#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nsc s GLU 2 N 0.00 1.70 -0.13 2.12 2.02 -0.25 -4.99 118.70 119.17 2nsc s GLU 2 Ca 0.00 -0.32 -0.04 0.00 0.02 0.00 0.00 54.97 54.63 2nsc s GLU 2 Cb 0.00 -1.69 -0.03 0.00 0.10 0.00 0.00 34.13 32.50 2nsc s GLU 2 CO 0.00 -0.25 0.02 0.54 0.02 0.00 0.00 175.26 175.59 2nsc s VAL 3 N 1.63 4.49 -0.06 2.63 0.11 -1.26 -0.94 120.40 126.99 2nsc s VAL 3 Ca 0.04 -0.16 0.03 0.00 -2.93 0.00 0.00 61.98 58.96 2nsc s VAL 3 Cb -0.13 -2.94 0.00 0.00 -1.53 0.00 0.00 36.38 31.78 2nsc s VAL 3 CO -0.08 0.55 -0.17 -0.75 -3.33 0.00 0.00 175.10 171.32 2nsc s LYS 4 N -0.36 2.02 -0.37 1.54 2.20 -0.13 -4.95 119.74 119.69 2nsc s LYS 4 Ca 0.08 -0.59 -0.29 0.00 -0.36 0.00 0.00 55.97 54.81 2nsc s LYS 4 Cb -0.12 -1.65 0.02 0.00 -1.51 0.00 0.00 37.83 34.56 2nsc s LYS 4 CO 0.02 0.15 1.13 -2.00 -0.36 0.00 0.00 175.35 174.28 2nsc s GLU 5 N 0.34 3.93 0.07 4.03 2.12 -1.26 -0.54 118.70 127.39 2nsc s GLU 5 Ca -0.11 0.93 -0.08 0.00 0.36 0.00 0.00 54.97 56.07 2nsc s GLU 5 Cb -0.15 -3.81 -0.26 0.00 0.26 0.00 0.00 34.13 30.17 2nsc s GLU 5 CO 0.04 -1.09 1.14 -0.07 -0.54 0.00 0.00 175.26 174.74 2nsc h LEU 6 N 10.57 0.58 -7.00 2.70 3.38 -1.05 -3.48 115.31 121.01 2nsc h LEU 6 Ca -0.22 -0.58 0.06 0.00 0.09 0.00 0.00 57.88 57.23 2nsc h LEU 6 Cb 1.06 -0.19 -0.19 0.00 0.09 0.00 0.00 40.66 41.44 2nsc h LEU 6 CO 1.07 1.43 0.45 -1.83 0.09 0.00 0.00 178.44 179.64 2nsc s GLU 7 N -2.79 0.79 -0.12 1.13 -1.05 -1.21 -5.00 118.70 110.45 2nsc s GLU 7 Ca -0.06 -0.02 0.03 0.00 -0.15 0.00 0.00 54.97 54.77 2nsc s GLU 7 Cb 0.07 0.37 0.01 0.00 -0.44 0.00 0.00 34.13 34.13 2nsc s GLU 7 CO 0.90 -0.29 -0.22 0.50 0.95 0.00 0.00 175.26 177.10 2nsc s ARG 8 N -1.95 2.98 -0.40 -4.83 3.52 -1.26 -1.06 118.95 115.96 2nsc s ARG 8 Ca -0.01 -0.85 0.01 0.00 -0.13 0.00 0.00 55.73 54.76 2nsc s ARG 8 Cb -0.01 -2.35 0.14 0.00 -1.56 0.00 0.00 34.95 31.18 2nsc s ARG 8 CO -0.01 0.06 0.24 0.34 -0.81 0.00 0.00 175.30 175.11 2nsc s ASP 9 N 0.64 3.18 1.72 -2.12 2.15 0.10 -5.02 116.67 117.32 2nsc s ASP 9 Ca -0.12 -2.46 0.00 0.00 0.43 0.00 0.00 52.55 50.40 2nsc s ASP 9 Cb -0.16 -0.69 0.00 0.00 -0.30 0.00 0.00 42.92 41.77 2nsc s ASP 9 CO 0.02 -0.28 0.00 0.29 -0.17 0.00 0.00 175.17 175.03 2nsc n LYS 10 N 3.71 0.00 -0.27 4.34 5.02 -1.26 -1.91 118.16 127.79 2nsc n LYS 10 Ca 0.12 0.00 0.11 0.00 -2.02 0.00 0.00 58.31 56.52 2nsc n LYS 10 Cb 0.37 0.00 0.26 0.00 -0.02 0.00 0.00 35.03 35.63 2nsc n LYS 10 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2nsc n ASN 11 N 9.92 3.63 -4.61 4.39 3.02 -1.26 -4.87 115.26 125.48 2nsc n ASN 11 Ca 0.00 -1.99 -0.40 0.00 -0.03 0.00 0.00 54.58 52.16 2nsc n ASN 11 Cb 0.00 -0.35 -0.08 0.00 -0.61 0.00 0.00 39.78 38.74 2nsc n ASN 11 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 2nsc s ARG 12 N -1.22 4.01 -0.08 3.52 3.52 -0.80 -5.07 118.95 122.84 2nsc s ARG 12 Ca 0.42 0.26 0.05 0.00 -0.13 0.00 0.00 55.73 56.32 2nsc s ARG 12 Cb 0.23 -3.67 -0.00 0.00 -1.56 0.00 0.00 34.95 29.95 2nsc s ARG 12 CO 0.31 -0.39 -0.22 0.08 -0.81 0.00 0.00 175.30 174.27 2nsc s VAL 13 N 2.33 1.89 -0.23 7.11 1.01 -1.26 0.02 120.40 131.27 2nsc s VAL 13 Ca 0.21 -0.95 -0.08 0.00 0.00 0.00 0.00 61.98 61.16 2nsc s VAL 13 Cb -0.16 -1.63 -0.04 0.00 0.00 0.00 0.00 36.38 34.56 2nsc s VAL 13 CO 0.10 0.53 0.08 -0.69 0.00 0.00 0.00 175.10 175.11 2nsc s VAL 14 N 0.17 4.61 -0.04 2.92 1.01 -0.22 -5.01 120.40 123.84 2nsc s VAL 14 Ca -0.12 -0.08 0.05 0.00 0.00 0.00 0.00 61.98 61.83 2nsc s VAL 14 Cb -0.16 -3.13 -0.01 0.00 0.00 0.00 0.00 36.38 33.09 2nsc s VAL 14 CO 0.06 0.37 -0.19 -0.76 0.00 0.00 0.00 175.10 174.59 2nsc s LEU 15 N 1.16 1.97 -0.26 3.92 1.43 -1.26 -0.36 118.68 125.28 2nsc s LEU 15 Ca 0.05 -0.37 -0.04 0.00 -1.03 0.00 0.00 54.13 52.74 2nsc s LEU 15 Cb -0.14 -1.03 0.02 0.00 0.03 0.00 0.00 46.19 45.06 2nsc s LEU 15 CO 0.04 0.19 0.00 -0.70 0.23 0.00 0.00 176.35 176.11 2nsc s GLU 16 N -0.13 3.00 -0.21 1.70 2.12 0.29 -4.92 118.70 120.55 2nsc s GLU 16 Ca -0.01 -0.89 -0.15 0.00 0.36 0.00 0.00 54.97 54.29 2nsc s GLU 16 Cb -0.11 -3.15 -0.04 0.00 0.26 0.00 0.00 34.13 31.09 2nsc s GLU 16 CO 0.02 -0.40 0.35 0.71 -0.54 0.00 0.00 175.26 175.40 2nsc s TYR 17 N 1.41 3.36 -0.18 5.30 2.02 -1.26 -0.95 117.35 127.05 2nsc s TYR 17 Ca 0.02 0.54 -0.02 0.00 -0.37 0.00 0.00 57.07 57.23 2nsc s TYR 17 Cb -0.17 -2.48 -0.01 0.00 -0.40 0.00 0.00 41.96 38.91 2nsc s TYR 17 CO -0.01 -0.00 -0.09 0.08 -1.57 0.00 0.00 175.55 173.95 2nsc s VAL 18 N 1.29 3.16 -0.10 0.71 1.01 -0.12 -4.99 120.40 121.36 2nsc s VAL 18 Ca 0.17 -0.59 -0.05 0.00 0.00 0.00 0.00 61.98 61.51 2nsc s VAL 18 Cb -0.15 -2.39 -0.04 0.00 0.00 0.00 0.00 36.38 33.81 2nsc s VAL 18 CO 0.07 0.48 0.11 -0.36 0.00 0.00 0.00 175.10 175.40 2nsc s PHE 19 N 0.97 3.48 0.70 5.22 0.08 -1.26 -1.09 117.98 126.08 2nsc s PHE 19 Ca -0.01 0.42 -0.06 0.00 0.12 0.00 0.00 56.93 57.41 2nsc s PHE 19 Cb -0.15 -1.89 0.07 0.00 -0.57 0.00 0.00 43.02 40.49 2nsc s PHE 19 CO -0.01 0.66 1.00 0.20 -0.10 0.00 0.00 175.22 176.98 2nsc s GLY 20 N -1.09 1.72 0.39 4.36 0.00 -1.26 -4.89 107.32 106.55 2nsc s GLY 20 Ca 0.16 -1.07 0.11 0.00 0.00 0.00 0.00 44.72 43.91 2nsc s GLY 20 CO 0.05 -0.64 1.94 0.00 0.00 0.00 0.00 173.10 174.44 2nsc h ALA 21 N -0.58 1.90 -0.22 3.20 0.00 -1.99 -2.18 119.26 119.39 2nsc h ALA 21 Ca -0.43 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 54.33 2nsc h ALA 21 Cb 1.30 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.97 2nsc h ALA 21 CO 0.56 -0.06 -0.39 1.49 0.00 0.00 0.00 179.25 180.84 2nsc h GLU 22 N 0.58 0.66 -0.60 0.00 4.57 -1.99 -2.08 114.58 115.71 2nsc h GLU 22 Ca 0.34 -0.41 -0.08 0.00 -1.18 0.00 0.00 59.36 58.03 2nsc h GLU 22 Cb 0.55 0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 29.16 2nsc h GLU 22 CO -0.12 1.03 0.08 0.93 -1.18 0.00 0.00 179.01 179.75 2nsc h GLU 23 N 0.37 0.99 -0.13 1.92 5.08 -1.89 -0.89 114.58 120.03 2nsc h GLU 23 Ca 0.01 -0.26 -0.01 0.00 -1.00 0.00 0.00 59.36 58.11 2nsc h GLU 23 Cb 0.99 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.11 2nsc h GLU 23 CO 0.09 0.93 0.05 0.82 -1.00 0.00 0.00 179.01 179.89 2nsc h ILE 24 N 0.93 1.16 -0.41 3.13 2.04 -1.37 0.23 117.51 123.23 2nsc h ILE 24 Ca 0.18 -0.49 0.01 0.00 1.00 0.00 0.00 64.86 65.56 2nsc h ILE 24 Cb 0.43 1.26 -0.02 0.00 -0.74 0.00 0.00 36.82 37.75 2nsc h ILE 24 CO 0.01 0.15 0.26 0.00 0.00 0.00 0.00 178.15 178.57 2nsc h ALA 25 N 0.87 0.52 -0.76 1.87 0.00 -1.17 0.11 119.26 120.71 2nsc h ALA 25 Ca 0.04 -0.02 0.07 0.00 0.00 0.00 0.00 54.91 55.00 2nsc h ALA 25 Cb 0.19 -0.15 -0.06 0.00 0.00 0.00 0.00 17.79 17.77 2nsc h ALA 25 CO -0.00 -0.05 0.43 1.96 0.00 0.00 0.00 179.25 181.59 2nsc h GLN 26 N 0.53 0.75 -0.37 0.00 4.20 -1.01 -1.04 115.11 118.16 2nsc h GLN 26 Ca 0.15 -0.05 -0.08 0.00 0.06 0.00 0.00 58.65 58.74 2nsc h GLN 26 Cb -0.04 -0.17 -0.01 0.00 0.30 0.00 0.00 27.48 27.56 2nsc h GLN 26 CO -0.05 0.50 -0.08 0.00 -0.67 0.00 0.00 178.83 178.52 2nsc h ALA 27 N 1.40 0.50 -0.70 3.87 0.00 -0.45 -1.76 119.26 122.11 2nsc h ALA 27 Ca 0.35 -0.30 0.09 0.00 0.00 0.00 0.00 54.91 55.04 2nsc h ALA 27 Cb 0.25 -0.13 -0.07 0.00 0.00 0.00 0.00 17.79 17.84 2nsc h ALA 27 CO -0.21 0.35 0.35 0.93 0.00 0.00 0.00 179.25 180.68 2nsc h GLU 28 N 0.50 0.59 -0.88 0.00 5.08 -0.50 -0.50 114.58 118.87 2nsc h GLU 28 Ca 0.09 -0.04 -0.01 0.00 -1.00 0.00 0.00 59.36 58.41 2nsc h GLU 28 Cb 0.59 -0.13 -0.04 0.00 0.50 0.00 0.00 28.75 29.67 2nsc h GLU 28 CO 0.04 0.39 0.51 -0.44 -1.00 0.00 0.00 179.01 178.50 2nsc h ASP 29 N 0.61 1.08 -0.63 1.42 3.32 -0.92 -0.98 116.42 120.32 2nsc h ASP 29 Ca 0.34 -0.08 -0.07 0.00 0.02 0.00 0.00 57.03 57.24 2nsc h ASP 29 Cb 0.34 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.59 2nsc h ASP 29 CO -0.26 0.85 0.13 0.11 -1.72 0.00 0.00 179.24 178.35 2nsc h LYS 30 N 1.22 1.05 -0.61 3.56 1.57 -0.70 -1.84 116.57 120.81 2nsc h LYS 30 Ca 0.31 -0.26 -0.00 0.00 -1.87 0.00 0.00 60.65 58.83 2nsc h LYS 30 Cb -0.01 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.14 2nsc h LYS 30 CO -0.05 0.95 0.37 0.00 -0.57 0.00 0.00 179.45 180.14 2nsc h ALA 31 N 1.14 0.78 -0.16 3.86 0.00 -0.46 0.14 119.26 124.56 2nsc h ALA 31 Ca 0.20 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 2nsc h ALA 31 Cb 0.39 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2nsc h ALA 31 CO 0.01 0.26 0.10 0.28 0.00 0.00 0.00 179.25 179.89 2nsc h VAL 32 N 0.83 1.07 -0.47 0.00 2.07 -1.05 -1.30 116.25 117.40 2nsc h VAL 32 Ca 0.22 -0.16 0.07 0.00 0.82 0.00 0.00 66.70 67.65 2nsc h VAL 32 Cb -0.02 0.89 -0.06 0.00 -1.52 0.00 0.00 31.29 30.58 2nsc h VAL 32 CO -0.04 0.06 0.13 -0.09 0.02 0.00 0.00 177.57 177.65 2nsc h ARG 33 N 0.19 0.27 -0.33 1.57 2.43 -0.98 -1.00 114.38 116.52 2nsc h ARG 33 Ca 0.06 -0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.17 2nsc h ARG 33 Cb 0.02 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.49 2nsc h ARG 33 CO -0.01 0.18 0.04 -0.92 -1.51 0.00 0.00 179.97 177.75 2nsc h TYR 34 N 0.27 0.59 -0.34 2.20 3.20 -0.54 -2.86 116.97 119.49 2nsc h TYR 34 Ca 0.23 -0.09 -0.10 0.00 3.14 0.00 0.00 58.73 61.91 2nsc h TYR 34 Cb 0.28 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.37 2nsc h TYR 34 CO -0.19 0.63 -0.20 -0.07 -1.64 0.00 0.00 178.16 176.69 2nsc h LEU 35 N 0.37 0.65 -0.40 2.82 3.38 -1.02 -2.98 115.31 118.14 2nsc h LEU 35 Ca 0.10 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.85 2nsc h LEU 35 Cb 0.37 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.94 2nsc h LEU 35 CO 0.01 0.85 0.00 0.78 0.09 0.00 0.00 178.44 180.17 2nsc h ASN 36 N 0.57 0.00 1.07 -0.43 2.35 -1.09 0.65 115.58 118.70 2nsc h ASN 36 Ca 0.09 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.84 2nsc h ASN 36 Cb 0.66 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.03 2nsc h ASN 36 CO 0.05 0.00 -0.17 0.00 -1.65 0.00 0.00 177.43 175.65 2nsc n GLN 37 N -2.42 0.14 0.00 0.81 6.02 -1.09 -3.41 117.38 117.43 2nsc n GLN 37 Ca 0.04 0.09 0.00 0.00 -0.01 0.00 0.00 57.00 57.11 2nsc n GLN 37 Cb 0.35 -1.63 0.00 0.00 1.02 0.00 0.00 30.24 29.98 2nsc n GLN 37 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2nsc n ARG 38 N -1.86 2.50 -4.64 -1.09 1.74 -0.77 -5.05 116.66 107.49 2nsc n ARG 38 Ca 0.06 0.00 -0.24 0.00 -0.77 0.00 0.00 57.85 56.89 2nsc n ARG 38 Cb 0.39 -0.78 -0.14 0.00 -1.02 0.00 0.00 32.46 30.90 2nsc n ARG 38 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 2nsc s VAL 39 N -1.17 1.49 -0.12 1.55 -7.23 0.15 -5.09 120.40 109.98 2nsc s VAL 39 Ca 0.00 -1.05 0.01 0.00 -1.81 0.00 0.00 61.98 59.13 2nsc s VAL 39 Cb 0.00 -1.29 0.02 0.00 0.56 0.00 0.00 36.38 35.67 2nsc s VAL 39 CO 0.00 0.21 -0.12 -0.70 -0.31 0.00 0.00 175.10 174.19 2nsc s GLU 40 N -0.97 1.93 0.09 4.82 2.12 -1.26 -4.59 118.70 120.82 2nsc s GLU 40 Ca 0.06 -0.43 0.09 0.00 0.36 0.00 0.00 54.97 55.06 2nsc s GLU 40 Cb -0.08 -1.79 -0.04 0.00 0.26 0.00 0.00 34.13 32.48 2nsc s GLU 40 CO 0.01 -0.18 -0.23 0.96 -0.54 0.00 0.00 175.26 175.28 2nsc s ILE 41 N 1.38 2.47 0.40 -3.70 -4.36 -1.26 -5.10 121.20 111.02 2nsc s ILE 41 Ca 0.00 -1.49 -0.26 0.00 -0.26 0.00 0.00 60.65 58.65 2nsc s ILE 41 Cb -0.13 -2.06 -0.11 0.00 1.25 0.00 0.00 42.46 41.41 2nsc s ILE 41 CO -0.06 0.22 1.23 -2.65 0.24 0.00 0.00 174.94 173.91 2nsc n PRO 42 N 1.24 1.87 -0.04 0.37 -0.02 -1.26 -2.72 135.00 134.44 2nsc n PRO 42 Ca -0.17 0.66 0.00 0.00 -2.02 0.00 0.00 63.50 61.97 2nsc n PRO 42 Cb 0.52 -2.30 0.00 0.00 -0.02 0.00 0.00 33.50 31.71 2nsc n PRO 42 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2nsc n GLY 43 N 0.87 0.64 2.90 -1.23 0.00 -1.26 -5.04 105.19 102.06 2nsc n GLY 43 Ca 0.07 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.91 2nsc n GLY 43 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2nsc s PHE 44 N -2.25 0.58 0.42 1.61 0.08 -1.10 -5.12 117.98 112.18 2nsc s PHE 44 Ca 0.00 -0.12 -0.23 0.00 0.12 0.00 0.00 56.93 56.69 2nsc s PHE 44 Cb 0.00 -0.51 -0.12 0.00 -0.57 0.00 0.00 43.02 41.83 2nsc s PHE 44 CO 0.00 -0.12 0.76 0.54 -0.10 0.00 0.00 175.22 176.29 2nsc n ARG 45 N 3.74 0.89 -1.46 0.44 5.12 -1.26 -4.54 116.66 119.59 2nsc n ARG 45 Ca -0.22 0.32 -0.50 0.00 -1.93 0.00 0.00 57.85 55.52 2nsc n ARG 45 Cb 0.53 -1.73 -0.07 0.00 -1.16 0.00 0.00 32.46 30.03 2nsc n ARG 45 CO 0.00 0.00 0.00 1.17 -1.93 0.00 0.00 177.63 176.87 2nsc n LYS 46 N 0.37 1.15 -0.40 5.56 4.81 -1.26 -1.00 118.16 127.40 2nsc n LYS 46 Ca 0.11 0.31 0.00 0.00 -0.87 0.00 0.00 58.31 57.86 2nsc n LYS 46 Cb 0.39 -2.54 0.00 0.00 0.02 0.00 0.00 35.03 32.90 2nsc n LYS 46 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2nsc n GLY 47 N 6.48 0.79 0.22 3.14 0.00 -1.22 -4.98 105.19 109.62 2nsc n GLY 47 Ca 0.40 -0.13 0.08 0.00 0.00 0.00 0.00 46.02 46.37 2nsc n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2nsc n ARG 48 N -2.40 1.06 -2.29 1.61 5.12 -0.17 -4.94 116.66 114.66 2nsc n ARG 48 Ca 0.00 -2.37 -0.42 0.00 -1.93 0.00 0.00 57.85 53.13 2nsc n ARG 48 Cb 0.00 -1.31 -0.03 0.00 -1.16 0.00 0.00 32.46 29.96 2nsc n ARG 48 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 2nsc s ILE 49 N -2.36 3.93 0.61 0.55 1.01 -1.26 -4.80 121.20 118.87 2nsc s ILE 49 Ca 0.27 1.25 -0.19 0.00 0.00 0.00 0.00 60.65 61.98 2nsc s ILE 49 Cb 0.24 -3.80 -0.02 0.00 0.01 0.00 0.00 42.46 38.89 2nsc s ILE 49 CO 0.01 -0.03 1.31 -2.84 0.00 0.00 0.00 174.94 173.38 2nsc s PRO 50 N 2.72 2.77 0.24 2.79 0.02 -1.26 -4.88 135.00 137.40 2nsc s PRO 50 Ca 0.61 2.09 -0.05 0.00 0.02 0.00 0.00 61.00 63.67 2nsc s PRO 50 Cb -0.28 -1.97 0.45 0.00 0.02 0.00 0.00 34.50 32.71 2nsc s PRO 50 CO 0.24 -1.44 1.69 -0.22 -0.33 0.00 0.00 177.00 176.94 2nsc h LYS 51 N 0.85 0.28 -0.32 5.54 3.64 -1.97 -2.17 116.57 122.41 2nsc h LYS 51 Ca -0.51 -0.02 0.02 0.00 -1.27 0.00 0.00 60.65 58.88 2nsc h LYS 51 Cb 1.32 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 33.06 2nsc h LYS 51 CO 0.54 0.19 0.22 -0.91 -2.27 0.00 0.00 179.45 177.22 2nsc h ASN 52 N 0.29 0.30 -0.03 4.20 2.35 -1.99 -1.52 115.58 119.17 2nsc h ASN 52 Ca 0.41 -0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 56.03 2nsc h ASN 52 Cb 0.68 -0.07 0.01 0.00 0.05 0.00 0.00 38.32 38.98 2nsc h ASN 52 CO -0.49 0.21 -0.44 0.58 -1.65 0.00 0.00 177.43 175.65 2nsc h VAL 53 N 0.35 1.44 -0.22 2.81 2.07 -1.77 -2.60 116.25 118.33 2nsc h VAL 53 Ca 0.13 -1.92 0.02 0.00 0.82 0.00 0.00 66.70 65.75 2nsc h VAL 53 Cb 0.09 2.51 -0.02 0.00 -1.52 0.00 0.00 31.29 32.35 2nsc h VAL 53 CO -0.03 0.55 0.08 -0.07 0.02 0.00 0.00 177.57 178.12 2nsc h LEU 54 N -0.18 0.09 -1.57 2.57 3.38 -1.10 -0.30 115.31 118.20 2nsc h LEU 54 Ca -0.05 0.02 0.06 0.00 0.09 0.00 0.00 57.88 58.01 2nsc h LEU 54 Cb 1.13 0.01 -0.03 0.00 0.09 0.00 0.00 40.66 41.86 2nsc h LEU 54 CO 0.09 0.08 0.38 0.11 0.09 0.00 0.00 178.44 179.19 2nsc h LYS 55 N 0.18 0.51 0.00 1.13 1.57 -1.34 0.06 116.57 118.68 2nsc h LYS 55 Ca 0.10 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.85 2nsc h LYS 55 Cb 0.06 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.26 2nsc h LYS 55 CO -0.10 0.34 -0.00 1.98 -0.57 0.00 0.00 179.45 181.10 2nsc h MET 56 N 0.53 -0.00 0.49 3.15 4.05 -0.99 -1.40 114.93 120.76 2nsc h MET 56 Ca 0.25 0.00 -0.02 0.00 -0.28 0.00 0.00 59.70 59.65 2nsc h MET 56 Cb 0.30 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 31.09 2nsc h MET 56 CO -0.07 0.76 -0.32 0.87 0.23 0.00 0.00 176.91 178.38 2nsc h LYS 57 N -0.77 -0.75 -0.00 0.39 1.79 -0.92 -3.26 116.57 113.05 2nsc h LYS 57 Ca -0.00 0.05 -0.13 0.00 -2.18 0.00 0.00 60.65 58.39 2nsc h LYS 57 Cb 0.76 0.17 -0.02 0.00 -1.58 0.00 0.00 32.23 31.56 2nsc h LYS 57 CO 0.00 -0.50 -0.61 -0.07 -1.08 0.00 0.00 179.45 177.19 2nsc h LEU 58 N -0.78 0.01 0.00 2.94 3.38 -1.13 -3.49 115.31 116.25 2nsc h LEU 58 Ca -0.05 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.91 2nsc h LEU 58 Cb 0.65 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.39 2nsc h LEU 58 CO 0.04 0.62 0.00 0.61 0.09 0.00 0.00 178.44 179.80 2nsc n GLY 59 N 0.23 3.65 0.14 0.83 0.00 -0.53 -2.28 105.19 107.24 2nsc n GLY 59 Ca -0.01 -0.07 0.12 0.00 0.00 0.00 0.00 46.02 46.06 2nsc n GLY 59 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2nsc n GLU 60 N 13.89 0.20 0.21 1.61 1.02 -1.26 -2.15 120.64 134.16 2nsc n GLU 60 Ca 0.00 0.44 0.09 0.00 -0.02 0.00 0.00 57.16 57.66 2nsc n GLU 60 Cb 0.00 -1.89 0.41 0.00 -0.02 0.00 0.00 31.44 29.93 2nsc n GLU 60 CO 0.00 0.00 0.00 1.49 1.18 0.00 0.00 177.13 179.80 2nsc h GLU 61 N 0.00 0.00 -0.67 3.49 4.81 -1.85 -3.15 114.58 117.22 2nsc h GLU 61 Ca 0.00 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.21 2nsc h GLU 61 Cb 0.36 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.71 2nsc h GLU 61 CO 0.00 0.26 0.31 0.35 -0.73 0.00 0.00 179.01 179.21 2nsc h PHE 62 N 0.00 0.94 -0.75 0.92 3.57 -1.59 -2.24 116.94 117.80 2nsc h PHE 62 Ca -0.00 -0.04 0.06 0.00 3.53 0.00 0.00 57.97 61.53 2nsc h PHE 62 Cb 0.82 -0.30 -0.05 0.00 2.79 0.00 0.00 35.95 39.22 2nsc h PHE 62 CO 0.00 0.69 0.49 1.96 -2.23 0.00 0.00 178.31 179.22 2nsc h GLN 63 N 0.94 0.77 -0.64 1.11 4.20 -1.73 -1.69 115.11 118.07 2nsc h GLN 63 Ca 0.23 -0.05 0.01 0.00 0.06 0.00 0.00 58.65 58.90 2nsc h GLN 63 Cb 0.10 -0.17 -0.03 0.00 0.30 0.00 0.00 27.48 27.68 2nsc h GLN 63 CO -0.03 0.51 0.42 0.93 -0.67 0.00 0.00 178.83 179.99 2nsc h GLU 64 N 0.79 0.84 -0.53 1.46 4.39 -1.53 0.18 114.58 120.18 2nsc h GLU 64 Ca 0.32 -0.05 -0.10 0.00 0.34 0.00 0.00 59.36 59.87 2nsc h GLU 64 Cb 0.25 -0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 28.69 2nsc h GLU 64 CO -0.11 0.56 -0.05 1.88 -1.16 0.00 0.00 179.01 180.13 2nsc h TYR 65 N 0.86 1.08 -0.50 4.33 0.05 -1.44 -0.73 116.97 120.62 2nsc h TYR 65 Ca 0.24 -0.21 0.03 0.00 0.05 0.00 0.00 58.73 58.84 2nsc h TYR 65 Cb -0.09 -0.27 -0.04 0.00 1.01 0.00 0.00 36.73 37.34 2nsc h TYR 65 CO -0.03 1.00 0.28 1.15 -1.05 0.00 0.00 178.16 179.50 2nsc h THR 66 N 0.85 1.01 -0.35 -2.88 2.02 -0.85 -2.30 112.91 110.41 2nsc h THR 66 Ca 0.15 -0.19 -0.10 0.00 0.77 0.00 0.00 66.41 67.04 2nsc h THR 66 Cb 0.60 0.41 -0.02 0.00 -1.74 0.00 0.00 68.15 67.40 2nsc h THR 66 CO 0.04 0.10 -0.20 -0.07 0.37 0.00 0.00 175.52 175.75 2nsc h LEU 67 N 0.55 0.67 -0.39 2.58 3.38 -0.45 -1.71 115.31 119.93 2nsc h LEU 67 Ca 0.21 -0.22 0.07 0.00 0.09 0.00 0.00 57.88 58.03 2nsc h LEU 67 Cb 0.07 -0.18 -0.07 0.00 0.09 0.00 0.00 40.66 40.58 2nsc h LEU 67 CO -0.12 0.87 -0.01 0.44 0.09 0.00 0.00 178.44 179.70 2nsc h ASP 68 N 0.59 -0.19 0.58 -0.43 3.32 -0.69 -0.37 116.42 119.24 2nsc h ASP 68 Ca 0.09 0.09 -0.13 0.00 0.02 0.00 0.00 57.03 57.11 2nsc h ASP 68 Cb 0.67 0.17 -0.02 0.00 0.22 0.00 0.00 39.33 40.37 2nsc h ASP 68 CO 0.05 -0.06 -0.59 -0.26 -1.72 0.00 0.00 179.24 176.66 2nsc h PHE 69 N 0.09 0.01 -0.62 4.55 0.04 -1.19 -2.81 116.94 117.00 2nsc h PHE 69 Ca 0.19 -0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.91 2nsc h PHE 69 Cb 0.28 -0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.40 2nsc h PHE 69 CO -0.28 0.60 0.20 -0.07 -0.60 0.00 0.00 178.31 178.16 2nsc h LEU 70 N 0.01 0.90 -1.97 1.54 3.38 -0.77 -2.44 115.31 115.96 2nsc h LEU 70 Ca -0.01 -0.20 0.20 0.00 0.09 0.00 0.00 57.88 57.96 2nsc h LEU 70 Cb 1.05 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.53 2nsc h LEU 70 CO 0.08 0.86 0.51 0.24 0.09 0.00 0.00 178.44 180.22 2nsc h MET 71 N 0.89 0.03 0.00 1.13 2.86 -0.82 -0.20 114.93 118.82 2nsc h MET 71 Ca 0.20 -0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.84 2nsc h MET 71 Cb 0.28 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.93 2nsc h MET 71 CO -0.01 0.02 0.00 -0.25 1.06 0.00 0.00 176.91 177.73 2nsc n ASP 72 N -4.34 0.00 0.10 1.22 8.00 -0.92 -2.21 116.55 118.40 2nsc n ASP 72 Ca 0.14 -0.39 0.12 0.00 0.71 0.00 0.00 54.79 55.37 2nsc n ASP 72 Cb 0.77 -0.10 0.03 0.00 -0.02 0.00 0.00 41.12 41.79 2nsc n ASP 72 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 2nsc h LEU 73 N 0.00 0.00 0.49 0.64 3.38 -1.15 -3.41 115.31 115.26 2nsc h LEU 73 Ca 0.00 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 2nsc h LEU 73 Cb 0.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.82 2nsc h LEU 73 CO 0.00 0.02 -0.24 0.40 0.09 0.00 0.00 178.44 178.71 2nsc h ILE 74 N 0.00 0.26 -1.10 1.22 2.04 -1.59 -3.26 117.51 115.08 2nsc h ILE 74 Ca 0.00 -0.50 0.34 0.00 1.00 0.00 0.00 64.86 65.70 2nsc h ILE 74 Cb 0.96 0.39 -0.13 0.00 -0.74 0.00 0.00 36.82 37.30 2nsc h ILE 74 CO 0.00 0.05 0.67 -0.65 0.00 0.00 0.00 178.15 178.22 2nsc h PRO 75 N -1.06 0.27 0.00 2.37 0.11 -1.80 0.34 132.00 132.23 2nsc h PRO 75 Ca -0.07 -0.02 -0.08 0.00 0.11 0.00 0.00 66.00 65.95 2nsc h PRO 75 Cb 0.59 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 31.63 2nsc h PRO 75 CO 0.11 0.18 -0.36 0.22 -0.21 0.00 0.00 178.00 177.94 2nsc h ASP 76 N 0.28 0.00 0.88 -2.05 1.82 -1.85 -1.72 116.42 113.78 2nsc h ASP 76 Ca 0.73 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 57.37 2nsc h ASP 76 Cb 1.88 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.89 2nsc h ASP 76 CO -0.49 0.36 0.00 0.35 -1.61 0.00 0.00 179.24 177.86 2nsc n THR 77 N -4.03 0.68 0.45 2.25 -2.24 0.12 -3.15 114.28 108.36 2nsc n THR 77 Ca -0.02 0.08 0.05 0.00 -2.27 0.00 0.00 64.05 61.90 2nsc n THR 77 Cb 0.41 -0.88 0.04 0.00 -2.10 0.00 0.00 70.33 67.80 2nsc n THR 77 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2nsc n LEU 78 N -1.93 1.88 0.17 3.22 4.77 -0.68 -4.65 117.00 119.78 2nsc n LEU 78 Ca 0.04 -0.99 0.12 0.00 -0.03 0.00 0.00 56.01 55.15 2nsc n LEU 78 Cb 0.28 0.00 0.61 0.00 -2.33 0.00 0.00 43.42 41.98 2nsc n LEU 78 CO 0.22 0.36 0.86 0.07 -1.33 0.00 0.00 177.39 177.57 2nsc h LYS 79 N 2.09 0.00 -0.01 3.23 2.10 -1.43 0.16 116.57 122.72 2nsc h LYS 79 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2nsc h LYS 79 Cb 0.45 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.78 2nsc h LYS 79 CO 0.00 0.00 -0.16 -0.40 -2.00 0.00 0.00 179.45 176.89 2nsc n ASP 80 N -2.33 0.72 -4.77 7.07 5.75 -1.26 -4.87 116.55 116.85 2nsc n ASP 80 Ca -0.01 -0.75 -0.31 0.00 -0.01 0.00 0.00 54.79 53.72 2nsc n ASP 80 Cb 0.09 0.01 -0.07 0.00 -1.03 0.00 0.00 41.12 40.12 2nsc n ASP 80 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 2nsc s ARG 81 N -2.45 2.93 -0.43 0.11 0.52 0.04 -5.08 118.95 114.58 2nsc s ARG 81 Ca 0.28 -0.64 -0.18 0.00 -0.52 0.00 0.00 55.73 54.68 2nsc s ARG 81 Cb 0.20 -2.76 0.03 0.00 0.52 0.00 0.00 34.95 32.94 2nsc s ARG 81 CO 0.48 0.59 0.46 0.21 0.02 0.00 0.00 175.30 177.06 2nsc s LYS 82 N -2.22 3.10 0.03 3.54 2.20 -1.26 -5.04 119.74 120.09 2nsc s LYS 82 Ca 0.28 -0.79 0.08 0.00 -0.36 0.00 0.00 55.97 55.17 2nsc s LYS 82 Cb -0.12 -3.99 -0.02 0.00 -1.51 0.00 0.00 37.83 32.18 2nsc s LYS 82 CO 0.20 -0.91 -0.22 -0.51 -0.36 0.00 0.00 175.35 173.55 2nsc s LEU 83 N 2.19 2.14 0.05 5.43 1.43 -1.26 -5.05 118.68 123.61 2nsc s LEU 83 Ca 0.12 -0.51 -0.18 0.00 -1.03 0.00 0.00 54.13 52.53 2nsc s LEU 83 Cb -0.18 -1.09 -0.14 0.00 0.03 0.00 0.00 46.19 44.81 2nsc s LEU 83 CO 0.13 0.21 1.32 0.40 0.23 0.00 0.00 176.35 178.64 2nsc h ILE 84 N 4.38 1.35 -1.76 -0.59 1.08 -1.98 -3.47 117.51 116.51 2nsc h ILE 84 Ca -0.43 -1.53 -0.61 0.00 -0.39 0.00 0.00 64.86 61.90 2nsc h ILE 84 Cb 1.15 1.93 -0.13 0.00 -3.07 0.00 0.00 36.82 36.70 2nsc h ILE 84 CO 0.45 0.46 -0.60 -0.76 -0.69 0.00 0.00 178.15 177.01 2nsc s LEU 85 N -8.89 2.79 0.59 1.44 1.43 -1.26 -5.12 118.68 109.66 2nsc s LEU 85 Ca -0.13 -1.38 -0.16 0.00 -1.03 0.00 0.00 54.13 51.43 2nsc s LEU 85 Cb 0.06 -0.84 -0.03 0.00 0.03 0.00 0.00 46.19 45.41 2nsc s LEU 85 CO 0.80 -0.48 1.07 -0.44 0.23 0.00 0.00 176.35 177.53 2nsc s SER 86 N -3.69 5.67 0.37 2.29 0.01 -1.26 -4.98 113.70 112.12 2nsc s SER 86 Ca 0.35 1.90 -0.28 0.00 1.31 0.00 0.00 55.95 59.23 2nsc s SER 86 Cb 0.10 -2.54 -0.11 0.00 0.21 0.00 0.00 66.02 63.67 2nsc s SER 86 CO 0.17 -1.24 1.42 -2.65 0.41 0.00 0.00 173.24 171.35 2nsc n PRO 87 N -1.95 2.46 -3.67 12.44 -0.02 -1.26 -4.97 135.00 138.03 2nsc n PRO 87 Ca 0.09 0.86 -0.37 0.00 -2.02 0.00 0.00 63.50 62.07 2nsc n PRO 87 Cb 0.52 -2.55 -0.11 0.00 -0.02 0.00 0.00 33.50 31.35 2nsc n PRO 87 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2nsc s ILE 88 N -1.12 5.17 -0.19 4.25 1.01 -1.26 -5.06 121.20 124.00 2nsc s ILE 88 Ca 0.55 0.12 -0.29 0.00 0.00 0.00 0.00 60.65 61.02 2nsc s ILE 88 Cb -0.50 -3.43 -0.00 0.00 0.01 0.00 0.00 42.46 38.54 2nsc s ILE 88 CO 0.63 0.31 1.09 -0.69 0.00 0.00 0.00 174.94 176.28 2nsc s VAL 89 N 1.37 4.60 -0.37 2.92 1.01 -1.26 -4.90 120.40 123.77 2nsc s VAL 89 Ca 0.07 1.92 0.11 0.00 0.00 0.00 0.00 61.98 64.07 2nsc s VAL 89 Cb -0.15 -4.24 -0.13 0.00 0.00 0.00 0.00 36.38 31.87 2nsc s VAL 89 CO 0.07 -0.13 0.39 0.35 0.00 0.00 0.00 175.10 175.78 2nsc n THR 90 N 5.17 0.00 -3.61 3.92 -2.24 -1.26 -5.01 114.28 111.25 2nsc n THR 90 Ca 0.12 -0.25 -0.15 0.00 -2.27 0.00 0.00 64.05 61.50 2nsc n THR 90 Cb 0.46 0.81 -0.07 0.00 -2.10 0.00 0.00 70.33 69.43 2nsc n THR 90 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2nsc s GLU 91 N -2.19 0.87 0.03 -0.78 2.12 -1.26 -5.17 118.70 112.32 2nsc s GLU 91 Ca 0.02 0.84 0.02 0.00 0.36 0.00 0.00 54.97 56.21 2nsc s GLU 91 Cb 0.08 0.42 -0.02 0.00 0.26 0.00 0.00 34.13 34.87 2nsc s GLU 91 CO 0.44 -0.15 -0.07 1.03 -0.54 0.00 0.00 175.26 175.97 2nsc s ARG 92 N 0.05 0.53 -0.27 4.30 0.52 -1.26 -5.09 118.95 117.73 2nsc s ARG 92 Ca -0.02 -0.55 -0.16 0.00 -0.52 0.00 0.00 55.73 54.47 2nsc s ARG 92 Cb -0.04 -0.40 0.08 0.00 0.52 0.00 0.00 34.95 35.11 2nsc s ARG 92 CO 0.03 0.09 0.66 -2.00 0.02 0.00 0.00 175.30 174.10 2nsc s GLU 93 N -1.02 0.69 -0.07 3.54 2.12 -1.26 -5.15 118.70 117.56 2nsc s GLU 93 Ca -0.05 1.16 0.02 0.00 0.36 0.00 0.00 54.97 56.46 2nsc s GLU 93 Cb -0.07 0.14 0.02 0.00 0.26 0.00 0.00 34.13 34.48 2nsc s GLU 93 CO 0.00 -0.15 -0.10 -1.17 -0.54 0.00 0.00 175.26 173.31 2nsc s LEU 94 N 1.51 1.51 -0.20 2.70 0.20 -1.26 -5.09 118.68 118.05 2nsc s LEU 94 Ca -0.09 -0.26 -0.01 0.00 0.69 0.00 0.00 54.13 54.45 2nsc s LEU 94 Cb -0.05 -0.75 0.00 0.00 -0.43 0.00 0.00 46.19 44.96 2nsc s LEU 94 CO -0.18 -0.01 -0.12 -0.54 -0.29 0.00 0.00 176.35 175.22 2nsc s LYS 95 N 0.87 3.20 0.93 1.98 -0.14 -1.26 -5.12 119.74 120.20 2nsc s LYS 95 Ca -0.11 -0.72 -0.11 0.00 -1.36 0.00 0.00 55.97 53.67 2nsc s LYS 95 Cb -0.15 -2.79 0.15 0.00 -1.68 0.00 0.00 37.83 33.36 2nsc s LYS 95 CO 0.01 -0.19 1.10 -0.51 -0.76 0.00 0.00 175.35 175.00 2nsc s ASP 96 N 1.35 3.02 0.38 2.83 1.01 -1.26 -4.92 116.67 119.09 2nsc s ASP 96 Ca 0.05 1.79 -0.26 0.00 0.71 0.00 0.00 52.55 54.84 2nsc s ASP 96 Cb -0.14 -2.39 -0.11 0.00 1.01 0.00 0.00 42.92 41.29 2nsc s ASP 96 CO -0.07 -2.97 1.13 0.55 0.21 0.00 0.00 175.17 174.02 2nsc n VAL 97 N -4.12 2.31 -3.92 -1.27 3.14 -1.26 -4.99 118.33 108.21 2nsc n VAL 97 Ca 0.08 -0.50 -0.09 0.00 -2.96 0.00 0.00 64.34 60.87 2nsc n VAL 97 Cb 0.54 -1.32 -0.09 0.00 -1.06 0.00 0.00 33.84 31.91 2nsc n VAL 97 CO 0.00 0.00 0.00 0.28 -6.46 0.00 0.00 176.83 170.65 2nsc s THR 98 N -1.18 0.14 -0.04 1.55 -1.32 -1.26 -5.17 115.64 108.36 2nsc s THR 98 Ca 0.60 -1.19 -0.16 0.00 -1.21 0.00 0.00 61.69 59.74 2nsc s THR 98 Cb -0.57 -1.09 0.03 0.00 -1.51 0.00 0.00 72.50 69.35 2nsc s THR 98 CO 0.59 -0.66 0.35 0.00 -2.21 0.00 0.00 174.62 172.69 2nsc s ALA 99 N -3.10 -0.88 -0.09 11.08 0.00 -1.26 -5.16 121.76 122.34 2nsc s ALA 99 Ca -0.01 0.54 -0.08 0.00 0.00 0.00 0.00 51.96 52.42 2nsc s ALA 99 Cb 0.02 -0.07 0.03 0.00 0.00 0.00 0.00 23.12 23.10 2nsc s ALA 99 CO -0.07 -0.25 0.24 0.50 0.00 0.00 0.00 175.76 176.18 2nsc s ARG 100 N -1.01 0.27 -0.05 0.00 3.52 -1.26 -5.15 118.95 115.27 2nsc s ARG 100 Ca -0.11 0.38 0.01 0.00 -0.13 0.00 0.00 55.73 55.89 2nsc s ARG 100 Cb -0.04 0.08 0.02 0.00 -1.56 0.00 0.00 34.95 33.45 2nsc s ARG 100 CO 0.04 -0.06 -0.06 0.08 -0.81 0.00 0.00 175.30 174.49 2nsc s VAL 101 N 0.37 0.67 -0.21 7.11 1.01 -1.26 -5.13 120.40 122.96 2nsc s VAL 101 Ca -0.02 -0.20 -0.08 0.00 0.00 0.00 0.00 61.98 61.68 2nsc s VAL 101 Cb -0.04 -0.67 -0.04 0.00 0.00 0.00 0.00 36.38 35.64 2nsc s VAL 101 CO -0.02 0.25 0.07 -0.69 0.00 0.00 0.00 175.10 174.72 2nsc s VAL 102 N 0.86 4.65 0.20 2.92 1.01 -1.26 -5.10 120.40 123.68 2nsc s VAL 102 Ca -0.12 -0.07 0.11 0.00 0.00 0.00 0.00 61.98 61.89 2nsc s VAL 102 Cb -0.15 -3.13 -0.04 0.00 0.00 0.00 0.00 36.38 33.06 2nsc s VAL 102 CO 0.01 0.40 -0.21 0.68 0.00 0.00 0.00 175.10 175.98 2nsc s VAL 103 N 0.89 2.20 -0.07 2.92 -7.23 -1.26 -5.14 120.40 112.70 2nsc s VAL 103 Ca 0.04 -2.09 0.03 0.00 -1.81 0.00 0.00 61.98 58.15 2nsc s VAL 103 Cb -0.14 -2.08 -0.02 0.00 0.56 0.00 0.00 36.38 34.71 2nsc s VAL 103 CO 0.03 -0.25 -0.15 -1.61 -0.31 0.00 0.00 175.10 172.80 2nsc s GLU 104 N -2.92 2.72 0.13 4.82 2.02 -1.26 -5.13 118.70 119.07 2nsc s GLU 104 Ca 0.21 -0.72 0.08 0.00 0.02 0.00 0.00 54.97 54.56 2nsc s GLU 104 Cb -0.06 -2.41 -0.04 0.00 0.10 0.00 0.00 34.13 31.72 2nsc s GLU 104 CO 0.10 0.50 -0.17 0.14 0.02 0.00 0.00 175.26 175.84 2nsc s VAL 105 N -0.40 1.63 -0.27 2.63 -7.23 -1.26 -5.12 120.40 110.37 2nsc s VAL 105 Ca 0.04 -1.75 0.02 0.00 -1.81 0.00 0.00 61.98 58.49 2nsc s VAL 105 Cb -0.12 -1.65 0.07 0.00 0.56 0.00 0.00 36.38 35.24 2nsc s VAL 105 CO 0.02 -0.28 -0.05 -1.00 -0.31 0.00 0.00 175.10 173.48 2nsc s HIS 106 N -1.83 3.05 0.31 2.82 3.76 -1.26 -5.11 115.29 117.03 2nsc s HIS 106 Ca 0.11 -2.27 -0.28 0.00 -0.15 0.00 0.00 55.06 52.46 2nsc s HIS 106 Cb -0.07 -2.02 -0.09 0.00 1.11 0.00 0.00 32.58 31.51 2nsc s HIS 106 CO 0.05 -0.86 1.08 -1.21 -0.85 0.00 0.00 174.74 172.94 2nsc s GLU 107 N 1.17 4.51 0.15 1.40 2.02 -1.26 -4.99 118.70 121.71 2nsc s GLU 107 Ca -0.03 1.71 -0.34 0.00 0.02 0.00 0.00 54.97 56.33 2nsc s GLU 107 Cb -0.19 -3.01 -0.14 0.00 0.10 0.00 0.00 34.13 30.88 2nsc s GLU 107 CO -0.07 0.13 1.52 -1.91 0.02 0.00 0.00 175.26 174.95 2nsc n GLU 108 N 0.85 1.96 0.00 1.61 4.07 -1.26 -5.37 120.64 122.50 2nsc n GLU 108 Ca 0.01 0.71 0.14 0.00 -0.06 0.00 0.00 57.16 57.96 2nsc n GLU 108 Cb 0.46 -2.45 0.85 0.00 -0.06 0.00 0.00 31.44 30.24 2nsc n GLU 108 CO 0.00 0.00 0.00 -0.35 -0.06 0.00 0.00 177.13 176.72