#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mvo n ASN 2 N 0.00 -0.29 -4.79 7.83 3.02 -1.26 -5.01 115.26 114.77 1mvo n ASN 2 Ca 0.00 1.15 -0.34 0.00 -0.03 0.00 0.00 54.58 55.35 1mvo n ASN 2 Cb 0.00 -1.05 -0.01 0.00 -0.61 0.00 0.00 39.78 38.10 1mvo n ASN 2 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1mvo s LYS 3 N -0.99 3.54 -0.17 3.52 -0.14 -1.26 -4.74 119.74 119.50 1mvo s LYS 3 Ca 0.66 1.47 -0.02 0.00 -1.36 0.00 0.00 55.97 56.72 1mvo s LYS 3 Cb -0.90 -2.04 -0.02 0.00 -1.68 0.00 0.00 37.83 33.19 1mvo s LYS 3 CO 0.57 -0.67 -0.08 0.21 -0.76 0.00 0.00 175.35 174.62 1mvo s LYS 4 N -3.33 3.47 -0.14 1.68 2.20 -1.26 -1.06 119.74 121.30 1mvo s LYS 4 Ca 0.70 -0.62 -0.01 0.00 -0.36 0.00 0.00 55.97 55.68 1mvo s LYS 4 Cb -0.20 -2.83 -0.02 0.00 -1.51 0.00 0.00 37.83 33.27 1mvo s LYS 4 CO 0.25 0.09 -0.10 0.42 -0.36 0.00 0.00 175.35 175.65 1mvo s ILE 5 N 0.71 3.28 -0.30 5.43 1.01 0.54 -0.46 121.20 131.42 1mvo s ILE 5 Ca -0.04 -0.58 -0.16 0.00 0.00 0.00 0.00 60.65 59.87 1mvo s ILE 5 Cb -0.15 -2.40 -0.02 0.00 0.01 0.00 0.00 42.46 39.90 1mvo s ILE 5 CO 0.02 0.51 0.43 -0.22 0.00 0.00 0.00 174.94 175.68 1mvo s LEU 6 N 0.40 4.16 -0.18 2.97 2.96 -0.39 -1.26 118.68 127.34 1mvo s LEU 6 Ca -0.08 0.19 -0.05 0.00 -0.22 0.00 0.00 54.13 53.96 1mvo s LEU 6 Cb -0.15 -2.49 -0.03 0.00 0.50 0.00 0.00 46.19 44.01 1mvo s LEU 6 CO 0.05 -0.29 -0.00 -0.69 -1.32 0.00 0.00 176.35 174.10 1mvo s VAL 7 N 2.18 4.12 -0.18 1.68 1.01 0.07 -0.76 120.40 128.51 1mvo s VAL 7 Ca 0.16 -0.27 -0.02 0.00 0.00 0.00 0.00 61.98 61.86 1mvo s VAL 7 Cb -0.16 -2.84 0.05 0.00 0.00 0.00 0.00 36.38 33.44 1mvo s VAL 7 CO 0.11 0.46 0.01 -0.69 0.00 0.00 0.00 175.10 174.99 1mvo s VAL 8 N 0.61 0.72 -0.12 2.92 1.01 0.15 -1.01 120.40 124.69 1mvo s VAL 8 Ca -0.01 -0.59 -0.23 0.00 0.00 0.00 0.00 61.98 61.16 1mvo s VAL 8 Cb -0.14 -1.12 0.05 0.00 0.00 0.00 0.00 36.38 35.18 1mvo s VAL 8 CO 0.02 -0.11 0.56 -0.62 0.00 0.00 0.00 175.10 174.95 1mvo s ASP 9 N 1.78 -0.54 0.00 3.32 -1.08 -1.00 -1.56 116.67 117.60 1mvo s ASP 9 Ca -0.01 0.79 0.28 0.00 -0.52 0.00 0.00 52.55 53.09 1mvo s ASP 9 Cb -0.17 0.78 1.16 0.00 -1.46 0.00 0.00 42.92 43.24 1mvo s ASP 9 CO -0.07 -0.39 1.84 -0.90 0.52 0.00 0.00 175.17 176.16 1mvo n ASP 10 N 1.82 0.32 -4.58 -0.34 5.68 -1.25 -4.30 116.55 113.90 1mvo n ASP 10 Ca -0.17 -0.26 -0.41 0.00 -0.50 0.00 0.00 54.79 53.46 1mvo n ASP 10 Cb 0.56 -0.14 -0.08 0.00 -1.14 0.00 0.00 41.12 40.32 1mvo n ASP 10 CO 0.00 0.00 0.00 -1.61 -1.33 0.00 0.00 177.20 174.26 1mvo s GLU 11 N -2.67 3.77 0.23 0.11 0.41 -1.26 -4.95 118.70 114.34 1mvo s GLU 11 Ca 0.23 -0.05 -0.08 0.00 -0.41 0.00 0.00 54.97 54.67 1mvo s GLU 11 Cb 0.19 -3.75 0.21 0.00 -1.78 0.00 0.00 34.13 29.00 1mvo s GLU 11 CO 0.52 -0.52 1.88 0.93 -0.49 0.00 0.00 175.26 177.58 1mvo h GLU 12 N 8.32 1.21 -0.87 1.61 5.08 -2.00 -1.41 114.58 126.52 1mvo h GLU 12 Ca -0.29 -0.11 0.04 0.00 -1.00 0.00 0.00 59.36 58.00 1mvo h GLU 12 Cb 1.14 -0.25 -0.05 0.00 0.50 0.00 0.00 28.75 30.08 1mvo h GLU 12 CO 0.73 0.84 0.57 0.66 -1.00 0.00 0.00 179.01 180.82 1mvo h SER 13 N 1.22 0.92 -0.37 1.42 4.64 -1.97 -0.00 113.55 119.41 1mvo h SER 13 Ca 0.32 -0.01 -0.10 0.00 -0.47 0.00 0.00 61.79 61.53 1mvo h SER 13 Cb -0.06 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 61.81 1mvo h SER 13 CO -0.06 0.63 -0.17 0.40 -0.87 0.00 0.00 176.83 176.76 1mvo h ILE 14 N 1.07 1.28 -0.47 0.95 1.08 -1.68 -2.04 117.51 117.71 1mvo h ILE 14 Ca 0.35 -1.29 -0.03 0.00 -0.39 0.00 0.00 64.86 63.50 1mvo h ILE 14 Cb 0.05 1.33 -0.02 0.00 -3.07 0.00 0.00 36.82 35.11 1mvo h ILE 14 CO -0.11 0.43 0.17 0.58 -0.69 0.00 0.00 178.15 178.53 1mvo h VAL 15 N 0.57 1.22 -0.53 1.67 2.07 -0.99 -1.29 116.25 118.96 1mvo h VAL 15 Ca 0.08 -0.69 0.01 0.00 0.82 0.00 0.00 66.70 66.92 1mvo h VAL 15 Cb 0.71 0.78 -0.03 0.00 -1.52 0.00 0.00 31.29 31.24 1mvo h VAL 15 CO 0.05 0.25 0.35 0.74 0.02 0.00 0.00 177.57 178.99 1mvo h THR 16 N 0.62 1.14 -0.08 2.57 2.02 -0.94 -0.19 112.91 118.05 1mvo h THR 16 Ca 0.16 -0.25 0.02 0.00 0.77 0.00 0.00 66.41 67.11 1mvo h THR 16 Cb 0.23 0.35 -0.02 0.00 -1.74 0.00 0.00 68.15 66.96 1mvo h THR 16 CO -0.01 0.13 -0.06 -0.07 0.37 0.00 0.00 175.52 175.88 1mvo h LEU 17 N 0.72 -0.20 -0.35 2.58 3.38 -1.19 -0.96 115.31 119.29 1mvo h LEU 17 Ca 0.20 0.04 -0.05 0.00 0.09 0.00 0.00 57.88 58.16 1mvo h LEU 17 Cb -0.08 0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.76 1mvo h LEU 17 CO -0.04 -0.09 0.03 -0.07 0.09 0.00 0.00 178.44 178.36 1mvo h LEU 18 N -0.07 0.57 -0.29 1.67 3.38 -1.01 -1.94 115.31 117.62 1mvo h LEU 18 Ca 0.05 -0.28 -0.02 0.00 0.09 0.00 0.00 57.88 57.73 1mvo h LEU 18 Cb 0.15 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1mvo h LEU 18 CO -0.12 0.71 0.11 -0.61 0.09 0.00 0.00 178.44 178.61 1mvo h GLN 19 N 0.41 0.44 0.00 1.13 4.15 -0.92 -0.64 115.11 119.68 1mvo h GLN 19 Ca 0.10 -0.08 0.01 0.00 0.77 0.00 0.00 58.65 59.45 1mvo h GLN 19 Cb 0.39 -0.07 -0.01 0.00 0.21 0.00 0.00 27.48 28.00 1mvo h GLN 19 CO 0.01 0.47 -0.06 -0.92 -1.93 0.00 0.00 178.83 176.39 1mvo h TYR 20 N 0.32 -0.16 -0.40 3.99 3.20 -1.01 -0.88 116.97 122.03 1mvo h TYR 20 Ca 0.10 0.01 -0.15 0.00 3.14 0.00 0.00 58.73 61.82 1mvo h TYR 20 Cb 0.20 0.07 -0.01 0.00 1.54 0.00 0.00 36.73 38.53 1mvo h TYR 20 CO -0.00 -0.10 -0.34 -0.91 -1.64 0.00 0.00 178.16 175.16 1mvo h ASN 21 N -0.12 1.00 0.09 -2.11 2.35 -1.28 -1.99 115.58 113.51 1mvo h ASN 21 Ca 0.03 -0.45 -0.17 0.00 -0.55 0.00 0.00 56.30 55.15 1mvo h ASN 21 Cb 0.15 -0.28 -0.00 0.00 0.05 0.00 0.00 38.32 38.23 1mvo h ASN 21 CO -0.06 1.24 -0.61 -0.07 -1.65 0.00 0.00 177.43 176.27 1mvo h LEU 22 N 0.76 0.59 -0.68 1.61 3.38 -1.06 -1.51 115.31 118.41 1mvo h LEU 22 Ca 0.07 -0.34 -0.08 0.00 0.09 0.00 0.00 57.88 57.63 1mvo h LEU 22 Cb 0.94 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.49 1mvo h LEU 22 CO 0.09 1.06 0.13 -0.33 0.09 0.00 0.00 178.44 179.47 1mvo h GLU 23 N 0.39 1.11 -0.49 1.13 5.08 -1.13 -1.47 114.58 119.19 1mvo h GLU 23 Ca -0.01 -0.29 -0.01 0.00 -1.00 0.00 0.00 59.36 58.05 1mvo h GLU 23 Cb 1.17 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 30.26 1mvo h GLU 23 CO 0.11 1.01 0.25 -0.09 -1.00 0.00 0.00 179.01 179.29 1mvo h ARG 24 N 1.04 0.68 0.00 2.33 2.43 -1.09 -0.91 114.38 118.86 1mvo h ARG 24 Ca 0.21 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.30 1mvo h ARG 24 Cb 0.42 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.84 1mvo h ARG 24 CO 0.01 0.52 0.00 0.43 -1.51 0.00 0.00 179.97 179.42 1mvo n SER 25 N -4.39 0.00 0.00 -3.80 7.64 -0.59 -4.89 113.62 107.58 1mvo n SER 25 Ca 0.04 -0.95 0.00 0.00 1.01 0.00 0.00 58.87 58.97 1mvo n SER 25 Cb 0.11 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.31 1mvo n SER 25 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1mvo n GLY 26 N 0.89 1.02 3.86 0.23 0.00 -0.34 -5.06 105.19 105.77 1mvo n GLY 26 Ca 0.22 -0.29 -0.26 0.00 0.00 0.00 0.00 46.02 45.69 1mvo n GLY 26 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1mvo s TYR 27 N -2.00 3.28 0.12 1.61 1.51 -0.59 -4.54 117.35 116.74 1mvo s TYR 27 Ca 0.00 0.03 -0.19 0.00 -1.01 0.00 0.00 57.07 55.90 1mvo s TYR 27 Cb 0.00 -1.57 -0.07 0.00 -0.11 0.00 0.00 41.96 40.21 1mvo s TYR 27 CO 0.00 0.52 0.61 -0.51 -1.11 0.00 0.00 175.55 175.06 1mvo s ASP 28 N -3.16 7.05 -0.04 2.29 1.01 -0.22 -4.09 116.67 119.50 1mvo s ASP 28 Ca 0.32 1.29 0.03 0.00 0.71 0.00 0.00 52.55 54.91 1mvo s ASP 28 Cb -0.10 -2.37 0.00 0.00 1.01 0.00 0.00 42.92 41.46 1mvo s ASP 28 CO 0.25 0.20 -0.14 -0.69 0.21 0.00 0.00 175.17 175.00 1mvo s VAL 29 N -1.25 1.23 0.21 -1.27 1.01 -1.26 -0.34 120.40 118.72 1mvo s VAL 29 Ca 0.34 -0.59 0.10 0.00 0.00 0.00 0.00 61.98 61.83 1mvo s VAL 29 Cb -0.19 -1.07 -0.04 0.00 0.00 0.00 0.00 36.38 35.08 1mvo s VAL 29 CO 0.20 0.36 -0.21 0.27 0.00 0.00 0.00 175.10 175.73 1mvo s ILE 30 N 0.21 2.19 0.09 2.22 -4.36 -0.39 -4.96 121.20 116.20 1mvo s ILE 30 Ca -0.06 -2.10 0.03 0.00 -0.26 0.00 0.00 60.65 58.26 1mvo s ILE 30 Cb -0.12 -2.08 -0.04 0.00 1.25 0.00 0.00 42.46 41.48 1mvo s ILE 30 CO 0.02 -0.27 -0.09 0.42 0.24 0.00 0.00 174.94 175.27 1mvo s THR 31 N -2.05 0.85 0.01 8.37 -4.23 -1.26 -0.75 115.64 116.58 1mvo s THR 31 Ca 0.21 -1.67 -0.06 0.00 -1.18 0.00 0.00 61.69 59.00 1mvo s THR 31 Cb -0.06 -1.37 -0.00 0.00 1.34 0.00 0.00 72.50 72.40 1mvo s THR 31 CO 0.10 -0.62 0.11 0.00 -0.54 0.00 0.00 174.62 173.67 1mvo s ALA 32 N -2.64 -0.24 -0.75 3.99 0.00 -0.18 -4.92 121.76 117.02 1mvo s ALA 32 Ca 0.06 -0.24 0.06 0.00 0.00 0.00 0.00 51.96 51.84 1mvo s ALA 32 Cb -0.01 0.13 0.07 0.00 0.00 0.00 0.00 23.12 23.31 1mvo s ALA 32 CO -0.01 -0.21 0.78 -1.13 0.00 0.00 0.00 175.76 175.19 1mvo n SER 33 N 1.39 1.71 -3.86 0.00 3.41 -1.26 -2.38 113.62 112.63 1mvo n SER 33 Ca -0.23 -1.40 -0.09 0.00 -0.26 0.00 0.00 58.87 56.90 1mvo n SER 33 Cb 0.56 -0.02 -0.05 0.00 -0.26 0.00 0.00 64.21 64.44 1mvo n SER 33 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 175.04 176.39 1mvo s ASP 34 N -0.61 -0.15 0.36 4.04 3.84 -1.26 -3.95 116.67 118.93 1mvo s ASP 34 Ca 0.08 -0.69 0.18 0.00 -0.00 0.00 0.00 52.55 52.12 1mvo s ASP 34 Cb 0.06 0.57 0.61 0.00 -1.38 0.00 0.00 42.92 42.77 1mvo s ASP 34 CO 0.08 -1.07 1.70 1.23 -0.00 0.00 0.00 175.17 177.11 1mvo h GLY 35 N 2.26 0.00 0.70 2.12 0.00 -1.21 -1.43 103.07 105.51 1mvo h GLY 35 Ca -0.28 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.04 1mvo h GLY 35 CO 0.38 0.00 -0.02 1.05 0.00 0.00 0.00 176.54 177.95 1mvo h GLU 36 N 0.00 0.15 -0.65 4.80 4.11 -1.81 -0.99 114.58 120.18 1mvo h GLU 36 Ca -0.00 -0.05 0.01 0.00 0.07 0.00 0.00 59.36 59.38 1mvo h GLU 36 Cb 0.95 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.16 1mvo h GLU 36 CO 0.05 0.47 0.43 1.49 0.07 0.00 0.00 179.01 181.51 1mvo h GLU 37 N -0.19 0.86 -0.36 1.06 4.81 -1.94 -2.30 114.58 116.51 1mvo h GLU 37 Ca 0.02 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1mvo h GLU 37 Cb 0.41 -0.19 -0.02 0.00 0.63 0.00 0.00 28.75 29.58 1mvo h GLU 37 CO 0.01 0.57 0.23 0.00 -0.73 0.00 0.00 179.01 179.09 1mvo h ALA 38 N 1.23 0.46 -0.63 2.92 0.00 -1.13 -0.67 119.26 121.44 1mvo h ALA 38 Ca 0.24 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 55.05 1mvo h ALA 38 Cb -0.09 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 1mvo h ALA 38 CO -0.05 -0.07 0.14 1.25 0.00 0.00 0.00 179.25 180.53 1mvo h LEU 39 N 0.48 0.93 -0.15 0.00 5.85 -1.01 -1.07 115.31 120.34 1mvo h LEU 39 Ca 0.13 -0.19 -0.02 0.00 0.84 0.00 0.00 57.88 58.64 1mvo h LEU 39 Cb -0.03 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 40.75 1mvo h LEU 39 CO -0.03 0.91 -0.00 0.50 -0.34 0.00 0.00 178.44 179.48 1mvo h LYS 40 N 0.94 0.26 -0.52 1.25 1.63 -1.21 -1.79 116.57 117.13 1mvo h LYS 40 Ca 0.20 -0.09 -0.03 0.00 -0.85 0.00 0.00 60.65 59.88 1mvo h LYS 40 Cb 0.35 -0.02 -0.03 0.00 -0.60 0.00 0.00 32.23 31.93 1mvo h LYS 40 CO 0.00 0.50 0.19 0.87 -3.45 0.00 0.00 179.45 177.56 1mvo h LYS 41 N -0.00 0.76 -0.08 1.90 1.57 -0.92 -1.14 116.57 118.66 1mvo h LYS 41 Ca 0.04 -0.12 -0.01 0.00 -1.87 0.00 0.00 60.65 58.69 1mvo h LYS 41 Cb 0.38 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.56 1mvo h LYS 41 CO 0.01 0.64 0.01 0.00 -0.57 0.00 0.00 179.45 179.53 1mvo h ALA 42 N 1.47 0.10 -0.57 3.86 0.00 -1.06 0.98 119.26 124.04 1mvo h ALA 42 Ca 0.18 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 1mvo h ALA 42 Cb 0.17 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 1mvo h ALA 42 CO -0.01 -0.24 0.19 0.93 0.00 0.00 0.00 179.25 180.11 1mvo h GLU 43 N -0.13 0.85 0.05 0.00 5.08 -1.07 -2.88 114.58 116.48 1mvo h GLU 43 Ca 0.02 -0.15 -0.34 0.00 -1.00 0.00 0.00 59.36 57.90 1mvo h GLU 43 Cb 0.30 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 29.37 1mvo h GLU 43 CO 0.00 0.73 -1.88 0.25 -1.00 0.00 0.00 179.01 177.11 1mvo n THR 44 N -4.30 1.64 1.04 1.13 -2.24 -0.45 -4.52 114.28 106.57 1mvo n THR 44 Ca 0.05 -0.41 0.12 0.00 -2.27 0.00 0.00 64.05 61.54 1mvo n THR 44 Cb 0.19 -1.82 0.20 0.00 -2.10 0.00 0.00 70.33 66.80 1mvo n THR 44 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1mvo n GLU 45 N -3.86 0.19 -3.84 -0.78 -0.58 0.33 -5.00 120.64 107.11 1mvo n GLU 45 Ca -0.36 -0.13 -0.29 0.00 -0.42 0.00 0.00 57.16 55.96 1mvo n GLU 45 Cb 0.90 -1.50 0.01 0.00 -0.57 0.00 0.00 31.44 30.28 1mvo n GLU 45 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1mvo n LYS 46 N -1.29 -1.21 -1.27 3.49 4.76 -1.09 -4.92 118.16 116.63 1mvo n LYS 46 Ca 0.07 0.61 -0.32 0.00 -2.87 0.00 0.00 58.31 55.79 1mvo n LYS 46 Cb 0.34 -2.49 0.10 0.00 -1.84 0.00 0.00 35.03 31.14 1mvo n LYS 46 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 1mvo s PRO 47 N -5.52 2.10 0.40 1.97 0.04 -1.26 -4.94 135.00 127.79 1mvo s PRO 47 Ca 0.13 1.38 0.21 0.00 0.04 0.00 0.00 61.00 62.76 1mvo s PRO 47 Cb -0.07 -1.86 0.29 0.00 0.04 0.00 0.00 34.50 32.90 1mvo s PRO 47 CO 0.91 -1.79 1.58 -0.44 0.04 0.00 0.00 177.00 177.29 1mvo h ASP 48 N -0.92 0.00 -4.50 6.66 3.32 -1.12 -3.46 116.42 116.40 1mvo h ASP 48 Ca -0.45 0.00 -0.07 0.00 0.02 0.00 0.00 57.03 56.54 1mvo h ASP 48 Cb 1.25 0.00 -0.20 0.00 0.22 0.00 0.00 39.33 40.60 1mvo h ASP 48 CO 0.50 0.12 0.06 -0.22 -1.72 0.00 0.00 179.24 177.98 1mvo s LEU 49 N -6.28 -0.39 -0.15 1.55 0.20 -1.17 -4.33 118.68 108.12 1mvo s LEU 49 Ca 0.06 0.93 0.01 0.00 0.69 0.00 0.00 54.13 55.82 1mvo s LEU 49 Cb 0.06 2.23 0.00 0.00 -0.43 0.00 0.00 46.19 48.05 1mvo s LEU 49 CO 0.69 -0.40 -0.18 -0.63 -0.29 0.00 0.00 176.35 175.53 1mvo s ILE 50 N -0.46 2.45 -0.34 6.68 1.01 -0.05 -1.26 121.20 129.23 1mvo s ILE 50 Ca -0.06 -0.85 -0.12 0.00 0.00 0.00 0.00 60.65 59.62 1mvo s ILE 50 Cb -0.03 -2.01 -0.01 0.00 0.01 0.00 0.00 42.46 40.42 1mvo s ILE 50 CO 0.05 0.53 0.22 -0.69 0.00 0.00 0.00 174.94 175.05 1mvo s VAL 51 N 0.76 5.12 -0.14 2.92 1.01 0.06 -0.37 120.40 129.77 1mvo s VAL 51 Ca -0.07 -0.29 -0.00 0.00 0.00 0.00 0.00 61.98 61.62 1mvo s VAL 51 Cb -0.16 -3.64 0.03 0.00 0.00 0.00 0.00 36.38 32.61 1mvo s VAL 51 CO 0.00 -0.01 -0.08 -0.22 0.00 0.00 0.00 175.10 174.79 1mvo s LEU 52 N 1.69 1.43 0.24 3.92 2.96 0.18 -0.67 118.68 128.43 1mvo s LEU 52 Ca 0.06 -0.45 -0.30 0.00 -0.22 0.00 0.00 54.13 53.22 1mvo s LEU 52 Cb -0.17 -0.94 -0.10 0.00 0.50 0.00 0.00 46.19 45.48 1mvo s LEU 52 CO 0.09 -0.12 1.36 -0.62 -1.32 0.00 0.00 176.35 175.74 1mvo s ASP 53 N 1.64 6.79 -0.00 3.68 2.15 -0.60 -0.66 116.67 129.66 1mvo s ASP 53 Ca 0.04 2.55 -0.25 0.00 0.43 0.00 0.00 52.55 55.32 1mvo s ASP 53 Cb -0.13 -2.62 -0.18 0.00 -0.30 0.00 0.00 42.92 39.68 1mvo s ASP 53 CO -0.09 -0.59 1.28 0.58 -0.17 0.00 0.00 175.17 176.18 1mvo h VAL 54 N 3.55 1.06 -2.88 1.11 2.07 -1.66 -3.30 116.25 116.19 1mvo h VAL 54 Ca -0.46 -0.82 -0.65 0.00 0.82 0.00 0.00 66.70 65.59 1mvo h VAL 54 Cb 1.22 1.57 -0.16 0.00 -1.52 0.00 0.00 31.29 32.40 1mvo h VAL 54 CO 0.76 0.19 0.35 -0.04 0.02 0.00 0.00 177.57 178.85 1mvo s MET 55 N -4.56 3.12 0.01 1.57 -1.94 -1.26 -1.17 119.30 115.07 1mvo s MET 55 Ca -0.15 -0.90 0.05 0.00 -1.71 0.00 0.00 55.69 52.98 1mvo s MET 55 Cb 0.02 -4.20 -0.01 0.00 2.01 0.00 0.00 34.83 32.65 1mvo s MET 55 CO 0.61 -1.61 -0.15 -0.51 -0.01 0.00 0.00 175.02 173.36 1mvo s LEU 56 N 3.46 2.08 0.69 -0.03 1.43 -1.26 -4.74 118.68 120.29 1mvo s LEU 56 Ca 0.19 -0.33 -0.13 0.00 -1.03 0.00 0.00 54.13 52.84 1mvo s LEU 56 Cb -0.19 -0.71 0.01 0.00 0.03 0.00 0.00 46.19 45.33 1mvo s LEU 56 CO 0.11 0.14 1.08 -2.16 0.23 0.00 0.00 176.35 175.74 1mvo s PRO 57 N -0.60 2.79 0.00 1.29 0.04 -1.26 -3.61 135.00 133.65 1mvo s PRO 57 Ca 0.05 1.18 0.00 0.00 0.04 0.00 0.00 61.00 62.27 1mvo s PRO 57 Cb -0.06 -1.96 0.00 0.00 0.04 0.00 0.00 34.50 32.51 1mvo s PRO 57 CO 0.00 -1.23 0.00 1.63 0.04 0.00 0.00 177.00 177.44 1mvo n LYS 58 N -2.82 0.00 -3.89 4.56 5.02 -1.26 -1.48 118.16 118.29 1mvo n LYS 58 Ca 0.09 0.00 -0.19 0.00 -2.02 0.00 0.00 58.31 56.19 1mvo n LYS 58 Cb 0.53 0.00 -0.17 0.00 -0.02 0.00 0.00 35.03 35.37 1mvo n LYS 58 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1mvo s LEU 59 N 0.00 0.90 0.95 -0.35 1.43 -1.26 -4.87 118.68 115.48 1mvo s LEU 59 Ca 0.00 -0.04 -0.15 0.00 -1.03 0.00 0.00 54.13 52.90 1mvo s LEU 59 Cb 0.00 -0.30 0.19 0.00 0.03 0.00 0.00 46.19 46.11 1mvo s LEU 59 CO 0.00 -0.14 1.31 1.51 0.23 0.00 0.00 176.35 179.26 1mvo s ASP 60 N 1.41 3.21 0.23 2.29 1.47 -1.24 -3.17 116.67 120.87 1mvo s ASP 60 Ca -0.04 0.27 -0.08 0.00 1.18 0.00 0.00 52.55 53.88 1mvo s ASP 60 Cb -0.13 -0.34 0.22 0.00 -0.34 0.00 0.00 42.92 42.33 1mvo s ASP 60 CO -0.03 -2.68 1.91 1.23 0.68 0.00 0.00 175.17 176.28 1mvo h GLY 61 N -1.59 1.25 0.97 2.12 0.00 -1.22 -0.36 103.07 104.25 1mvo h GLY 61 Ca -0.44 -0.46 0.01 0.00 0.00 0.00 0.00 47.33 46.44 1mvo h GLY 61 CO 0.39 0.45 0.43 -2.22 0.00 0.00 0.00 176.54 175.60 1mvo h ILE 62 N 1.20 1.15 -0.34 2.60 2.04 -1.89 -1.59 117.51 120.68 1mvo h ILE 62 Ca 0.33 -0.30 -0.14 0.00 1.00 0.00 0.00 64.86 65.75 1mvo h ILE 62 Cb -0.13 0.20 -0.01 0.00 -0.74 0.00 0.00 36.82 36.14 1mvo h ILE 62 CO -0.07 0.16 -0.31 -0.08 0.00 0.00 0.00 178.15 177.84 1mvo h GLU 63 N 0.88 0.82 -0.17 2.37 4.57 -1.65 0.48 114.58 121.88 1mvo h GLU 63 Ca 0.25 -0.42 0.04 0.00 -1.18 0.00 0.00 59.36 58.04 1mvo h GLU 63 Cb -0.07 0.01 -0.04 0.00 -0.16 0.00 0.00 28.75 28.49 1mvo h GLU 63 CO -0.07 1.06 -0.07 0.28 -1.18 0.00 0.00 179.01 179.03 1mvo h VAL 64 N 0.60 0.76 -0.71 0.32 2.07 -0.91 -0.62 116.25 117.77 1mvo h VAL 64 Ca 0.06 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.57 1mvo h VAL 64 Cb 0.89 0.76 -0.03 0.00 -1.52 0.00 0.00 31.29 31.39 1mvo h VAL 64 CO 0.08 0.00 0.43 0.00 0.02 0.00 0.00 177.57 178.10 1mvo h LYS 66 N 0.96 0.84 -0.34 0.00 3.64 -0.54 -0.70 116.57 120.44 1mvo h LYS 66 Ca 0.25 -0.08 -0.13 0.00 -1.27 0.00 0.00 60.65 59.42 1mvo h LYS 66 Cb -0.04 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 31.59 1mvo h LYS 66 CO -0.05 0.61 -0.33 1.96 -2.27 0.00 0.00 179.45 179.38 1mvo h GLN 67 N 0.84 0.75 -0.51 1.90 4.20 -0.81 -1.03 115.11 120.44 1mvo h GLN 67 Ca 0.22 -0.35 -0.01 0.00 0.06 0.00 0.00 58.65 58.56 1mvo h GLN 67 Cb -0.01 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 27.74 1mvo h GLN 67 CO -0.04 0.97 0.27 -0.07 -0.67 0.00 0.00 178.83 179.29 1mvo h LEU 68 N 0.63 0.65 -0.84 1.46 3.38 -0.96 -2.39 115.31 117.25 1mvo h LEU 68 Ca 0.07 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 1mvo h LEU 68 Cb 0.86 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 41.40 1mvo h LEU 68 CO 0.07 0.57 0.45 -0.09 0.09 0.00 0.00 178.44 179.53 1mvo h ARG 69 N 0.69 1.18 -0.30 1.13 2.43 -0.86 -0.91 114.38 117.74 1mvo h ARG 69 Ca 0.18 -0.15 -0.01 0.00 -0.81 0.00 0.00 59.98 59.19 1mvo h ARG 69 Cb 0.07 -0.23 -0.02 0.00 -0.42 0.00 0.00 29.97 29.38 1mvo h ARG 69 CO -0.03 0.88 0.13 0.37 -1.51 0.00 0.00 179.97 179.81 1mvo h GLN 70 N 1.18 0.41 -0.01 0.20 5.75 -0.98 -0.60 115.11 121.06 1mvo h GLN 70 Ca 0.29 -0.04 0.00 0.00 -0.15 0.00 0.00 58.65 58.75 1mvo h GLN 70 Cb 0.05 -0.08 0.00 0.00 1.07 0.00 0.00 27.48 28.52 1mvo h GLN 70 CO -0.04 0.33 0.00 1.04 -2.65 0.00 0.00 178.83 177.51 1mvo n GLN 71 N -4.43 1.15 -1.52 1.69 6.02 -0.83 -4.90 117.38 114.56 1mvo n GLN 71 Ca 0.01 -0.21 -0.12 0.00 -0.01 0.00 0.00 57.00 56.67 1mvo n GLN 71 Cb 0.12 -1.48 -0.04 0.00 1.02 0.00 0.00 30.24 29.86 1mvo n GLN 71 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 1mvo n LYS 72 N -0.73 -0.83 -3.27 -1.09 4.76 -0.23 -5.00 118.16 111.77 1mvo n LYS 72 Ca 0.22 0.83 -0.39 0.00 -2.87 0.00 0.00 58.31 56.11 1mvo n LYS 72 Cb 0.16 -4.86 -0.06 0.00 -1.84 0.00 0.00 35.03 28.44 1mvo n LYS 72 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 1mvo s LEU 73 N -2.78 4.43 -0.18 -0.35 1.43 -0.41 -5.00 118.68 115.82 1mvo s LEU 73 Ca 0.00 1.12 0.01 0.00 -1.03 0.00 0.00 54.13 54.23 1mvo s LEU 73 Cb 0.00 -2.84 0.03 0.00 0.03 0.00 0.00 46.19 43.41 1mvo s LEU 73 CO 0.00 0.16 -0.14 -0.32 0.23 0.00 0.00 176.35 176.28 1mvo s MET 74 N -0.41 2.39 0.05 1.70 1.75 -1.26 -4.19 119.30 119.32 1mvo s MET 74 Ca 0.29 -0.80 0.07 0.00 -1.25 0.00 0.00 55.69 53.99 1mvo s MET 74 Cb -0.18 -2.41 -0.03 0.00 2.84 0.00 0.00 34.83 35.06 1mvo s MET 74 CO 0.16 -0.33 -0.19 -0.06 -0.65 0.00 0.00 175.02 173.96 1mvo s PHE 75 N 1.37 1.65 0.08 4.11 0.40 -1.26 -5.11 117.98 119.22 1mvo s PHE 75 Ca 0.02 -0.37 -0.31 0.00 -0.60 0.00 0.00 56.93 55.66 1mvo s PHE 75 Cb -0.15 -0.97 -0.08 0.00 0.51 0.00 0.00 43.02 42.33 1mvo s PHE 75 CO -0.10 0.09 1.48 -2.14 0.70 0.00 0.00 175.22 175.25 1mvo s PRO 76 N -1.24 4.27 -0.09 0.24 0.02 -1.26 -4.89 135.00 132.05 1mvo s PRO 76 Ca 0.06 2.15 0.01 0.00 0.02 0.00 0.00 61.00 63.23 1mvo s PRO 76 Cb -0.09 -3.39 0.02 0.00 0.02 0.00 0.00 34.50 31.06 1mvo s PRO 76 CO 0.02 -0.56 -0.08 0.42 -0.33 0.00 0.00 177.00 176.46 1mvo s ILE 77 N 1.78 0.97 -0.34 2.83 1.01 -1.26 -0.87 121.20 125.32 1mvo s ILE 77 Ca 0.67 -0.31 -0.10 0.00 0.00 0.00 0.00 60.65 60.92 1mvo s ILE 77 Cb -0.37 -0.96 0.01 0.00 0.01 0.00 0.00 42.46 41.15 1mvo s ILE 77 CO 0.30 0.34 0.16 -0.22 0.00 0.00 0.00 174.94 175.53 1mvo s LEU 78 N 1.30 4.36 0.10 2.97 2.96 0.50 -0.69 118.68 130.18 1mvo s LEU 78 Ca -0.03 -0.79 -0.23 0.00 -0.22 0.00 0.00 54.13 52.86 1mvo s LEU 78 Cb -0.14 -1.99 -0.07 0.00 0.50 0.00 0.00 46.19 44.49 1mvo s LEU 78 CO -0.03 -0.29 0.69 -0.04 -1.32 0.00 0.00 176.35 175.36 1mvo s MET 79 N 1.56 4.42 -0.18 1.98 -1.94 -0.33 -0.65 119.30 124.16 1mvo s MET 79 Ca 0.03 0.97 -0.05 0.00 -1.71 0.00 0.00 55.69 54.93 1mvo s MET 79 Cb -0.18 -3.28 -0.03 0.00 2.01 0.00 0.00 34.83 33.35 1mvo s MET 79 CO 0.06 0.53 0.01 -1.17 -0.01 0.00 0.00 175.02 174.43 1mvo s LEU 80 N -0.88 3.38 0.17 -0.03 2.96 0.16 -0.89 118.68 123.55 1mvo s LEU 80 Ca 0.33 -0.12 0.11 0.00 -0.22 0.00 0.00 54.13 54.23 1mvo s LEU 80 Cb -0.21 -1.85 -0.04 0.00 0.50 0.00 0.00 46.19 44.59 1mvo s LEU 80 CO 0.23 0.12 -0.21 0.42 -1.32 0.00 0.00 176.35 175.58 1mvo s THR 81 N 0.70 2.56 0.67 3.68 -4.23 -0.31 -1.63 115.64 117.09 1mvo s THR 81 Ca 0.00 -1.86 -0.08 0.00 -1.18 0.00 0.00 61.69 58.57 1mvo s THR 81 Cb -0.14 -2.22 0.03 0.00 1.34 0.00 0.00 72.50 71.51 1mvo s THR 81 CO 0.02 -0.06 1.00 0.00 -0.54 0.00 0.00 174.62 175.04 1mvo s ALA 82 N -1.54 3.11 0.28 3.99 0.00 -1.26 -0.56 121.76 125.78 1mvo s ALA 82 Ca 0.20 -0.67 -0.30 0.00 0.00 0.00 0.00 51.96 51.19 1mvo s ALA 82 Cb -0.09 -2.74 -0.11 0.00 0.00 0.00 0.00 23.12 20.19 1mvo s ALA 82 CO 0.10 -1.10 1.58 0.15 0.00 0.00 0.00 175.76 176.50 1mvo s LYS 83 N -5.20 4.14 -1.28 0.00 1.02 -1.18 -2.29 119.74 114.95 1mvo s LYS 83 Ca 0.57 2.54 -0.02 0.00 0.02 0.00 0.00 55.97 59.08 1mvo s LYS 83 Cb -0.11 -3.04 0.01 0.00 -0.52 0.00 0.00 37.83 34.18 1mvo s LYS 83 CO 0.47 -0.61 0.15 -0.40 -0.92 0.00 0.00 175.35 174.04 1mvo n ASP 84 N 2.27 -4.49 -3.87 2.83 5.75 -1.26 -4.92 116.55 112.86 1mvo n ASP 84 Ca 0.08 0.01 -0.29 0.00 -0.01 0.00 0.00 54.79 54.58 1mvo n ASP 84 Cb 0.38 -3.76 -0.13 0.00 -1.03 0.00 0.00 41.12 36.58 1mvo n ASP 84 CO 0.00 0.00 0.00 -1.83 -0.11 0.00 0.00 177.20 175.26 1mvo s GLU 85 N -5.27 2.11 0.39 0.11 -1.05 -0.97 -5.10 118.70 108.92 1mvo s GLU 85 Ca 0.10 -2.93 -0.26 0.00 -0.15 0.00 0.00 54.97 51.73 1mvo s GLU 85 Cb -0.05 -3.18 -0.09 0.00 -0.44 0.00 0.00 34.13 30.37 1mvo s GLU 85 CO 0.12 -1.22 1.28 -2.00 0.95 0.00 0.00 175.26 174.39 1mvo s GLU 86 N -0.83 4.06 0.01 -4.83 -6.30 -1.26 -4.47 118.70 105.08 1mvo s GLU 86 Ca 0.22 2.11 0.06 0.00 -2.50 0.00 0.00 54.97 54.86 1mvo s GLU 86 Cb -0.13 -2.80 -0.03 0.00 0.00 0.00 0.00 34.13 31.17 1mvo s GLU 86 CO -0.10 -0.41 -0.15 0.12 0.02 0.00 0.00 175.26 174.74 1mvo s PHE 87 N -1.26 2.64 -0.60 5.30 5.36 -1.26 -5.08 117.98 123.08 1mvo s PHE 87 Ca 0.55 -0.20 -0.27 0.00 -0.96 0.00 0.00 56.93 56.05 1mvo s PHE 87 Cb -0.37 -1.52 0.03 0.00 -0.34 0.00 0.00 43.02 40.82 1mvo s PHE 87 CO 0.48 0.25 1.15 0.34 -1.46 0.00 0.00 175.22 175.98 1mvo s ASP 88 N -1.26 6.38 0.44 6.13 -1.08 -1.26 -4.88 116.67 121.14 1mvo s ASP 88 Ca 0.14 -0.08 0.29 0.00 -0.52 0.00 0.00 52.55 52.39 1mvo s ASP 88 Cb -0.11 -2.53 1.12 0.00 -1.46 0.00 0.00 42.92 39.95 1mvo s ASP 88 CO 0.04 -1.48 1.86 0.11 0.52 0.00 0.00 175.17 176.22 1mvo h LYS 89 N 9.57 0.00 -0.20 4.34 1.57 -1.98 -0.64 116.57 129.23 1mvo h LYS 89 Ca -0.26 0.00 -0.21 0.00 -1.87 0.00 0.00 60.65 58.31 1mvo h LYS 89 Cb 1.06 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.38 1mvo h LYS 89 CO 1.18 0.00 -0.70 0.28 -0.57 0.00 0.00 179.45 179.64 1mvo h VAL 90 N 0.00 1.28 -0.48 0.50 2.07 -2.00 -1.18 116.25 116.43 1mvo h VAL 90 Ca 0.00 -1.89 -0.01 0.00 0.82 0.00 0.00 66.70 65.62 1mvo h VAL 90 Cb 0.54 1.87 -0.02 0.00 -1.52 0.00 0.00 31.29 32.16 1mvo h VAL 90 CO 0.00 0.60 0.25 0.25 0.02 0.00 0.00 177.57 178.69 1mvo h LEU 91 N 0.58 0.61 -0.90 2.57 5.85 -1.85 -2.69 115.31 119.47 1mvo h LEU 91 Ca -0.03 -0.11 0.14 0.00 0.84 0.00 0.00 57.88 58.72 1mvo h LEU 91 Cb 1.32 -0.16 -0.09 0.00 0.37 0.00 0.00 40.66 42.11 1mvo h LEU 91 CO 0.15 0.54 0.51 1.23 -0.34 0.00 0.00 178.44 180.53 1mvo h GLY 92 N 0.63 1.48 1.09 3.75 0.00 -0.91 -0.87 103.07 108.23 1mvo h GLY 92 Ca 0.17 -0.32 -0.08 0.00 0.00 0.00 0.00 47.33 47.10 1mvo h GLY 92 CO -0.02 0.04 0.10 -2.00 0.00 0.00 0.00 176.54 174.65 1mvo h LEU 93 N 0.76 1.06 -1.31 3.11 5.85 -0.95 -0.53 115.31 123.30 1mvo h LEU 93 Ca 0.47 -0.26 0.11 0.00 0.84 0.00 0.00 57.88 59.05 1mvo h LEU 93 Cb 0.59 -0.28 -0.06 0.00 0.37 0.00 0.00 40.66 41.28 1mvo h LEU 93 CO -0.32 1.06 0.55 -0.33 -0.34 0.00 0.00 178.44 179.05 1mvo h GLU 94 N 1.03 0.71 -0.01 1.25 5.08 -0.88 -2.35 114.58 119.41 1mvo h GLU 94 Ca 0.20 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.52 1mvo h GLU 94 Cb 0.45 -0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1mvo h GLU 94 CO 0.01 0.47 -0.14 1.28 -1.00 0.00 0.00 179.01 179.64 1mvo n LEU 95 N -4.53 0.68 0.00 1.33 4.77 -0.59 -4.94 117.00 113.73 1mvo n LEU 95 Ca 0.15 -0.10 0.00 0.00 -0.03 0.00 0.00 56.01 56.03 1mvo n LEU 95 Cb 0.38 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 1mvo n LEU 95 CO 0.31 0.13 0.00 0.61 -1.33 0.00 0.00 177.39 177.11 1mvo n GLY 96 N 1.28 0.74 3.77 -0.72 0.00 -0.81 -4.65 105.19 104.79 1mvo n GLY 96 Ca 0.14 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.77 1mvo n GLY 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mvo s ALA 97 N -2.19 3.24 -0.08 4.61 0.00 -0.31 -4.43 121.76 122.60 1mvo s ALA 97 Ca 0.00 1.07 0.15 0.00 0.00 0.00 0.00 51.96 53.18 1mvo s ALA 97 Cb 0.00 -3.42 -0.23 0.00 0.00 0.00 0.00 23.12 19.48 1mvo s ALA 97 CO 0.00 -0.59 0.22 -0.25 0.00 0.00 0.00 175.76 175.14 1mvo n ASP 98 N 0.26 1.21 -3.80 0.00 8.00 0.13 -4.53 116.55 117.82 1mvo n ASP 98 Ca 0.03 0.00 -0.05 0.00 0.71 0.00 0.00 54.79 55.48 1mvo n ASP 98 Cb 0.45 1.35 -0.02 0.00 -0.02 0.00 0.00 41.12 42.88 1mvo n ASP 98 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1mvo s ASP 99 N -4.36 -0.21 0.00 -2.24 2.15 -1.08 -5.02 116.67 105.91 1mvo s ASP 99 Ca -0.07 -0.50 0.01 0.00 0.43 0.00 0.00 52.55 52.41 1mvo s ASP 99 Cb 0.08 0.60 -0.00 0.00 -0.30 0.00 0.00 42.92 43.29 1mvo s ASP 99 CO 0.66 -1.11 -0.02 -0.31 -0.17 0.00 0.00 175.17 174.22 1mvo s TYR 100 N -3.56 0.20 -0.01 -5.34 1.51 -1.26 -1.18 117.35 107.71 1mvo s TYR 100 Ca 0.12 -0.09 0.00 0.00 -1.01 0.00 0.00 57.07 56.09 1mvo s TYR 100 Cb -0.03 -0.13 0.01 0.00 -0.11 0.00 0.00 41.96 41.70 1mvo s TYR 100 CO 0.05 -0.02 -0.01 1.41 -1.11 0.00 0.00 175.55 175.87 1mvo s MET 101 N -0.23 0.12 0.22 -0.62 1.75 -0.07 -4.93 119.30 115.54 1mvo s MET 101 Ca -0.01 0.01 -0.01 0.00 -1.25 0.00 0.00 55.69 54.43 1mvo s MET 101 Cb -0.02 -0.20 -0.04 0.00 2.84 0.00 0.00 34.83 37.41 1mvo s MET 101 CO -0.00 -0.03 0.41 0.95 -0.65 0.00 0.00 175.02 175.70 1mvo s THR 102 N 0.31 5.19 -0.12 10.11 -4.23 -1.26 -1.16 115.64 124.48 1mvo s THR 102 Ca -0.03 -0.38 -0.03 0.00 -1.18 0.00 0.00 61.69 60.07 1mvo s THR 102 Cb -0.05 -3.75 -0.03 0.00 1.34 0.00 0.00 72.50 70.01 1mvo s THR 102 CO -0.01 -0.21 0.01 -0.54 -0.54 0.00 0.00 174.62 173.32 1mvo s LYS 103 N -3.43 3.35 0.65 3.99 1.02 0.28 -3.75 119.74 121.85 1mvo s LYS 103 Ca 0.39 -0.42 -0.12 0.00 0.02 0.00 0.00 55.97 55.84 1mvo s LYS 103 Cb -0.11 -2.91 -0.01 0.00 -0.52 0.00 0.00 37.83 34.28 1mvo s LYS 103 CO 0.29 0.51 1.05 -1.25 -0.92 0.00 0.00 175.35 175.04 1mvo s PRO 104 N -0.35 3.16 0.04 -1.68 0.04 -1.26 -3.09 135.00 131.86 1mvo s PRO 104 Ca 0.07 0.99 -0.00 0.00 0.04 0.00 0.00 61.00 62.09 1mvo s PRO 104 Cb -0.12 -2.02 -0.03 0.00 0.04 0.00 0.00 34.50 32.37 1mvo s PRO 104 CO 0.02 -0.93 -0.03 -0.59 0.04 0.00 0.00 177.00 175.51 1mvo s PHE 105 N -2.90 0.39 0.38 0.56 -0.12 -1.25 -5.12 117.98 109.93 1mvo s PHE 105 Ca 0.59 -0.80 -0.01 0.00 -0.05 0.00 0.00 56.93 56.66 1mvo s PHE 105 Cb -0.14 -0.29 -0.03 0.00 -0.63 0.00 0.00 43.02 41.93 1mvo s PHE 105 CO 0.49 -0.28 0.60 -1.54 -0.05 0.00 0.00 175.22 174.44 1mvo s SER 106 N -2.20 6.28 0.25 1.98 1.04 -1.26 -4.96 113.70 114.83 1mvo s SER 106 Ca -0.04 0.55 -0.03 0.00 0.48 0.00 0.00 55.95 56.90 1mvo s SER 106 Cb -0.01 -2.07 0.44 0.00 0.10 0.00 0.00 66.02 64.48 1mvo s SER 106 CO -0.05 -0.36 1.79 -0.65 0.98 0.00 0.00 173.24 174.95 1mvo h PRO 107 N 0.63 0.70 -0.06 4.02 0.11 -2.00 -2.00 132.00 133.41 1mvo h PRO 107 Ca -0.49 -0.04 -0.10 0.00 0.11 0.00 0.00 66.00 65.47 1mvo h PRO 107 Cb 1.22 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 1mvo h PRO 107 CO 0.61 0.47 -0.44 0.00 -0.21 0.00 0.00 178.00 178.43 1mvo h ARG 108 N 0.73 0.14 -0.00 1.05 3.08 -1.99 -1.90 114.38 115.48 1mvo h ARG 108 Ca 0.42 -0.07 -0.00 0.00 0.07 0.00 0.00 59.98 60.40 1mvo h ARG 108 Cb 0.46 -0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.51 1mvo h ARG 108 CO -0.29 0.56 0.00 1.49 -1.07 0.00 0.00 179.97 180.66 1mvo h GLU 109 N 0.12 0.01 -0.72 0.04 4.81 -1.77 -0.85 114.58 116.22 1mvo h GLU 109 Ca 0.01 -0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.17 1mvo h GLU 109 Cb 0.82 -0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.17 1mvo h GLU 109 CO 0.06 0.25 0.20 -0.24 -0.73 0.00 0.00 179.01 178.55 1mvo h VAL 110 N -0.24 1.26 -0.83 0.32 3.04 -1.35 -1.07 116.25 117.38 1mvo h VAL 110 Ca 0.00 -0.94 0.02 0.00 -1.01 0.00 0.00 66.70 64.76 1mvo h VAL 110 Cb 0.25 0.51 -0.04 0.00 -2.01 0.00 0.00 31.29 29.99 1mvo h VAL 110 CO 0.00 0.37 0.55 0.78 -1.01 0.00 0.00 177.57 178.25 1mvo h ASN 111 N 1.07 0.93 -0.46 3.17 -0.26 -1.27 -0.78 115.58 117.98 1mvo h ASN 111 Ca 0.23 -0.02 -0.06 0.00 -0.56 0.00 0.00 56.30 55.89 1mvo h ASN 111 Cb 0.35 -0.22 -0.02 0.00 -1.06 0.00 0.00 38.32 37.37 1mvo h ASN 111 CO -0.00 0.66 0.06 0.00 -1.06 0.00 0.00 177.43 177.09 1mvo h ALA 112 N 1.32 0.61 -0.50 -0.83 0.00 -0.72 -1.47 119.26 117.67 1mvo h ALA 112 Ca 0.32 -0.23 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 1mvo h ALA 112 Cb -0.08 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 1mvo h ALA 112 CO -0.09 0.34 -0.08 0.00 0.00 0.00 0.00 179.25 179.42 1mvo h ARG 113 N 0.62 0.94 -0.52 0.00 3.08 -0.79 -1.60 114.38 116.12 1mvo h ARG 113 Ca 0.14 -0.34 -0.07 0.00 0.07 0.00 0.00 59.98 59.77 1mvo h ARG 113 Cb 0.40 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.37 1mvo h ARG 113 CO 0.01 1.00 0.05 0.28 -1.07 0.00 0.00 179.97 180.24 1mvo h VAL 114 N 0.80 1.26 -0.35 2.04 2.07 -1.06 -1.83 116.25 119.17 1mvo h VAL 114 Ca 0.13 -1.01 0.00 0.00 0.82 0.00 0.00 66.70 66.64 1mvo h VAL 114 Cb 0.64 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 31.29 1mvo h VAL 114 CO 0.04 0.36 0.23 0.50 0.02 0.00 0.00 177.57 178.72 1mvo h LYS 115 N 0.76 0.47 -0.67 1.57 3.64 -1.19 -0.50 116.57 120.65 1mvo h LYS 115 Ca 0.15 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.48 1mvo h LYS 115 Cb 0.46 -0.10 -0.03 0.00 -0.41 0.00 0.00 32.23 32.14 1mvo h LYS 115 CO 0.02 0.33 0.33 0.00 -2.27 0.00 0.00 179.45 177.86 1mvo h ALA 116 N 1.12 0.86 -0.44 5.00 0.00 -1.13 -1.22 119.26 123.46 1mvo h ALA 116 Ca 0.13 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 1mvo h ALA 116 Cb -0.04 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 1mvo h ALA 116 CO -0.03 0.41 0.02 0.82 0.00 0.00 0.00 179.25 180.47 1mvo h ILE 117 N 0.93 1.26 0.00 0.00 2.04 -0.98 -1.77 117.51 118.99 1mvo h ILE 117 Ca 0.23 -1.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.04 1mvo h ILE 117 Cb 0.10 1.05 -0.01 0.00 -0.74 0.00 0.00 36.82 37.22 1mvo h ILE 117 CO -0.03 0.35 -0.22 -0.07 0.00 0.00 0.00 178.15 178.18 1mvo h LEU 118 N 0.61 0.00 -0.07 1.44 3.38 -0.85 -2.61 115.31 117.21 1mvo h LEU 118 Ca 0.13 0.00 -0.24 0.00 0.09 0.00 0.00 57.88 57.86 1mvo h LEU 118 Cb 0.47 0.00 0.02 0.00 0.09 0.00 0.00 40.66 41.23 1mvo h LEU 118 CO 0.02 0.22 -0.89 -0.09 0.09 0.00 0.00 178.44 177.79 1mvo h ARG 119 N 0.00 0.73 0.00 1.13 2.43 -0.96 -2.92 114.38 114.79 1mvo h ARG 119 Ca -0.00 -0.69 0.00 0.00 -0.81 0.00 0.00 59.98 58.48 1mvo h ARG 119 Cb 0.43 0.17 0.00 0.00 -0.42 0.00 0.00 29.97 30.15 1mvo h ARG 119 CO 0.03 1.28 0.03 0.54 -1.51 0.00 0.00 179.97 180.34 1mvo n ARG 120 N -3.92 0.00 0.00 0.20 1.74 -0.69 -5.11 116.66 108.88 1mvo n ARG 120 Ca -0.09 0.40 0.00 0.00 -0.77 0.00 0.00 57.85 57.38 1mvo n ARG 120 Cb 0.80 -1.53 0.00 0.00 -1.02 0.00 0.00 32.46 30.71 1mvo n ARG 120 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98