 Ca 0.00 0.00 0.07 0.00 -0.04 0.00 0.00 63.50 63.53 1npp n PRO 207 Cb 0.00 -1.50 0.15 0.00 -0.04 0.00 0.00 33.50 32.11 1npp n PRO 207 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1npp n PHE 208 N -1.01 0.39 -1.49 0.54 3.72 -1.26 -5.06 117.46 113.29 1npp n PHE 208 Ca 0.23 -0.75 -0.46 0.00 -0.05 0.00 0.00 57.45 56.41 1npp n PHE 208 Cb 0.11 -0.15 -0.02 0.00 -0.94 0.00 0.00 39.48 38.47 1npp n PHE 208 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 176.76 175.38 1npp n MET 209 N -0.53 0.61 0.00 -1.08 2.81 -1.20 -2.22 117.12 115.50 1npp n MET 209 Ca 0.13 0.21 0.00 0.00 -1.81 0.00 0.00 57.70 56.24 1npp n MET 209 Cb 0.59 -1.38 0.00 0.00 -0.71 0.00 0.00 33.22 31.72 1npp n MET 209 CO 0.00 0.00 0.00 0.09 1.51 0.00 0.00 175.97 177.57 1npp n ASN 210 N 1.65 0.00 -4.62 7.83 3.02 0.44 -4.84 115.26 118.74 1npp n ASN 210 Ca 0.14 0.00 -0.30 0.00 -0.03 0.00 0.00 54.58 54.40 1npp n ASN 210 Cb 0.28 -0.36 0.19 0.00 -0.61 0.00 0.00 39.78 39.27 1npp n ASN 210 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1npp s PHE 211 N -0.37 1.76 0.08 3.10 0.08 -0.94 -4.63 117.98 117.06 1npp s PHE 211 Ca 0.00 1.40 -0.05 0.00 0.12 0.00 0.00 56.93 58.39 1npp s PHE 211 Cb 0.00 -3.19 -0.02 0.00 -0.57 0.00 0.00 43.02 39.24 1npp s PHE 211 CO 0.00 -3.06 0.10 0.95 -0.10 0.00 0.00 175.22 173.12 1npp s THR 212 N -2.68 0.16 0.00 0.64 -4.23 -1.26 -2.90 115.64 105.38 1npp s THR 212 Ca 0.66 -1.50 0.00 0.00 -1.18 0.00 0.00 61.69 59.67 1npp s THR 212 Cb -0.22 -1.51 0.00 0.00 1.34 0.00 0.00 72.50 72.11 1npp s THR 212 CO 0.60 -0.74 0.00 0.61 -0.54 0.00 0.00 174.62 174.55 1npp n GLY 213 N -0.01 0.85 3.72 3.99 0.00 -1.24 -2.59 105.19 109.90 1npp n GLY 213 Ca -0.13 -0.47 -0.37 0.00 0.00 0.00 0.00 46.02 45.05 1npp n GLY 213 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1npp s THR 214 N -1.65 5.27 -0.12 2.61 2.01 0.16 -3.34 115.64 120.59 1npp s THR 214 Ca 0.00 0.63 -0.30 0.00 0.31 0.00 0.00 61.69 62.33 1npp s THR 214 Cb 0.00 -3.67 -0.02 0.00 0.01 0.00 0.00 72.50 68.82 1npp s THR 214 CO 0.00 0.36 1.16 -0.69 -0.69 0.00 0.00 174.62 174.75 1npp s VAL 215 N 0.63 4.42 0.10 3.82 1.01 -0.81 0.46 120.40 130.03 1npp s VAL 215 Ca 0.18 1.73 0.02 0.00 0.00 0.00 0.00 61.98 63.91 1npp s VAL 215 Cb -0.14 -4.11 -0.24 0.00 0.00 0.00 0.00 36.38 31.89 1npp s VAL 215 CO 0.05 -0.06 1.21 -0.33 0.00 0.00 0.00 175.10 175.97 1npp h GLU 216 N 7.57 0.11 0.00 2.72 4.39 0.15 -2.50 114.58 127.02 1npp h GLU 216 Ca -0.29 -0.19 0.00 0.00 0.34 0.00 0.00 59.36 59.21 1npp h GLU 216 Cb 1.13 0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.85 1npp h GLU 216 CO 0.91 1.08 0.00 -1.91 -1.16 0.00 0.00 179.01 177.93 1npp n GLU 217 N -3.42 -1.12 -0.03 2.33 4.07 -1.22 -4.82 120.64 116.43 1npp n GLU 217 Ca -0.04 0.00 -0.04 0.00 -0.06 0.00 0.00 57.16 57.02 1npp n GLU 217 Cb 0.98 0.00 -0.03 0.00 -0.06 0.00 0.00 31.44 32.32 1npp n GLU 217 CO 0.00 0.00 0.00 0.28 -0.06 0.00 0.00 177.13 177.35 1npp n VAL 218 N -0.07 0.37 -1.05 6.31 0.31 -1.26 -3.51 118.33 119.43 1npp n VAL 218 Ca 0.00 -0.17 0.01 0.00 -0.01 0.00 0.00 64.34 64.17 1npp n VAL 218 Cb 0.00 -0.78 -0.00 0.00 -0.91 0.00 0.00 33.84 32.15 1npp n VAL 218 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 1npp n HIS 219 N -2.52 -1.86 -2.16 3.52 8.25 -1.26 -4.14 115.22 115.05 1npp n HIS 219 Ca -0.11 0.09 -0.43 0.00 -0.26 0.00 0.00 57.72 57.02 1npp n HIS 219 Cb 0.64 -0.16 -0.02 0.00 1.12 0.00 0.00 29.99 31.56 1npp n HIS 219 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 1npp s PRO 220 N -0.82 3.48 0.00 -0.41 0.04 -1.26 -4.51 135.00 131.52 1npp s PRO 220 Ca 0.00 1.25 0.00 0.00 0.04 0.00 0.00 61.00 62.29 1npp s PRO 220 Cb 0.00 -4.11 0.00 0.00 0.04 0.00 0.00 34.50 30.43 1npp s PRO 220 CO 0.00 -1.68 0.00 -0.85 0.04 0.00 0.00 177.00 174.51 1npp n GLU 221 N 8.21 -0.08 0.00 4.56 0.28 -1.26 -4.77 120.64 127.57 1npp n GLU 221 Ca 0.20 0.12 0.00 0.00 -0.16 0.00 0.00 57.16 57.32 1npp n GLU 221 Cb 0.47 -0.12 0.00 0.00 1.43 0.00 0.00 31.44 33.22 1npp n GLU 221 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 177.13 178.14 1npp n LYS 222 N 0.82 0.00 -2.77 3.44 4.81 -1.26 -5.05 118.16 118.14 1npp n LYS 222 Ca 0.00 0.00 -0.14 0.00 -0.87 0.00 0.00 58.31 57.30 1npp n LYS 222 Cb 0.04 0.00 -0.03 0.00 0.02 0.00 0.00 35.03 35.06 1npp n LYS 222 CO 0.00 0.00 0.00 2.89 1.17 0.00 0.00 177.40 181.46 1npp n ARG 223 N 0.00 -0.92 -4.38 1.64 1.85 -1.26 -4.90 116.66 108.69 1npp n ARG 223 Ca 0.00 0.04 -0.19 0.00 -1.00 0.00 0.00 57.85 56.71 1npp n ARG 223 Cb 0.34 -1.56 -0.10 0.00 -1.05 0.00 0.00 32.46 30.08 1npp n ARG 223 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 1npp s LYS 224 N -3.67 1.47 -0.02 2.89 1.02 -1.26 -3.83 119.74 116.35 1npp s LYS 224 Ca 0.21 -1.78 0.00 0.00 0.02 0.00 0.00 55.97 54.42 1npp s LYS 224 Cb -0.12 -0.69 0.02 0.00 -0.52 0.00 0.00 37.83 36.53 1npp s LYS 224 CO 0.37 -0.15 0.01 -0.51 -0.92 0.00 0.00 175.35 174.15 1npp s LEU 225 N -3.38 1.29 -0.36 3.17 1.43 0.34 -4.42 118.68 116.74 1npp s LEU 225 Ca 0.33 0.00 -0.18 0.00 -1.03 0.00 0.00 54.13 53.24 1npp s LEU 225 Cb 0.07 -0.13 -0.00 0.00 0.03 0.00 0.00 46.19 46.16 1npp s LEU 225 CO 0.12 -0.09 0.52 -0.89 0.23 0.00 0.00 176.35 176.24 1npp s THR 226 N 0.84 5.00 -0.09 5.49 2.01 -1.23 0.65 115.64 128.32 1npp s THR 226 Ca -0.08 0.29 0.04 0.00 0.31 0.00 0.00 61.69 62.25 1npp s THR 226 Cb -0.11 -3.99 0.00 0.00 0.01 0.00 0.00 72.50 68.41 1npp s THR 226 CO -0.02 -0.26 -0.21 -0.69 -0.69 0.00 0.00 174.62 172.75 1npp s VAL 227 N 2.42 1.85 -0.46 3.82 1.01 0.44 0.89 120.40 130.37 1npp s VAL 227 Ca 0.19 -0.90 -0.27 0.00 0.00 0.00 0.00 61.98 60.99 1npp s VAL 227 Cb -0.15 -1.61 0.03 0.00 0.00 0.00 0.00 36.38 34.64 1npp s VAL 227 CO 0.14 0.51 1.04 -0.04 0.00 0.00 0.00 175.10 176.75 1npp s MET 228 N 0.38 3.67 0.25 2.72 -1.94 0.17 -0.02 119.30 124.53 1npp s MET 228 Ca -0.17 0.42 0.10 0.00 -1.71 0.00 0.00 55.69 54.33 1npp s MET 228 Cb -0.17 -3.90 -0.04 0.00 2.01 0.00 0.00 34.83 32.72 1npp s MET 228 CO 0.08 -1.27 -0.07 0.96 -0.01 0.00 0.00 175.02 174.70 1npp s ILE 229 N 4.08 3.16 -0.43 2.53 -4.36 -0.89 0.40 121.20 125.69 1npp s ILE 229 Ca 0.43 -1.98 -0.12 0.00 -0.26 0.00 0.00 60.65 58.72 1npp s ILE 229 Cb -0.09 -2.66 0.07 0.00 1.25 0.00 0.00 42.46 41.03 1npp s ILE 229 CO 0.28 -0.33 0.31 -0.55 0.24 0.00 0.00 174.94 174.89 1npp s SER 230 N -3.47 5.85 -0.75 4.36 0.15 -1.07 -1.88 113.70 116.90 1npp s SER 230 Ca 0.30 -1.37 -0.22 0.00 0.70 0.00 0.00 55.95 55.36 1npp s SER 230 Cb -0.07 -2.07 0.08 0.00 -1.71 0.00 0.00 66.02 62.26 1npp s SER 230 CO 0.18 -0.56 1.05 -0.63 1.20 0.00 0.00 173.24 174.47 1npp s ILE 231 N 1.53 4.37 -1.70 6.45 1.01 -0.53 -4.18 121.20 128.14 1npp s ILE 231 Ca 0.03 -0.64 -0.11 0.00 0.00 0.00 0.00 60.65 59.93 1npp s ILE 231 Cb -0.23 -4.74 0.11 0.00 0.01 0.00 0.00 42.46 37.61 1npp s ILE 231 CO 0.04 -1.52 0.28 0.49 0.00 0.00 0.00 174.94 174.24 1npp n PHE 232 N 7.57 -1.22 0.00 3.97 3.72 -1.26 -0.31 117.46 129.94 1npp n PHE 232 Ca 0.05 0.65 0.00 0.00 -0.05 0.00 0.00 57.45 58.10 1npp n PHE 232 Cb 0.47 -2.38 0.00 0.00 -0.94 0.00 0.00 39.48 36.63 1npp n PHE 232 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1npp n GLY 233 N -1.88 2.84 3.60 1.37 0.00 -1.26 -5.04 105.19 104.82 1npp n GLY 233 Ca -0.12 -0.58 -0.43 0.00 0.00 0.00 0.00 46.02 44.89 1npp n GLY 233 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1npp s ARG 234 N 0.00 3.44 -0.00 1.61 6.06 0.58 -4.95 118.95 125.68 1npp s ARG 234 Ca 0.00 1.00 -0.30 0.00 -2.50 0.00 0.00 55.73 53.93 1npp s ARG 234 Cb 0.00 -4.10 -0.07 0.00 0.06 0.00 0.00 34.95 30.85 1npp s ARG 234 CO 0.00 -1.73 1.63 1.41 -2.50 0.00 0.00 175.30 174.11 1npp s MET 235 N 5.28 4.20 -0.04 5.12 1.75 -1.26 -1.46 119.30 132.88 1npp s MET 235 Ca 0.65 2.22 -0.00 0.00 -1.25 0.00 0.00 55.69 57.31 1npp s MET 235 Cb -0.16 -3.81 0.03 0.00 2.84 0.00 0.00 34.83 33.73 1npp s MET 235 CO 0.32 -0.78 0.00 0.99 -0.65 0.00 0.00 175.02 174.90 1npp s THR 236 N 3.38 0.24 0.37 10.11 2.01 -0.79 -4.98 115.64 125.98 1npp s THR 236 Ca 0.73 0.12 -0.26 0.00 0.31 0.00 0.00 61.69 62.58 1npp s THR 236 Cb -0.35 -0.37 -0.09 0.00 0.01 0.00 0.00 72.50 71.70 1npp s THR 236 CO 0.30 0.19 1.17 -2.84 -0.69 0.00 0.00 174.62 172.75 1npp s PRO 237 N 1.44 4.22 -0.02 4.92 0.02 -1.26 -2.09 135.00 142.23 1npp s PRO 237 Ca -0.04 1.87 0.00 0.00 0.02 0.00 0.00 61.00 62.85 1npp s PRO 237 Cb -0.13 -2.82 0.02 0.00 0.02 0.00 0.00 34.50 31.59 1npp s PRO 237 CO -0.03 -0.18 0.00 0.08 -0.33 0.00 0.00 177.00 176.54 1npp s VAL 238 N -1.34 0.13 -0.40 3.83 1.01 0.96 -4.91 120.40 119.69 1npp s VAL 238 Ca 0.53 0.06 -0.18 0.00 0.00 0.00 0.00 61.98 62.39 1npp s VAL 238 Cb -0.32 -0.20 0.01 0.00 0.00 0.00 0.00 36.38 35.87 1npp s VAL 238 CO 0.40 0.11 0.51 -1.61 0.00 0.00 0.00 175.10 174.52 1npp s GLU 239 N 0.75 3.36 0.09 2.72 8.01 -1.26 0.17 118.70 132.54 1npp s GLU 239 Ca -0.07 -0.42 0.05 0.00 0.01 0.00 0.00 54.97 54.54 1npp s GLU 239 Cb -0.10 -3.90 -0.03 0.00 -4.31 0.00 0.00 34.13 25.79 1npp s GLU 239 CO -0.02 -0.80 -0.13 -0.51 0.01 0.00 0.00 175.26 173.81 1npp s LEU 240 N 2.40 2.34 0.53 1.80 1.43 0.21 -4.96 118.68 122.44 1npp s LEU 240 Ca 0.17 -0.71 -0.02 0.00 -1.03 0.00 0.00 54.13 52.53 1npp s LEU 240 Cb -0.16 -0.49 0.01 0.00 0.03 0.00 0.00 46.19 45.58 1npp s LEU 240 CO 0.15 -0.13 0.79 -0.62 0.23 0.00 0.00 176.35 176.77 1npp s ASP 241 N -2.10 5.64 0.40 2.29 -1.08 -1.26 0.13 116.67 120.69 1npp s ASP 241 Ca 0.03 0.44 0.21 0.00 -0.52 0.00 0.00 52.55 52.71 1npp s ASP 241 Cb -0.07 -1.53 0.79 0.00 -1.46 0.00 0.00 42.92 40.65 1npp s ASP 241 CO 0.02 -0.93 1.78 -0.26 0.52 0.00 0.00 175.17 176.30 1npp h PHE 242 N 0.09 0.00 0.00 -5.34 0.04 -1.87 -1.60 116.94 108.26 1npp h PHE 242 Ca -0.45 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.32 1npp h PHE 242 Cb 1.26 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.41 1npp h PHE 242 CO 0.45 0.31 0.00 -0.44 -0.60 0.00 0.00 178.31 178.02 1npp h ASP 243 N 0.00 0.00 -0.00 2.17 3.32 -1.93 -2.91 116.42 117.08 1npp h ASP 243 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1npp h ASP 243 Cb 0.82 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.37 1npp h ASP 243 CO 0.04 0.00 -0.91 0.00 -1.72 0.00 0.00 179.24 176.65 1npp n GLN 244 N -2.98 0.54 -4.31 3.56 6.02 -0.66 -4.60 117.38 114.94 1npp n GLN 244 Ca 0.01 -0.02 -0.17 0.00 -0.01 0.00 0.00 57.00 56.82 1npp n GLN 244 Cb 0.34 -1.43 -0.10 0.00 1.02 0.00 0.00 30.24 30.07 1npp n GLN 244 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 1npp s VAL 245 N -2.84 1.18 -0.00 5.09 -7.23 -0.86 -0.48 120.40 115.26 1npp s VAL 245 Ca 0.08 -2.06 0.00 0.00 -1.81 0.00 0.00 61.98 58.19 1npp s VAL 245 Cb 0.15 -2.17 0.00 0.00 0.56 0.00 0.00 36.38 34.92 1npp s VAL 245 CO 0.80 -0.48 -0.01 -1.83 -0.31 0.00 0.00 175.10 173.28 1npp s GLU 246 N -3.80 0.08 0.46 4.82 -1.05 -0.75 -4.80 118.70 113.66 1npp s GLU 246 Ca 0.24 -0.01 -0.23 0.00 -0.15 0.00 0.00 54.97 54.83 1npp s GLU 246 Cb 0.04 -0.11 -0.07 0.00 -0.44 0.00 0.00 34.13 33.54 1npp s GLU 246 CO 0.06 -0.00 1.17 0.15 0.95 0.00 0.00 175.26 177.58 1npp s LYS 247 N 0.13 3.77 0.00 -4.83 1.02 -1.26 -1.22 119.74 117.35 1npp s LYS 247 Ca -0.01 1.78 0.00 0.00 0.02 0.00 0.00 55.97 57.76 1npp s LYS 247 Cb -0.02 -2.42 0.00 0.00 -0.52 0.00 0.00 37.83 34.87 1npp s LYS 247 CO -0.00 -0.54 0.36 0.44 -0.92 0.00 0.00 175.35 174.68