#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vsc s LYS 2 N 0.00 1.10 0.15 3.97 1.02 -0.20 -5.00 119.74 120.77 1vsc s LYS 2 Ca 0.00 -1.24 0.10 0.00 0.02 0.00 0.00 55.97 54.85 1vsc s LYS 2 Cb 0.00 -1.14 -0.04 0.00 -0.52 0.00 0.00 37.83 36.13 1vsc s LYS 2 CO 0.00 0.24 -0.18 -1.50 -0.92 0.00 0.00 175.35 172.99 1vsc s ILE 3 N -1.77 2.76 0.09 2.17 2.07 -1.26 -1.63 121.20 123.63 1vsc s ILE 3 Ca 0.09 -1.69 -0.17 0.00 -1.41 0.00 0.00 60.65 57.46 1vsc s ILE 3 Cb -0.07 -2.30 0.04 0.00 0.13 0.00 0.00 42.46 40.25 1vsc s ILE 3 CO 0.04 -0.01 0.42 -1.83 -1.91 0.00 0.00 174.94 171.65 1vsc s GLU 4 N -2.43 1.02 0.06 3.50 -1.05 -0.17 -4.96 118.70 114.67 1vsc s GLU 4 Ca 0.20 -0.55 -0.00 0.00 -0.15 0.00 0.00 54.97 54.46 1vsc s GLU 4 Cb -0.09 0.45 -0.04 0.00 -0.44 0.00 0.00 34.13 34.01 1vsc s GLU 4 CO 0.11 -0.38 -0.04 0.95 0.95 0.00 0.00 175.26 176.85 1vsc s THR 5 N -3.26 0.33 -0.06 1.83 -4.23 -1.26 -1.58 115.64 107.42 1vsc s THR 5 Ca -0.00 -1.79 -0.02 0.00 -1.18 0.00 0.00 61.69 58.70 1vsc s THR 5 Cb 0.01 -1.49 0.03 0.00 1.34 0.00 0.00 72.50 72.39 1vsc s THR 5 CO -0.08 -0.94 0.03 0.42 -0.54 0.00 0.00 174.62 173.51 1vsc s THR 6 N -3.69 0.16 1.13 3.99 -4.23 -0.78 -4.10 115.64 108.12 1vsc s THR 6 Ca 0.07 0.23 -0.17 0.00 -1.18 0.00 0.00 61.69 60.64 1vsc s THR 6 Cb 0.06 -0.38 0.25 0.00 1.34 0.00 0.00 72.50 73.78 1vsc s THR 6 CO -0.08 0.20 1.11 -2.16 -0.54 0.00 0.00 174.62 173.16 1vsc s PRO 7 N 2.06 -0.67 0.04 3.99 0.04 -1.26 -1.55 135.00 137.64 1vsc s PRO 7 Ca 0.05 0.07 -0.28 0.00 0.04 0.00 0.00 61.00 60.88 1vsc s PRO 7 Cb -0.12 -1.65 -0.17 0.00 0.04 0.00 0.00 34.50 32.60 1vsc s PRO 7 CO -0.04 -3.37 1.43 0.93 0.04 0.00 0.00 177.00 175.98 1vsc h GLU 8 N -2.34 -0.57 0.00 4.56 4.39 -1.96 -3.43 114.58 115.23 1vsc h GLU 8 Ca -0.48 0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.26 1vsc h GLU 8 Cb 1.30 0.13 0.00 0.00 -0.10 0.00 0.00 28.75 30.08 1vsc h GLU 8 CO 0.41 -0.30 0.00 -1.13 -1.16 0.00 0.00 179.01 176.84 1vsc n SER 9 N -5.28 0.00 -3.48 1.42 3.41 -1.26 -4.83 113.62 103.60 1vsc n SER 9 Ca -0.11 -0.36 -0.11 0.00 -0.26 0.00 0.00 58.87 58.03 1vsc n SER 9 Cb 0.28 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.21 1vsc n SER 9 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1vsc s ARG 10 N 0.00 1.32 -0.15 4.33 1.70 -1.26 -1.85 118.95 123.03 1vsc s ARG 10 Ca 0.00 -0.54 -0.08 0.00 -0.47 0.00 0.00 55.73 54.64 1vsc s ARG 10 Cb 0.00 0.58 0.06 0.00 -0.57 0.00 0.00 34.95 35.02 1vsc s ARG 10 CO 0.00 -0.57 0.36 -0.47 -1.08 0.00 0.00 175.30 173.54 1vsc s TYR 11 N -3.77 -0.55 -0.28 5.89 6.14 0.39 -4.79 117.35 120.38 1vsc s TYR 11 Ca 0.02 1.17 -0.06 0.00 0.64 0.00 0.00 57.07 58.84 1vsc s TYR 11 Cb -0.01 0.20 0.00 0.00 0.42 0.00 0.00 41.96 42.57 1vsc s TYR 11 CO -0.11 -0.33 0.06 -1.17 0.64 0.00 0.00 175.55 174.64 1vsc s LEU 12 N 1.59 3.68 0.22 6.97 2.96 -1.26 0.84 118.68 133.69 1vsc s LEU 12 Ca -0.08 -0.64 0.11 0.00 -0.22 0.00 0.00 54.13 53.31 1vsc s LEU 12 Cb -0.10 -1.86 -0.05 0.00 0.50 0.00 0.00 46.19 44.69 1vsc s LEU 12 CO -0.11 -0.16 -0.22 0.00 -1.32 0.00 0.00 176.35 174.54 1vsc s ALA 13 N 1.50 2.55 -0.18 5.97 0.00 0.70 -4.97 121.76 127.32 1vsc s ALA 13 Ca 0.03 -1.72 -0.12 0.00 0.00 0.00 0.00 51.96 50.15 1vsc s ALA 13 Cb -0.17 -0.28 -0.05 0.00 0.00 0.00 0.00 23.12 22.62 1vsc s ALA 13 CO 0.02 0.34 0.20 -1.14 0.00 0.00 0.00 175.76 175.18 1vsc s GLN 14 N -3.04 4.21 0.21 0.00 0.74 -1.26 -1.60 119.66 118.91 1vsc s GLN 14 Ca 0.24 -0.08 -0.32 0.00 0.05 0.00 0.00 55.36 55.26 1vsc s GLN 14 Cb -0.06 -3.42 -0.15 0.00 1.10 0.00 0.00 33.01 30.48 1vsc s GLN 14 CO 0.11 0.28 1.18 -0.89 -0.55 0.00 0.00 175.29 175.42 1vsc n ILE 15 N 3.53 1.11 0.00 -2.34 5.41 0.06 -0.71 119.36 126.41 1vsc n ILE 15 Ca -0.14 -0.28 0.00 0.00 1.00 0.00 0.00 62.75 63.33 1vsc n ILE 15 Cb 0.52 -0.98 0.00 0.00 -0.71 0.00 0.00 39.64 38.47 1vsc n ILE 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1vsc n GLY 16 N 1.89 3.19 3.81 7.39 0.00 0.34 -4.93 105.19 116.89 1vsc n GLY 16 Ca 0.13 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.84 1vsc n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1vsc s ASP 17 N -0.11 5.19 -0.39 1.61 1.01 0.11 -4.44 116.67 119.65 1vsc s ASP 17 Ca 0.00 1.61 -0.15 0.00 0.71 0.00 0.00 52.55 54.71 1vsc s ASP 17 Cb 0.00 -2.45 0.01 0.00 1.01 0.00 0.00 42.92 41.49 1vsc s ASP 17 CO 0.00 -1.56 0.33 -0.55 0.21 0.00 0.00 175.17 173.60 1vsc s SER 18 N -3.76 6.13 -0.07 0.27 0.15 -1.26 0.84 113.70 116.00 1vsc s SER 18 Ca 0.59 -0.65 0.02 0.00 0.70 0.00 0.00 55.95 56.61 1vsc s SER 18 Cb -0.14 -2.18 -0.02 0.00 -1.71 0.00 0.00 66.02 61.97 1vsc s SER 18 CO 0.55 -0.43 -0.14 -0.69 1.20 0.00 0.00 173.24 173.74 1vsc s VAL 19 N 1.86 3.09 -0.08 4.45 1.01 0.16 -4.96 120.40 125.93 1vsc s VAL 19 Ca 0.08 -0.70 0.04 0.00 0.00 0.00 0.00 61.98 61.41 1vsc s VAL 19 Cb -0.18 -2.24 0.00 0.00 0.00 0.00 0.00 36.38 33.97 1vsc s VAL 19 CO 0.11 0.57 -0.22 -0.44 0.00 0.00 0.00 175.10 175.12 1vsc s SER 20 N -0.41 2.84 -0.11 3.32 0.01 -1.26 0.26 113.70 118.35 1vsc s SER 20 Ca 0.05 -0.50 0.02 0.00 1.31 0.00 0.00 55.95 56.82 1vsc s SER 20 Cb -0.12 -1.19 -0.01 0.00 0.21 0.00 0.00 66.02 64.91 1vsc s SER 20 CO 0.02 0.15 -0.19 -0.76 0.41 0.00 0.00 173.24 172.88 1vsc s LEU 21 N 0.29 2.39 0.15 2.44 1.43 -0.09 -4.67 118.68 120.61 1vsc s LEU 21 Ca -0.15 -0.45 0.11 0.00 -1.03 0.00 0.00 54.13 52.61 1vsc s LEU 21 Cb -0.17 -1.51 -0.04 0.00 0.03 0.00 0.00 46.19 44.51 1vsc s LEU 21 CO 0.07 0.16 -0.26 0.42 0.23 0.00 0.00 176.35 176.97 1vsc s THR 22 N 0.35 2.30 -0.05 5.49 -4.23 -0.60 0.05 115.64 118.96 1vsc s THR 22 Ca -0.15 -1.82 -0.00 0.00 -1.18 0.00 0.00 61.69 58.54 1vsc s THR 22 Cb -0.17 -2.04 0.03 0.00 1.34 0.00 0.00 72.50 71.66 1vsc s THR 22 CO 0.07 0.04 0.00 0.00 -0.54 0.00 0.00 174.62 174.19 1vsc s SER 24 N 1.43 2.20 0.16 0.00 0.01 -0.61 0.94 113.70 117.83 1vsc s SER 24 Ca -0.04 -1.46 0.05 0.00 1.31 0.00 0.00 55.95 55.82 1vsc s SER 24 Cb -0.13 0.13 -0.04 0.00 0.21 0.00 0.00 66.02 66.18 1vsc s SER 24 CO -0.03 -0.72 -0.11 0.42 0.41 0.00 0.00 173.24 173.21 1vsc s THR 25 N -3.38 1.28 0.05 1.44 -4.23 -0.64 -0.99 115.64 109.16 1vsc s THR 25 Ca 0.34 -2.08 0.03 0.00 -1.18 0.00 0.00 61.69 58.80 1vsc s THR 25 Cb 0.07 -1.87 -0.03 0.00 1.34 0.00 0.00 72.50 72.01 1vsc s THR 25 CO 0.15 -0.71 -0.10 0.42 -0.54 0.00 0.00 174.62 173.84 1vsc s THR 26 N -3.23 0.70 0.00 3.99 -4.23 -0.65 -4.83 115.64 107.39 1vsc s THR 26 Ca 0.17 -1.14 0.00 0.00 -1.18 0.00 0.00 61.69 59.54 1vsc s THR 26 Cb 0.02 -0.74 0.00 0.00 1.34 0.00 0.00 72.50 73.12 1vsc s THR 26 CO 0.02 -0.34 0.00 0.61 -0.54 0.00 0.00 174.62 174.37 1vsc n GLY 27 N 1.41 0.67 3.08 3.99 0.00 -1.26 -1.04 105.19 112.05 1vsc n GLY 27 Ca -0.22 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.53 1vsc n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vsc h GLU 29 N 6.79 -0.19 -2.70 0.00 4.81 -1.98 -3.41 114.58 117.90 1vsc h GLU 29 Ca -0.28 0.01 -0.60 0.00 -0.13 0.00 0.00 59.36 58.36 1vsc h GLU 29 Cb 1.20 0.04 -0.40 0.00 0.63 0.00 0.00 28.75 30.22 1vsc h GLU 29 CO 0.47 0.26 -0.80 -1.12 -0.73 0.00 0.00 179.01 177.09 1vsc s SER 30 N -5.50 2.94 0.52 1.04 0.01 -1.26 -4.98 113.70 106.47 1vsc s SER 30 Ca -0.13 -3.32 -0.11 0.00 1.31 0.00 0.00 55.95 53.71 1vsc s SER 30 Cb 0.00 -0.94 -0.05 0.00 0.21 0.00 0.00 66.02 65.24 1vsc s SER 30 CO 0.50 -0.15 0.91 -2.16 0.41 0.00 0.00 173.24 172.75 1vsc s PRO 31 N -0.48 3.69 -0.03 12.44 0.04 -1.26 -4.66 135.00 144.74 1vsc s PRO 31 Ca 0.28 0.60 0.04 0.00 0.04 0.00 0.00 61.00 61.97 1vsc s PRO 31 Cb -0.02 -2.22 -0.00 0.00 0.04 0.00 0.00 34.50 32.29 1vsc s PRO 31 CO -0.17 -0.32 -0.16 0.12 0.04 0.00 0.00 177.00 176.52 1vsc s PHE 32 N -2.81 1.54 0.19 0.56 5.36 -0.13 -4.95 117.98 117.75 1vsc s PHE 32 Ca 0.53 -0.41 0.10 0.00 -0.96 0.00 0.00 56.93 56.19 1vsc s PHE 32 Cb -0.10 -1.04 -0.04 0.00 -0.34 0.00 0.00 43.02 41.49 1vsc s PHE 32 CO 0.43 -0.13 -0.13 -0.06 -1.46 0.00 0.00 175.22 173.87 1vsc s PHE 33 N -0.01 2.55 -0.07 10.12 0.40 -1.26 -0.38 117.98 129.32 1vsc s PHE 33 Ca -0.02 -0.26 -0.21 0.00 -0.60 0.00 0.00 56.93 55.84 1vsc s PHE 33 Cb -0.10 -1.24 0.05 0.00 0.51 0.00 0.00 43.02 42.24 1vsc s PHE 33 CO 0.01 0.52 0.49 -1.54 0.70 0.00 0.00 175.22 175.41 1vsc s SER 34 N -2.87 -0.44 0.23 1.36 1.04 -0.70 -4.99 113.70 107.33 1vsc s SER 34 Ca 0.24 0.53 0.11 0.00 0.48 0.00 0.00 55.95 57.32 1vsc s SER 34 Cb -0.08 0.57 -0.05 0.00 0.10 0.00 0.00 66.02 66.56 1vsc s SER 34 CO 0.14 -0.44 -0.22 0.26 0.98 0.00 0.00 173.24 173.96 1vsc s TRP 35 N -0.90 2.24 0.22 5.02 0.52 -1.26 0.22 118.94 124.99 1vsc s TRP 35 Ca -0.09 -0.36 -0.21 0.00 0.02 0.00 0.00 56.10 55.45 1vsc s TRP 35 Cb -0.03 -1.05 0.04 0.00 -1.15 0.00 0.00 33.47 31.28 1vsc s TRP 35 CO 0.05 0.57 0.64 -0.98 0.02 0.00 0.00 176.95 177.25 1vsc s ARG 36 N -3.05 1.54 0.34 4.98 1.70 -0.78 -4.97 118.95 118.72 1vsc s ARG 36 Ca 0.24 -0.80 0.07 0.00 -0.47 0.00 0.00 55.73 54.77 1vsc s ARG 36 Cb -0.06 0.58 -0.01 0.00 -0.57 0.00 0.00 34.95 34.89 1vsc s ARG 36 CO 0.11 -0.68 0.43 0.95 -1.08 0.00 0.00 175.30 175.03 1vsc s THR 37 N -3.86 3.82 0.58 4.99 -4.23 -1.26 0.11 115.64 115.78 1vsc s THR 37 Ca 0.08 -1.11 0.29 0.00 -1.18 0.00 0.00 61.69 59.77 1vsc s THR 37 Cb -0.03 -3.31 0.40 0.00 1.34 0.00 0.00 72.50 70.90 1vsc s THR 37 CO -0.01 -0.15 1.89 0.06 -0.54 0.00 0.00 174.62 175.87 1vsc h GLN 38 N 0.97 0.00 -0.17 3.99 -0.00 -1.85 0.40 115.11 118.46 1vsc h GLN 38 Ca -0.45 0.00 -0.04 0.00 -0.00 0.00 0.00 58.65 58.16 1vsc h GLN 38 Cb 1.26 0.00 -0.02 0.00 -0.00 0.00 0.00 27.48 28.72 1vsc h GLN 38 CO 0.54 0.00 -0.06 0.44 -0.00 0.00 0.00 178.83 179.74 1vsc n ILE 39 N -3.82 2.20 -3.99 1.86 -5.35 -1.26 -4.99 119.36 104.01 1vsc n ILE 39 Ca 0.10 -2.32 -0.33 0.00 -0.27 0.00 0.00 62.75 59.94 1vsc n ILE 39 Cb 0.73 -0.26 -0.01 0.00 -1.74 0.00 0.00 39.64 38.36 1vsc n ILE 39 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 1vsc n ASP 40 N -1.00 -2.09 -4.77 7.28 8.00 0.14 -4.99 116.55 119.12 1vsc n ASP 40 Ca 0.22 -1.13 -0.23 0.00 0.71 0.00 0.00 54.79 54.35 1vsc n ASP 40 Cb 0.82 -2.53 -0.06 0.00 -0.02 0.00 0.00 41.12 39.33 1vsc n ASP 40 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1vsc s SER 41 N -3.98 4.61 0.42 -2.24 1.04 -1.26 -4.94 113.70 107.35 1vsc s SER 41 Ca 0.22 -0.96 -0.22 0.00 0.48 0.00 0.00 55.95 55.47 1vsc s SER 41 Cb -0.10 -0.53 -0.12 0.00 0.10 0.00 0.00 66.02 65.36 1vsc s SER 41 CO 0.92 -0.54 0.55 -2.65 0.98 0.00 0.00 173.24 172.50 1vsc n PRO 42 N -1.30 0.58 0.07 4.02 -0.02 -1.26 -4.33 135.00 132.76 1vsc n PRO 42 Ca -0.00 0.21 -0.11 0.00 -2.02 0.00 0.00 63.50 61.58 1vsc n PRO 42 Cb 0.63 -1.51 -0.01 0.00 -0.02 0.00 0.00 33.50 32.59 1vsc n PRO 42 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1vsc h LEU 43 N 0.79 0.40 -1.29 2.45 3.38 -1.95 -3.46 115.31 115.62 1vsc h LEU 43 Ca -0.40 -0.31 -0.39 0.00 0.09 0.00 0.00 57.88 56.87 1vsc h LEU 43 Cb 1.40 -0.12 0.11 0.00 0.09 0.00 0.00 40.66 42.14 1vsc h LEU 43 CO 0.51 1.10 -0.75 0.59 0.09 0.00 0.00 178.44 179.98 1vsc n ASN 44 N -3.72 -3.85 -3.60 -0.43 3.02 -1.26 -4.78 115.26 100.64 1vsc n ASN 44 Ca -0.05 -0.65 -0.02 0.00 -0.03 0.00 0.00 54.58 53.84 1vsc n ASN 44 Cb 0.80 -4.74 0.00 0.00 -0.61 0.00 0.00 39.78 35.23 1vsc n ASN 44 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1vsc s GLY 45 N -3.84 -0.15 -0.19 7.41 0.00 -1.26 -4.82 107.32 104.46 1vsc s GLY 45 Ca 0.31 0.10 -0.01 0.00 0.00 0.00 0.00 44.72 45.11 1vsc s GLY 45 CO 0.76 1.26 -0.12 1.25 0.00 0.00 0.00 173.10 176.25 1vsc s LYS 46 N -2.63 3.23 -0.10 2.90 2.20 0.34 -4.91 119.74 120.77 1vsc s LYS 46 Ca 0.17 -0.71 -0.20 0.00 -0.36 0.00 0.00 55.97 54.86 1vsc s LYS 46 Cb -0.00 -2.78 -0.04 0.00 -1.51 0.00 0.00 37.83 33.50 1vsc s LYS 46 CO 0.02 -0.13 0.57 0.08 -0.36 0.00 0.00 175.35 175.52 1vsc s VAL 47 N 1.22 5.13 -0.06 4.02 1.01 -1.26 -1.69 120.40 128.77 1vsc s VAL 47 Ca 0.02 1.15 0.01 0.00 0.00 0.00 0.00 61.98 63.16 1vsc s VAL 47 Cb -0.14 -3.91 0.02 0.00 0.00 0.00 0.00 36.38 32.35 1vsc s VAL 47 CO -0.05 0.29 -0.07 0.42 0.00 0.00 0.00 175.10 175.69 1vsc s THR 48 N 0.72 0.77 -0.21 3.92 -4.23 -0.15 -4.96 115.64 111.50 1vsc s THR 48 Ca 0.31 -0.24 -0.05 0.00 -1.18 0.00 0.00 61.69 60.52 1vsc s THR 48 Cb -0.16 -0.77 -0.02 0.00 1.34 0.00 0.00 72.50 72.89 1vsc s THR 48 CO 0.13 0.29 0.01 0.20 -0.54 0.00 0.00 174.62 174.71 1vsc s ASN 49 N 0.98 4.87 -0.30 3.99 0.01 -1.26 -0.34 114.94 122.88 1vsc s ASN 49 Ca -0.10 -0.20 0.00 0.00 -0.71 0.00 0.00 52.86 51.85 1vsc s ASN 49 Cb -0.14 -1.84 0.09 0.00 0.41 0.00 0.00 41.25 39.77 1vsc s ASN 49 CO 0.00 0.05 0.07 -0.70 -1.51 0.00 0.00 177.10 175.01 1vsc s GLU 50 N 1.10 0.96 6.91 -0.60 -6.30 -0.68 -5.02 118.70 115.08 1vsc s GLU 50 Ca 0.03 -1.20 0.00 0.00 -2.50 0.00 0.00 54.97 51.29 1vsc s GLU 50 Cb -0.14 -2.32 0.00 0.00 0.00 0.00 0.00 34.13 31.67 1vsc s GLU 50 CO 0.02 -0.92 0.00 0.41 0.02 0.00 0.00 175.26 174.79 1vsc n GLY 51 N 4.71 2.58 1.82 -1.50 0.00 -1.26 -2.61 105.19 108.94 1vsc n GLY 51 Ca -0.02 0.18 0.07 0.00 0.00 0.00 0.00 46.02 46.25 1vsc n GLY 51 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1vsc n THR 52 N 0.00 2.57 -3.89 2.61 -2.24 -1.26 -4.75 114.28 107.32 1vsc n THR 52 Ca 0.00 -1.33 -0.11 0.00 -2.27 0.00 0.00 64.05 60.34 1vsc n THR 52 Cb 0.00 -0.24 -0.13 0.00 -2.10 0.00 0.00 70.33 67.86 1vsc n THR 52 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1vsc s THR 53 N -2.60 0.04 -0.00 4.28 2.01 -1.07 -1.62 115.64 116.67 1vsc s THR 53 Ca 0.53 -0.30 0.08 0.00 0.31 0.00 0.00 61.69 62.30 1vsc s THR 53 Cb 0.39 -0.14 -0.02 0.00 0.01 0.00 0.00 72.50 72.74 1vsc s THR 53 CO 0.16 -0.17 -0.24 -0.55 -0.69 0.00 0.00 174.62 173.13 1vsc s SER 54 N -0.49 3.23 -0.09 3.53 0.15 0.27 -1.68 113.70 118.60 1vsc s SER 54 Ca -0.06 -0.48 0.04 0.00 0.70 0.00 0.00 55.95 56.16 1vsc s SER 54 Cb -0.03 -0.39 0.00 0.00 -1.71 0.00 0.00 66.02 63.89 1vsc s SER 54 CO -0.00 0.30 -0.22 -0.89 1.20 0.00 0.00 173.24 173.63 1vsc s THR 55 N -0.70 1.90 -0.38 6.45 2.01 0.53 -0.57 115.64 124.89 1vsc s THR 55 Ca 0.11 -0.93 -0.09 0.00 0.31 0.00 0.00 61.69 61.09 1vsc s THR 55 Cb -0.10 -1.65 0.06 0.00 0.01 0.00 0.00 72.50 70.81 1vsc s THR 55 CO 0.00 0.53 0.20 -0.22 -0.69 0.00 0.00 174.62 174.44 1vsc s LEU 56 N 0.37 4.80 -0.28 4.42 2.96 0.11 -0.98 118.68 130.08 1vsc s LEU 56 Ca -0.18 -1.29 -0.15 0.00 -0.22 0.00 0.00 54.13 52.29 1vsc s LEU 56 Cb -0.17 -1.95 -0.03 0.00 0.50 0.00 0.00 46.19 44.53 1vsc s LEU 56 CO 0.08 -0.44 0.37 -0.89 -1.32 0.00 0.00 176.35 174.15 1vsc s THR 57 N 1.44 5.17 -0.34 3.68 2.01 -0.68 -0.92 115.64 126.00 1vsc s THR 57 Ca 0.01 0.51 0.02 0.00 0.31 0.00 0.00 61.69 62.54 1vsc s THR 57 Cb -0.21 -3.71 0.09 0.00 0.01 0.00 0.00 72.50 68.68 1vsc s THR 57 CO 0.03 0.13 0.06 -0.04 -0.69 0.00 0.00 174.62 174.12 1vsc s MET 58 N 2.06 1.79 -0.21 4.92 -1.94 0.14 -0.50 119.30 125.56 1vsc s MET 58 Ca 0.15 -1.75 -0.04 0.00 -1.71 0.00 0.00 55.69 52.34 1vsc s MET 58 Cb -0.16 -3.26 0.09 0.00 2.01 0.00 0.00 34.83 33.51 1vsc s MET 58 CO 0.10 -0.90 0.21 1.21 -0.01 0.00 0.00 175.02 175.63 1vsc s ASN 59 N 1.19 1.65 0.53 3.03 2.47 -1.26 0.41 114.94 122.95 1vsc s ASN 59 Ca 0.06 -0.38 -0.11 0.00 0.42 0.00 0.00 52.86 52.85 1vsc s ASN 59 Cb -0.20 0.28 -0.05 0.00 -1.45 0.00 0.00 41.25 39.83 1vsc s ASN 59 CO -0.06 -0.34 0.92 -2.16 -3.72 0.00 0.00 177.10 171.73 1vsc s PRO 60 N 2.29 3.69 0.26 0.43 0.04 -1.26 -5.02 135.00 135.43 1vsc s PRO 60 Ca 0.07 0.61 -0.29 0.00 0.04 0.00 0.00 61.00 61.43 1vsc s PRO 60 Cb -0.16 -2.22 -0.09 0.00 0.04 0.00 0.00 34.50 32.07 1vsc s PRO 60 CO -0.15 -0.33 0.98 0.54 0.04 0.00 0.00 177.00 178.08 1vsc s VAL 61 N -2.82 3.94 0.04 -0.36 0.11 0.25 -4.81 120.40 116.74 1vsc s VAL 61 Ca 0.53 1.90 0.00 0.00 -2.93 0.00 0.00 61.98 61.48 1vsc s VAL 61 Cb -0.10 -4.19 -0.00 0.00 -1.53 0.00 0.00 36.38 30.56 1vsc s VAL 61 CO 0.43 0.41 0.05 -0.24 -3.33 0.00 0.00 175.10 172.42 1vsc n SER 62 N 1.27 -0.12 -0.06 3.54 2.88 -1.26 -0.50 113.62 119.36 1vsc n SER 62 Ca -0.01 -1.20 0.14 0.00 -1.33 0.00 0.00 58.87 56.46 1vsc n SER 62 Cb 0.47 0.24 0.55 0.00 -0.75 0.00 0.00 64.21 64.72 1vsc n SER 62 CO 0.00 0.00 0.00 -0.26 -1.23 0.00 0.00 175.04 173.55 1vsc h PHE 63 N 1.11 0.33 0.00 0.66 0.04 -1.97 -0.36 116.94 116.74 1vsc h PHE 63 Ca -0.03 0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.75 1vsc h PHE 63 Cb 0.12 -0.11 0.00 0.00 2.20 0.00 0.00 35.95 38.17 1vsc h PHE 63 CO 0.00 0.15 0.00 0.41 -0.60 0.00 0.00 178.31 178.27 1vsc n GLY 64 N -1.55 -0.68 0.42 -1.45 0.00 -1.26 -2.26 105.19 98.41 1vsc n GLY 64 Ca 0.10 -0.06 0.04 0.00 0.00 0.00 0.00 46.02 46.10 1vsc n GLY 64 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1vsc n ASN 65 N -0.73 2.50 -4.51 1.61 5.03 -0.15 -4.68 115.26 114.34 1vsc n ASN 65 Ca 0.07 -1.91 -0.43 0.00 0.87 0.00 0.00 54.58 53.19 1vsc n ASN 65 Cb 0.03 -0.14 -0.02 0.00 -1.02 0.00 0.00 39.78 38.64 1vsc n ASN 65 CO 0.00 0.00 0.00 -0.70 -1.83 0.00 0.00 177.26 174.73 1vsc s GLU 66 N -0.95 3.73 0.23 3.52 2.12 -0.96 -4.72 118.70 121.67 1vsc s GLU 66 Ca 0.15 -1.71 -0.22 0.00 0.36 0.00 0.00 54.97 53.55 1vsc s GLU 66 Cb 0.08 -5.17 0.05 0.00 0.26 0.00 0.00 34.13 29.35 1vsc s GLU 66 CO 0.11 -1.99 0.88 -1.01 -0.54 0.00 0.00 175.26 172.71 1vsc s HIS 67 N 3.49 -0.08 -0.23 5.30 3.76 -1.12 -5.01 115.29 121.39 1vsc s HIS 67 Ca 0.42 -0.33 -0.15 0.00 -0.15 0.00 0.00 55.06 54.84 1vsc s HIS 67 Cb -0.02 0.70 -0.04 0.00 1.11 0.00 0.00 32.58 34.33 1vsc s HIS 67 CO -0.06 -1.07 0.38 -1.12 -0.85 0.00 0.00 174.74 172.02 1vsc s SER 68 N -3.02 6.35 -0.21 1.40 0.01 -1.26 0.12 113.70 117.08 1vsc s SER 68 Ca 0.14 0.40 -0.12 0.00 1.31 0.00 0.00 55.95 57.68 1vsc s SER 68 Cb -0.03 -2.22 -0.05 0.00 0.21 0.00 0.00 66.02 63.93 1vsc s SER 68 CO 0.05 -0.12 0.20 -0.31 0.41 0.00 0.00 173.24 173.48 1vsc s TYR 69 N 1.63 3.37 -0.20 2.43 2.02 0.79 -2.28 117.35 125.10 1vsc s TYR 69 Ca 0.17 0.36 -0.03 0.00 -0.37 0.00 0.00 57.07 57.20 1vsc s TYR 69 Cb -0.15 -2.29 -0.01 0.00 -0.40 0.00 0.00 41.96 39.12 1vsc s TYR 69 CO 0.08 0.14 -0.07 -0.51 -1.57 0.00 0.00 175.55 173.62 1vsc s LEU 70 N 0.83 2.77 -0.13 -1.29 1.43 0.12 -0.92 118.68 121.49 1vsc s LEU 70 Ca 0.10 -0.42 -0.23 0.00 -1.03 0.00 0.00 54.13 52.56 1vsc s LEU 70 Cb -0.13 -1.69 -0.03 0.00 0.03 0.00 0.00 46.19 44.37 1vsc s LEU 70 CO 0.03 0.01 0.69 0.00 0.23 0.00 0.00 176.35 177.31 1vsc s THR 72 N 1.39 4.07 -0.19 0.00 2.01 0.13 -2.03 115.64 121.03 1vsc s THR 72 Ca 0.34 -0.68 -0.10 0.00 0.31 0.00 0.00 61.69 61.57 1vsc s THR 72 Cb -0.17 -3.11 -0.05 0.00 0.01 0.00 0.00 72.50 69.18 1vsc s THR 72 CO 0.14 0.06 0.14 0.00 -0.69 0.00 0.00 174.62 174.27 1vsc s ALA 73 N 1.51 3.71 -0.09 7.40 0.00 -0.16 -1.73 121.76 132.41 1vsc s ALA 73 Ca 0.03 -0.67 0.04 0.00 0.00 0.00 0.00 51.96 51.36 1vsc s ALA 73 Cb -0.17 -2.15 -0.00 0.00 0.00 0.00 0.00 23.12 20.79 1vsc s ALA 73 CO 0.03 0.22 -0.24 0.99 0.00 0.00 0.00 175.76 176.77 1vsc s THR 74 N 0.17 2.12 -0.05 0.00 2.01 0.48 -0.29 115.64 120.09 1vsc s THR 74 Ca 0.09 -1.01 0.01 0.00 0.31 0.00 0.00 61.69 61.10 1vsc s THR 74 Cb -0.11 -1.80 0.02 0.00 0.01 0.00 0.00 72.50 70.62 1vsc s THR 74 CO -0.01 0.56 -0.06 0.00 -0.69 0.00 0.00 174.62 174.42 1vsc n GLU 76 N 3.99 0.00 -0.24 0.00 1.02 -1.26 -0.20 120.64 123.94 1vsc n GLU 76 Ca -0.25 0.00 0.09 0.00 -0.02 0.00 0.00 57.16 56.99 1vsc n GLU 76 Cb 0.51 0.00 0.23 0.00 -0.02 0.00 0.00 31.44 32.16 1vsc n GLU 76 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 1vsc n SER 77 N 4.39 3.39 -4.75 1.62 7.64 -1.26 -4.97 113.62 119.69 1vsc n SER 77 Ca 0.00 -1.96 -0.36 0.00 1.01 0.00 0.00 58.87 57.56 1vsc n SER 77 Cb 0.00 -0.32 -0.08 0.00 -1.01 0.00 0.00 64.21 62.80 1vsc n SER 77 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 1vsc s ARG 78 N -1.10 3.54 -0.03 1.43 0.52 0.72 -5.10 118.95 118.93 1vsc s ARG 78 Ca 0.36 -0.27 0.03 0.00 -0.52 0.00 0.00 55.73 55.33 1vsc s ARG 78 Cb 0.20 -3.12 -0.03 0.00 0.52 0.00 0.00 34.95 32.52 1vsc s ARG 78 CO 0.26 0.58 -0.09 -1.59 0.02 0.00 0.00 175.30 174.48 1vsc s LYS 79 N -0.49 2.58 0.15 3.54 -2.85 -1.26 -0.29 119.74 121.12 1vsc s LYS 79 Ca 0.11 -0.68 0.10 0.00 -1.00 0.00 0.00 55.97 54.49 1vsc s LYS 79 Cb -0.12 -2.49 -0.04 0.00 -2.06 0.00 0.00 37.83 33.12 1vsc s LYS 79 CO 0.02 0.62 -0.22 -0.51 0.10 0.00 0.00 175.35 175.36 1vsc s LEU 80 N -1.11 2.38 0.09 2.77 1.43 0.60 -4.99 118.68 119.85 1vsc s LEU 80 Ca 0.14 -0.80 0.05 0.00 -1.03 0.00 0.00 54.13 52.50 1vsc s LEU 80 Cb -0.11 -0.99 -0.03 0.00 0.03 0.00 0.00 46.19 45.08 1vsc s LEU 80 CO 0.04 0.06 -0.14 -1.61 0.23 0.00 0.00 176.35 174.94 1vsc s GLU 81 N -2.41 0.89 -0.28 1.70 2.02 -1.26 -0.98 118.70 118.37 1vsc s GLU 81 Ca 0.14 -1.07 -0.15 0.00 0.02 0.00 0.00 54.97 53.91 1vsc s GLU 81 Cb -0.08 -0.85 0.10 0.00 0.10 0.00 0.00 34.13 33.40 1vsc s GLU 81 CO 0.07 0.18 0.74 0.21 0.02 0.00 0.00 175.26 176.47 1vsc s LYS 82 N -2.12 0.63 0.30 1.61 2.20 -0.86 -5.01 119.74 116.49 1vsc s LYS 82 Ca 0.02 1.16 0.08 0.00 -0.36 0.00 0.00 55.97 56.87 1vsc s LYS 82 Cb -0.08 0.23 -0.04 0.00 -1.51 0.00 0.00 37.83 36.43 1vsc s LYS 82 CO 0.02 -0.14 0.18 0.20 -0.36 0.00 0.00 175.35 175.25 1vsc s GLY 83 N 1.77 1.66 -0.04 5.54 0.00 -1.26 -1.00 107.32 113.99 1vsc s GLY 83 Ca -0.09 -1.61 -0.00 0.00 0.00 0.00 0.00 44.72 43.02 1vsc s GLY 83 CO -0.19 -1.60 0.01 -0.42 0.00 0.00 0.00 173.10 170.91 1vsc s ILE 84 N -2.27 0.14 -0.13 0.90 1.01 -0.09 -4.63 121.20 116.13 1vsc s ILE 84 Ca 0.36 0.15 -0.23 0.00 0.00 0.00 0.00 60.65 60.93 1vsc s ILE 84 Cb -0.06 -0.28 -0.03 0.00 0.01 0.00 0.00 42.46 42.11 1vsc s ILE 84 CO 0.24 0.16 0.69 -1.58 0.00 0.00 0.00 174.94 174.45 1vsc s GLN 85 N 1.32 4.33 -0.31 2.79 2.00 -0.77 -0.15 119.66 128.88 1vsc s GLN 85 Ca -0.06 0.79 -0.07 0.00 -2.00 0.00 0.00 55.36 54.03 1vsc s GLN 85 Cb -0.13 -3.51 0.02 0.00 0.80 0.00 0.00 33.01 30.19 1vsc s GLN 85 CO -0.02 -0.10 0.09 0.08 -0.50 0.00 0.00 175.29 174.84 1vsc s VAL 86 N 1.38 3.96 0.06 1.34 1.01 0.12 -0.46 120.40 127.81 1vsc s VAL 86 Ca 0.34 -0.81 -0.02 0.00 0.00 0.00 0.00 61.98 61.49 1vsc s VAL 86 Cb -0.17 -3.10 -0.04 0.00 0.00 0.00 0.00 36.38 33.07 1vsc s VAL 86 CO 0.14 -0.00 0.23 -1.61 0.00 0.00 0.00 175.10 173.86 1vsc s GLU 87 N 1.48 3.48 0.09 2.72 2.02 0.25 -2.81 118.70 125.93 1vsc s GLU 87 Ca 0.01 -0.34 0.05 0.00 0.02 0.00 0.00 54.97 54.71 1vsc s GLU 87 Cb -0.18 -3.02 -0.03 0.00 0.10 0.00 0.00 34.13 30.99 1vsc s GLU 87 CO 0.03 0.60 -0.12 0.96 0.02 0.00 0.00 175.26 176.75 1vsc s ILE 88 N -1.48 1.09 0.14 -1.63 -4.36 -1.26 -0.22 121.20 113.47 1vsc s ILE 88 Ca 0.34 -1.53 -0.12 0.00 -0.26 0.00 0.00 60.65 59.08 1vsc s ILE 88 Cb -0.13 -1.28 0.01 0.00 1.25 0.00 0.00 42.46 42.31 1vsc s ILE 88 CO 0.25 -0.40 0.32 -0.72 0.24 0.00 0.00 174.94 174.63 1vsc s TYR 89 N -1.93 0.08 -0.10 1.37 1.13 -0.63 -4.64 117.35 112.64 1vsc s TYR 89 Ca 0.03 -0.45 -0.05 0.00 -1.41 0.00 0.00 57.07 55.19 1vsc s TYR 89 Cb -0.06 0.10 0.05 0.00 -1.10 0.00 0.00 41.96 40.94 1vsc s TYR 89 CO 0.02 -0.69 0.23 0.45 -2.51 0.00 0.00 175.55 173.04 1vsc s SER 90 N -2.88 -0.17 -0.45 -0.18 0.15 0.93 -0.76 113.70 110.34 1vsc s SER 90 Ca 0.08 0.49 0.07 0.00 0.70 0.00 0.00 55.95 57.29 1vsc s SER 90 Cb 0.03 0.39 0.33 0.00 -1.71 0.00 0.00 66.02 65.05 1vsc s SER 90 CO -0.07 -0.17 1.10 0.33 1.20 0.00 0.00 173.24 175.63 1vsc n PHE 91 N 4.33 -2.56 1.13 3.44 7.35 -1.25 -1.15 117.46 128.75 1vsc n PHE 91 Ca -0.24 -2.26 0.14 0.00 -0.76 0.00 0.00 57.45 54.33 1vsc n PHE 91 Cb 0.52 1.45 0.58 0.00 0.35 0.00 0.00 39.48 42.39 1vsc n PHE 91 CO 0.00 0.00 0.00 -0.35 -0.76 0.00 0.00 176.76 175.65 1vsc n PRO 92 N 0.27 0.16 -4.11 -7.13 -0.04 -1.26 -4.92 135.00 117.98 1vsc n PRO 92 Ca 0.07 -0.03 -0.14 0.00 -0.04 0.00 0.00 63.50 63.36 1vsc n PRO 92 Cb 0.71 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.55 1vsc n PRO 92 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1vsc s LYS 93 N -2.86 0.54 0.55 0.54 1.02 -1.26 -5.13 119.74 113.14 1vsc s LYS 93 Ca 0.18 -0.63 -0.19 0.00 0.02 0.00 0.00 55.97 55.35 1vsc s LYS 93 Cb 0.19 -0.38 -0.05 0.00 -0.52 0.00 0.00 37.83 37.06 1vsc s LYS 93 CO 0.54 0.08 1.12 -0.51 -0.92 0.00 0.00 175.35 175.66 1vsc s ASP 94 N -1.21 5.70 1.00 2.83 1.01 -1.26 -4.72 116.67 120.02 1vsc s ASP 94 Ca -0.06 2.14 -0.12 0.00 0.71 0.00 0.00 52.55 55.22 1vsc s ASP 94 Cb -0.08 -2.58 0.19 0.00 1.01 0.00 0.00 42.92 41.46 1vsc s ASP 94 CO 0.00 -1.23 1.08 -2.16 0.21 0.00 0.00 175.17 173.07 1vsc s PRO 95 N -3.37 0.41 -0.15 8.23 0.04 -1.26 -4.73 135.00 134.17 1vsc s PRO 95 Ca 0.72 0.66 -0.00 0.00 0.04 0.00 0.00 61.00 62.41 1vsc s PRO 95 Cb -0.23 -1.72 0.03 0.00 0.04 0.00 0.00 34.50 32.62 1vsc s PRO 95 CO 0.28 -2.78 -0.08 -2.00 0.04 0.00 0.00 177.00 172.46 1vsc s GLU 96 N -4.87 1.66 0.13 4.56 2.12 0.14 -4.53 118.70 117.90 1vsc s GLU 96 Ca 0.65 -0.48 -0.18 0.00 0.36 0.00 0.00 54.97 55.32 1vsc s GLU 96 Cb -0.19 -1.94 -0.07 0.00 0.26 0.00 0.00 34.13 32.18 1vsc s GLU 96 CO 0.59 -0.35 0.59 0.42 -0.54 0.00 0.00 175.26 175.96 1vsc s ILE 97 N 1.61 4.74 -0.21 -3.70 1.01 -1.26 -1.08 121.20 122.31 1vsc s ILE 97 Ca 0.02 1.10 -0.04 0.00 0.00 0.00 0.00 60.65 61.74 1vsc s ILE 97 Cb -0.14 -3.84 0.10 0.00 0.01 0.00 0.00 42.46 38.59 1vsc s ILE 97 CO -0.08 0.39 0.24 -2.28 0.00 0.00 0.00 174.94 173.20 1vsc s HIS 98 N -1.31 -0.34 0.19 3.97 2.46 0.21 -4.97 115.29 115.50 1vsc s HIS 98 Ca 0.35 0.26 -0.30 0.00 0.47 0.00 0.00 55.06 55.84 1vsc s HIS 98 Cb -0.18 -0.33 -0.08 0.00 -0.13 0.00 0.00 32.58 31.87 1vsc s HIS 98 CO 0.20 -0.63 0.95 -0.51 -2.47 0.00 0.00 174.74 172.28 1vsc s LEU 99 N 2.35 4.58 0.00 8.88 1.43 -1.26 -0.54 118.68 134.13 1vsc s LEU 99 Ca 0.08 1.89 0.00 0.00 -1.03 0.00 0.00 54.13 55.07 1vsc s LEU 99 Cb -0.16 -3.60 0.00 0.00 0.03 0.00 0.00 46.19 42.46 1vsc s LEU 99 CO -0.13 0.06 0.83 -1.20 0.23 0.00 0.00 176.35 176.13 1vsc n SER 100 N 2.03 0.00 0.00 2.29 7.64 0.25 -4.89 113.62 120.95 1vsc n SER 100 Ca -0.00 0.34 0.00 0.00 1.01 0.00 0.00 58.87 60.22 1vsc n SER 100 Cb 0.48 -0.34 0.00 0.00 -1.01 0.00 0.00 64.21 63.34 1vsc n SER 100 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1vsc n GLY 101 N -1.33 0.33 3.71 0.23 0.00 -1.26 -4.89 105.19 101.97 1vsc n GLY 101 Ca 0.00 -1.40 -0.60 0.00 0.00 0.00 0.00 46.02 44.02 1vsc n GLY 101 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1vsc n PRO 102 N 0.00 0.82 -2.76 1.61 -0.04 -1.26 -4.92 135.00 128.46 1vsc n PRO 102 Ca 0.00 0.30 -0.43 0.00 -0.04 0.00 0.00 63.50 63.33 1vsc n PRO 102 Cb 0.00 -1.93 -0.03 0.00 -0.04 0.00 0.00 33.50 31.50 1vsc n PRO 102 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1vsc s LEU 103 N 3.21 3.94 -0.02 1.53 2.96 -1.26 -5.00 118.68 124.04 1vsc s LEU 103 Ca 0.99 0.56 0.02 0.00 -0.22 0.00 0.00 54.13 55.48 1vsc s LEU 103 Cb -1.18 -3.33 0.01 0.00 0.50 0.00 0.00 46.19 42.19 1vsc s LEU 103 CO 0.69 -0.94 -0.06 -1.61 -1.32 0.00 0.00 176.35 173.11 1vsc s GLU 104 N 3.66 0.69 0.09 1.98 2.02 -1.26 -4.96 118.70 120.93 1vsc s GLU 104 Ca 0.40 -0.20 -0.34 0.00 0.02 0.00 0.00 54.97 54.85 1vsc s GLU 104 Cb -0.11 -0.68 -0.14 0.00 0.10 0.00 0.00 34.13 33.30 1vsc s GLU 104 CO 0.21 0.06 1.64 0.00 0.02 0.00 0.00 175.26 177.19 1vsc n ALA 105 N 3.38 1.10 -0.77 5.21 0.00 -1.26 -1.64 120.51 126.53 1vsc n ALA 105 Ca -0.19 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.67 1vsc n ALA 105 Cb 0.55 -2.37 0.00 0.00 0.00 0.00 0.00 19.45 17.63 1vsc n ALA 105 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1vsc n GLY 106 N 3.61 1.32 3.62 0.00 0.00 -0.87 -5.00 105.19 107.88 1vsc n GLY 106 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 1vsc n GLY 106 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1vsc s LYS 107 N -0.06 4.03 0.21 1.61 2.36 -0.65 -4.86 119.74 122.39 1vsc s LYS 107 Ca 0.00 -0.08 -0.32 0.00 -2.55 0.00 0.00 55.97 53.03 1vsc s LYS 107 Cb 0.00 -3.62 -0.12 0.00 -1.05 0.00 0.00 37.83 33.04 1vsc s LYS 107 CO 0.00 -0.16 1.71 -0.35 1.55 0.00 0.00 175.35 178.11 1vsc n PRO 108 N 4.95 2.77 -3.92 4.03 -0.04 -1.26 -4.39 135.00 137.13 1vsc n PRO 108 Ca -0.11 1.00 -0.14 0.00 -0.04 0.00 0.00 63.50 64.21 1vsc n PRO 108 Cb 0.51 -2.84 -0.15 0.00 -0.04 0.00 0.00 33.50 30.99 1vsc n PRO 108 CO 0.00 0.00 0.00 -1.50 -0.04 0.00 0.00 175.50 173.96 1vsc s ILE 109 N 1.08 0.11 -0.16 0.52 2.07 0.29 -4.89 121.20 120.22 1vsc s ILE 109 Ca 0.74 0.01 -0.20 0.00 -1.41 0.00 0.00 60.65 59.79 1vsc s ILE 109 Cb -0.51 -0.14 -0.03 0.00 0.13 0.00 0.00 42.46 41.91 1vsc s ILE 109 CO 0.34 0.07 0.60 -0.89 -1.91 0.00 0.00 174.94 173.14 1vsc s THR 110 N 0.34 5.07 -0.28 4.00 2.01 -1.26 -1.35 115.64 124.17 1vsc s THR 110 Ca -0.03 1.15 -0.12 0.00 0.31 0.00 0.00 61.69 63.00 1vsc s THR 110 Cb -0.05 -3.92 -0.04 0.00 0.01 0.00 0.00 72.50 68.49 1vsc s THR 110 CO -0.01 0.19 0.24 -0.69 -0.69 0.00 0.00 174.62 173.66 1vsc s VAL 111 N 1.42 5.27 -0.25 3.82 1.01 0.16 0.88 120.40 132.72 1vsc s VAL 111 Ca 0.29 0.22 -0.06 0.00 0.00 0.00 0.00 61.98 62.43 1vsc s VAL 111 Cb -0.16 -3.59 -0.01 0.00 0.00 0.00 0.00 36.38 32.62 1vsc s VAL 111 CO 0.11 0.20 0.04 -0.75 0.00 0.00 0.00 175.10 174.71 1vsc s LYS 112 N 1.83 3.45 -0.22 2.72 2.20 0.30 -1.59 119.74 128.43 1vsc s LYS 112 Ca 0.09 -0.61 -0.04 0.00 -0.36 0.00 0.00 55.97 55.05 1vsc s LYS 112 Cb -0.16 -3.25 -0.01 0.00 -1.51 0.00 0.00 37.83 32.90 1vsc s LYS 112 CO 0.11 -0.25 -0.03 0.00 -0.36 0.00 0.00 175.35 174.81 1vsc s SER 114 N 1.49 3.32 -0.05 0.00 0.01 -0.24 -1.22 113.70 117.01 1vsc s SER 114 Ca 0.06 -0.84 0.02 0.00 1.31 0.00 0.00 55.95 56.50 1vsc s SER 114 Cb -0.14 -0.24 0.02 0.00 0.21 0.00 0.00 66.02 65.87 1vsc s SER 114 CO -0.03 0.12 -0.09 -0.69 0.41 0.00 0.00 173.24 172.96 1vsc s VAL 115 N -1.57 0.86 0.10 3.43 1.01 0.60 0.25 120.40 125.09 1vsc s VAL 115 Ca 0.19 -0.33 0.02 0.00 0.00 0.00 0.00 61.98 61.86 1vsc s VAL 115 Cb -0.08 -0.82 -0.04 0.00 0.00 0.00 0.00 36.38 35.44 1vsc s VAL 115 CO 0.09 0.29 0.19 0.00 0.00 0.00 0.00 175.10 175.67 1vsc s ALA 116 N 0.70 3.85 -1.35 5.51 0.00 -1.26 -0.28 121.76 128.93 1vsc s ALA 116 Ca -0.12 -0.97 -0.07 0.00 0.00 0.00 0.00 51.96 50.79 1vsc s ALA 116 Cb -0.15 -1.67 0.02 0.00 0.00 0.00 0.00 23.12 21.32 1vsc s ALA 116 CO 0.02 0.70 1.07 -0.25 0.00 0.00 0.00 175.76 177.30 1vsc n ASP 117 N 0.03 -4.67 -4.85 0.00 8.00 -1.24 -4.42 116.55 109.40 1vsc n ASP 117 Ca -0.07 -0.62 -0.37 0.00 0.71 0.00 0.00 54.79 54.44 1vsc n ASP 117 Cb 0.52 -4.78 -0.06 0.00 -0.02 0.00 0.00 41.12 36.78 1vsc n ASP 117 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1vsc s VAL 118 N -3.36 5.47 -0.21 2.53 1.01 -1.26 -3.94 120.40 120.64 1vsc s VAL 118 Ca 0.41 0.24 -0.12 0.00 0.00 0.00 0.00 61.98 62.52 1vsc s VAL 118 Cb -0.19 -3.43 0.07 0.00 0.00 0.00 0.00 36.38 32.83 1vsc s VAL 118 CO 0.75 0.58 0.51 -0.47 0.00 0.00 0.00 175.10 176.48 1vsc s TYR 119 N -0.75 -0.79 0.30 5.22 5.04 -0.30 -4.40 117.35 121.67 1vsc s TYR 119 Ca 0.14 1.62 -0.08 0.00 -2.44 0.00 0.00 57.07 56.31 1vsc s TYR 119 Cb -0.12 0.41 -0.06 0.00 0.35 0.00 0.00 41.96 42.54 1vsc s TYR 119 CO 0.03 -0.42 0.61 -1.25 -1.34 0.00 0.00 175.55 173.18 1vsc s PRO 120 N 1.56 3.73 0.05 4.97 0.04 -1.26 -0.05 135.00 144.04 1vsc s PRO 120 Ca -0.09 0.21 -0.23 0.00 0.04 0.00 0.00 61.00 60.93 1vsc s PRO 120 Cb -0.07 -2.58 -0.15 0.00 0.04 0.00 0.00 34.50 31.74 1vsc s PRO 120 CO -0.15 0.18 1.54 0.74 0.04 0.00 0.00 177.00 179.35 1vsc h PHE 121 N 1.85 0.11 0.00 0.56 0.04 -1.85 -2.80 116.94 114.85 1vsc h PHE 121 Ca -0.47 -0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.28 1vsc h PHE 121 Cb 1.18 -0.03 0.00 0.00 2.20 0.00 0.00 35.95 39.30 1vsc h PHE 121 CO 0.59 0.29 0.06 -0.40 -0.60 0.00 0.00 178.31 178.26 1vsc n ASP 122 N -4.92 0.00 -1.12 2.17 5.68 -1.10 0.38 116.55 117.65 1vsc n ASP 122 Ca -0.06 0.35 0.11 0.00 -0.50 0.00 0.00 54.79 54.69 1vsc n ASP 122 Cb 0.14 -0.35 0.22 0.00 -1.14 0.00 0.00 41.12 39.99 1vsc n ASP 122 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.20 176.41 1vsc n ARG 123 N -1.34 2.48 -4.17 0.11 5.12 -1.06 -4.73 116.66 113.07 1vsc n ARG 123 Ca 0.00 -2.29 -0.34 0.00 -1.93 0.00 0.00 57.85 53.29 1vsc n ARG 123 Cb 0.06 -1.49 -0.10 0.00 -1.16 0.00 0.00 32.46 29.77 1vsc n ARG 123 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 1vsc s LEU 124 N -1.33 3.63 -0.09 0.55 2.96 0.16 -2.07 118.68 122.49 1vsc s LEU 124 Ca 0.38 0.04 0.03 0.00 -0.22 0.00 0.00 54.13 54.35 1vsc s LEU 124 Cb 0.22 -1.89 0.01 0.00 0.50 0.00 0.00 46.19 45.02 1vsc s LEU 124 CO 0.30 0.21 -0.17 -0.70 -1.32 0.00 0.00 176.35 174.66 1vsc s GLU 125 N 0.16 2.34 -0.17 1.98 2.12 -0.59 -3.44 118.70 121.09 1vsc s GLU 125 Ca 0.02 -0.62 -0.03 0.00 0.36 0.00 0.00 54.97 54.70 1vsc s GLU 125 Cb -0.13 -1.88 -0.02 0.00 0.26 0.00 0.00 34.13 32.37 1vsc s GLU 125 CO 0.01 0.05 -0.06 0.42 -0.54 0.00 0.00 175.26 175.14 1vsc s ILE 126 N 0.67 3.54 -0.09 -3.70 1.01 0.27 0.09 121.20 123.00 1vsc s ILE 126 Ca -0.13 -0.47 0.04 0.00 0.00 0.00 0.00 60.65 60.09 1vsc s ILE 126 Cb -0.16 -2.56 -0.01 0.00 0.01 0.00 0.00 42.46 39.74 1vsc s ILE 126 CO 0.03 0.47 -0.21 -1.81 0.00 0.00 0.00 174.94 173.42 1vsc s ASP 127 N 0.78 3.37 -0.35 3.58 1.01 0.21 0.15 116.67 125.43 1vsc s ASP 127 Ca -0.02 -0.46 -0.09 0.00 0.71 0.00 0.00 52.55 52.69 1vsc s ASP 127 Cb -0.15 -1.23 0.02 0.00 1.01 0.00 0.00 42.92 42.58 1vsc s ASP 127 CO 0.02 0.20 0.16 -0.22 0.21 0.00 0.00 175.17 175.54 1vsc s LEU 128 N 0.09 4.43 0.26 1.23 2.96 0.17 0.33 118.68 128.15 1vsc s LEU 128 Ca -0.10 -0.93 0.10 0.00 -0.22 0.00 0.00 54.13 52.98 1vsc s LEU 128 Cb -0.16 -1.96 -0.04 0.00 0.50 0.00 0.00 46.19 44.53 1vsc s LEU 128 CO 0.06 -0.32 -0.06 -0.76 -1.32 0.00 0.00 176.35 173.95 1vsc s LEU 129 N 1.52 3.02 -0.50 -0.68 1.02 0.32 -0.58 118.68 122.81 1vsc s LEU 129 Ca 0.01 -0.74 0.03 0.00 0.02 0.00 0.00 54.13 53.46 1vsc s LEU 129 Cb -0.19 -1.55 0.15 0.00 0.02 0.00 0.00 46.19 44.63 1vsc s LEU 129 CO 0.05 0.02 0.33 -0.75 0.02 0.00 0.00 176.35 176.02 1vsc s LYS 130 N -3.58 1.45 3.11 1.70 2.20 0.51 0.33 119.74 125.45 1vsc s LYS 130 Ca 0.31 -2.36 0.00 0.00 -0.36 0.00 0.00 55.97 53.56 1vsc s LYS 130 Cb -0.06 -2.31 0.00 0.00 -1.51 0.00 0.00 37.83 33.95 1vsc s LYS 130 CO 0.18 -1.26 0.00 0.41 -0.36 0.00 0.00 175.35 174.32 1vsc n GLY 131 N 2.96 0.62 1.77 5.54 0.00 -1.11 -2.88 105.19 112.08 1vsc n GLY 131 Ca 0.18 -1.05 -0.03 0.00 0.00 0.00 0.00 46.02 45.11 1vsc n GLY 131 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1vsc n ASP 132 N 3.56 4.45 -4.34 1.61 9.92 -1.26 -4.89 116.55 125.60 1vsc n ASP 132 Ca 0.00 -2.96 -0.39 0.00 -0.53 0.00 0.00 54.79 50.91 1vsc n ASP 132 Cb 0.00 -0.70 -0.12 0.00 -0.64 0.00 0.00 41.12 39.66 1vsc n ASP 132 CO 0.00 0.00 0.00 -2.28 0.13 0.00 0.00 177.20 175.05 1vsc s HIS 133 N -2.54 3.23 -0.08 1.24 2.46 -1.14 -5.05 115.29 113.42 1vsc s HIS 133 Ca 0.45 -1.11 -0.30 0.00 0.47 0.00 0.00 55.06 54.58 1vsc s HIS 133 Cb 0.36 -2.35 -0.04 0.00 -0.13 0.00 0.00 32.58 30.42 1vsc s HIS 133 CO 0.12 -0.66 1.44 -1.17 -2.47 0.00 0.00 174.74 172.00 1vsc s LEU 134 N 1.49 4.27 -0.21 8.88 0.20 -1.26 -0.37 118.68 131.68 1vsc s LEU 134 Ca 0.01 2.01 -0.09 0.00 0.69 0.00 0.00 54.13 56.75 1vsc s LEU 134 Cb -0.19 -3.54 -0.19 0.00 -0.43 0.00 0.00 46.19 41.84 1vsc s LEU 134 CO 0.05 -0.80 0.00 0.23 -0.29 0.00 0.00 176.35 175.54 1vsc n MET 135 N 6.39 0.65 -3.56 1.98 2.81 0.25 -4.94 117.12 120.70 1vsc n MET 135 Ca 0.15 0.29 -0.17 0.00 -1.81 0.00 0.00 57.70 56.16 1vsc n MET 135 Cb 0.44 -1.61 -0.06 0.00 -0.71 0.00 0.00 33.22 31.27 1vsc n MET 135 CO 0.00 0.00 0.00 0.21 1.51 0.00 0.00 175.97 177.69 1vsc s LYS 136 N -2.50 0.98 0.01 0.03 2.20 -1.06 -5.03 119.74 114.38 1vsc s LYS 136 Ca -0.31 0.40 0.03 0.00 -0.36 0.00 0.00 55.97 55.73 1vsc s LYS 136 Cb 0.09 0.46 -0.01 0.00 -1.51 0.00 0.00 37.83 36.86 1vsc s LYS 136 CO 0.62 -0.27 -0.11 -1.54 -0.36 0.00 0.00 175.35 173.70 1vsc s SER 137 N -0.84 1.24 -0.01 1.43 1.04 -1.26 0.42 113.70 115.72 1vsc s SER 137 Ca -0.09 -0.26 0.05 0.00 0.48 0.00 0.00 55.95 56.13 1vsc s SER 137 Cb -0.01 -0.11 -0.01 0.00 0.10 0.00 0.00 66.02 65.98 1vsc s SER 137 CO 0.08 0.08 -0.17 -1.58 0.98 0.00 0.00 173.24 172.62 1vsc s GLN 138 N -0.52 1.41 0.18 4.02 2.00 0.12 -4.96 119.66 121.92 1vsc s GLN 138 Ca 0.02 -0.61 0.09 0.00 -2.00 0.00 0.00 55.36 52.86 1vsc s GLN 138 Cb -0.05 -1.36 -0.04 0.00 0.80 0.00 0.00 33.01 32.36 1vsc s GLN 138 CO 0.00 0.36 -0.19 -1.21 -0.50 0.00 0.00 175.29 173.76 1vsc s GLU 139 N -0.38 1.34 -0.44 1.67 2.02 -1.26 -0.56 118.70 121.10 1vsc s GLU 139 Ca 0.06 -1.47 0.09 0.00 0.02 0.00 0.00 54.97 53.67 1vsc s GLU 139 Cb -0.07 -1.41 0.31 0.00 0.10 0.00 0.00 34.13 33.06 1vsc s GLU 139 CO -0.01 0.28 0.70 1.19 0.02 0.00 0.00 175.26 177.45 1vsc n PHE 140 N 0.15 0.96 1.82 1.61 3.01 -1.22 -4.85 117.46 118.93 1vsc n PHE 140 Ca -0.12 -3.80 0.13 0.00 1.01 0.00 0.00 57.45 54.67 1vsc n PHE 140 Cb 0.57 -0.42 0.71 0.00 -0.01 0.00 0.00 39.48 40.33 1vsc n PHE 140 CO 0.00 0.00 0.00 1.47 1.01 0.00 0.00 176.76 179.24 1vsc n LEU 141 N 0.60 0.48 -4.00 4.37 -0.00 -1.26 -2.72 117.00 114.47 1vsc n LEU 141 Ca 0.25 -0.18 -0.31 0.00 -0.00 0.00 0.00 56.01 55.78 1vsc n LEU 141 Cb 0.55 -0.01 -0.15 0.00 -0.00 0.00 0.00 43.42 43.81 1vsc n LEU 141 CO 0.24 0.09 -0.31 -1.61 -0.00 0.00 0.00 177.39 175.80 1vsc s GLU 142 N -1.98 1.52 -0.00 1.47 0.41 -1.26 -4.90 118.70 113.96 1vsc s GLU 142 Ca 0.40 -1.95 0.02 0.00 -0.41 0.00 0.00 54.97 53.03 1vsc s GLU 142 Cb 0.19 -3.19 -0.01 0.00 -1.78 0.00 0.00 34.13 29.35 1vsc s GLU 142 CO 0.32 -0.96 -0.08 0.34 -0.49 0.00 0.00 175.26 174.39 1vsc s ASP 143 N 0.77 0.92 -0.33 -0.19 -1.08 -1.26 -5.05 116.67 110.44 1vsc s ASP 143 Ca 0.12 -0.15 0.10 0.00 -0.52 0.00 0.00 52.55 52.09 1vsc s ASP 143 Cb -0.20 -0.10 0.75 0.00 -1.46 0.00 0.00 42.92 41.91 1vsc s ASP 143 CO -0.07 0.09 1.82 0.00 0.52 0.00 0.00 175.17 177.52 1vsc n ALA 144 N 2.86 4.64 -2.81 3.66 0.00 -1.26 -4.56 120.51 123.04 1vsc n ALA 144 Ca -0.13 -2.39 -0.02 0.00 0.00 0.00 0.00 53.44 50.90 1vsc n ALA 144 Cb 0.57 -1.25 0.01 0.00 0.00 0.00 0.00 19.45 18.79 1vsc n ALA 144 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1vsc s ASP 145 N -1.07 -0.98 0.06 0.00 2.15 -1.26 -5.09 116.67 110.49 1vsc s ASP 145 Ca 0.55 -0.96 -0.18 0.00 0.43 0.00 0.00 52.55 52.39 1vsc s ASP 145 Cb 0.44 1.27 -0.07 0.00 -0.30 0.00 0.00 42.92 44.26 1vsc s ASP 145 CO 0.13 -0.06 1.29 0.03 -0.17 0.00 0.00 175.17 176.40 1vsc h ARG 146 N 5.15 -0.33 -1.30 4.34 2.47 -2.04 -2.81 114.38 119.86 1vsc h ARG 146 Ca 0.03 0.02 -0.21 0.00 -1.26 0.00 0.00 59.98 58.56 1vsc h ARG 146 Cb 1.15 0.07 -0.11 0.00 -1.65 0.00 0.00 29.97 29.44 1vsc h ARG 146 CO -0.02 -0.22 0.27 1.63 0.56 0.00 0.00 179.97 182.20 1vsc n LYS 147 N -4.08 1.52 0.40 0.04 5.02 -1.26 -4.63 118.16 115.17 1vsc n LYS 147 Ca -0.04 -1.13 -0.17 0.00 -2.02 0.00 0.00 58.31 54.96 1vsc n LYS 147 Cb 0.21 -1.44 -0.08 0.00 -0.02 0.00 0.00 35.03 33.69 1vsc n LYS 147 CO 0.00 0.00 0.00 1.03 -0.52 0.00 0.00 177.40 177.91 1vsc h SER 148 N 0.83 -0.86 -0.19 4.39 0.87 -1.87 -3.48 113.55 113.24 1vsc h SER 148 Ca 0.22 0.01 -0.04 0.00 -1.23 0.00 0.00 61.79 60.75 1vsc h SER 148 Cb 1.33 0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 63.50 1vsc h SER 148 CO 0.48 -0.52 -0.05 0.18 -0.53 0.00 0.00 176.83 176.39 1vsc n LEU 149 N -5.47 -0.61 -4.83 2.23 4.77 -1.26 -5.03 117.00 106.80 1vsc n LEU 149 Ca -0.13 0.02 -0.34 0.00 -0.03 0.00 0.00 56.01 55.53 1vsc n LEU 149 Cb 0.41 -0.74 -0.06 0.00 -2.33 0.00 0.00 43.42 40.70 1vsc n LEU 149 CO 0.34 -0.06 0.50 -0.70 -1.33 0.00 0.00 177.39 176.13 1vsc s GLU 150 N -3.12 4.15 0.21 3.23 2.12 -1.26 -3.71 118.70 120.32 1vsc s GLU 150 Ca 0.00 0.87 -0.30 0.00 0.36 0.00 0.00 54.97 55.90 1vsc s GLU 150 Cb 0.00 -2.48 -0.09 0.00 0.26 0.00 0.00 34.13 31.82 1vsc s GLU 150 CO 0.00 0.16 1.36 0.99 -0.54 0.00 0.00 175.26 177.23 1vsc s THR 151 N -1.92 3.02 -0.10 -1.70 2.01 -1.26 -4.35 115.64 111.34 1vsc s THR 151 Ca 0.54 0.84 -0.01 0.00 0.31 0.00 0.00 61.69 63.36 1vsc s THR 151 Cb -0.12 -3.54 -0.03 0.00 0.01 0.00 0.00 72.50 68.83 1vsc s THR 151 CO 0.17 0.12 -0.04 -0.54 -0.69 0.00 0.00 174.62 173.65 1vsc s LYS 152 N -0.14 3.10 0.18 4.92 -0.14 0.61 -4.92 119.74 123.35 1vsc s LYS 152 Ca 0.58 -0.50 0.08 0.00 -1.36 0.00 0.00 55.97 54.77 1vsc s LYS 152 Cb -0.38 -2.75 -0.04 0.00 -1.68 0.00 0.00 37.83 32.97 1vsc s LYS 152 CO 0.39 0.55 -0.16 -1.12 -0.76 0.00 0.00 175.35 174.25 1vsc s SER 153 N -0.47 2.55 -0.05 2.83 0.01 -1.26 -0.29 113.70 117.01 1vsc s SER 153 Ca 0.08 -0.94 -0.00 0.00 1.31 0.00 0.00 55.95 56.39 1vsc s SER 153 Cb -0.12 -0.14 0.02 0.00 0.21 0.00 0.00 66.02 66.00 1vsc s SER 153 CO 0.02 -0.12 -0.02 -0.22 0.41 0.00 0.00 173.24 173.31 1vsc s LEU 154 N -2.99 1.00 0.03 2.44 2.96 -0.35 -5.01 118.68 116.75 1vsc s LEU 154 Ca 0.19 -0.10 0.08 0.00 -0.22 0.00 0.00 54.13 54.07 1vsc s LEU 154 Cb -0.03 -0.42 -0.02 0.00 0.50 0.00 0.00 46.19 46.22 1vsc s LEU 154 CO 0.06 -0.12 -0.22 -1.61 -1.32 0.00 0.00 176.35 173.14 1vsc s GLU 155 N 1.37 1.57 -0.09 1.98 2.02 -1.26 -0.33 118.70 123.96 1vsc s GLU 155 Ca -0.04 -0.94 -0.14 0.00 0.02 0.00 0.00 54.97 53.87 1vsc s GLU 155 Cb -0.13 -1.66 0.03 0.00 0.10 0.00 0.00 34.13 32.47 1vsc s GLU 155 CO -0.02 0.43 0.35 0.54 0.02 0.00 0.00 175.26 176.57 1vsc s VAL 156 N -0.73 0.02 -0.03 2.63 0.11 -0.62 -4.99 120.40 116.80 1vsc s VAL 156 Ca 0.09 -0.18 0.07 0.00 -2.93 0.00 0.00 61.98 59.03 1vsc s VAL 156 Cb -0.09 -0.56 -0.02 0.00 -1.53 0.00 0.00 36.38 34.19 1vsc s VAL 156 CO 0.01 -0.10 -0.24 -0.89 -3.33 0.00 0.00 175.10 170.55 1vsc s THR 157 N -0.41 1.95 0.12 5.04 2.01 -1.26 0.40 115.64 123.48 1vsc s THR 157 Ca -0.05 -1.04 -0.20 0.00 0.31 0.00 0.00 61.69 60.70 1vsc s THR 157 Cb -0.03 -1.62 0.05 0.00 0.01 0.00 0.00 72.50 70.91 1vsc s THR 157 CO 0.02 0.55 0.51 0.72 -0.69 0.00 0.00 174.62 175.73 1vsc s PHE 158 N -0.47 -0.39 -0.28 4.92 -0.71 -0.46 -4.89 117.98 115.70 1vsc s PHE 158 Ca 0.06 0.21 -0.09 0.00 -1.04 0.00 0.00 56.93 56.07 1vsc s PHE 158 Cb -0.10 0.40 -0.03 0.00 -1.21 0.00 0.00 43.02 42.07 1vsc s PHE 158 CO 0.00 -0.74 0.12 0.95 -1.34 0.00 0.00 175.22 174.21 1vsc s THR 159 N -3.43 4.65 0.24 -4.49 -4.23 -1.26 -0.55 115.64 106.57 1vsc s THR 159 Ca 0.00 -0.15 -0.04 0.00 -1.18 0.00 0.00 61.69 60.32 1vsc s THR 159 Cb 0.00 -3.25 0.06 0.00 1.34 0.00 0.00 72.50 70.65 1vsc s THR 159 CO -0.10 0.24 0.31 -0.81 -0.54 0.00 0.00 174.62 173.72 1vsc n PRO 160 N 4.98 -0.41 -4.01 3.99 -0.04 -1.26 -4.84 135.00 133.41 1vsc n PRO 160 Ca -0.15 -0.48 -0.10 0.00 -0.04 0.00 0.00 63.50 62.73 1vsc n PRO 160 Cb 0.51 -0.33 -0.06 0.00 -0.04 0.00 0.00 33.50 33.58 1vsc n PRO 160 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1vsc s VAL 161 N -1.67 0.02 0.50 0.52 -7.23 -1.26 -2.05 120.40 109.23 1vsc s VAL 161 Ca 0.18 -1.46 0.32 0.00 -1.81 0.00 0.00 61.98 59.21 1vsc s VAL 161 Cb -0.01 -2.13 0.51 0.00 0.56 0.00 0.00 36.38 35.31 1vsc s VAL 161 CO 0.13 -0.07 1.79 0.40 -0.31 0.00 0.00 175.10 177.03 1vsc h ILE 162 N 2.37 0.42 0.00 -0.62 2.04 -1.98 -0.17 117.51 119.56 1vsc h ILE 162 Ca -0.29 -0.04 -0.06 0.00 1.00 0.00 0.00 64.86 65.47 1vsc h ILE 162 Cb 1.25 0.30 -0.01 0.00 -0.74 0.00 0.00 36.82 37.62 1vsc h ILE 162 CO 0.41 0.02 -0.31 -0.33 0.00 0.00 0.00 178.15 177.94 1vsc h GLU 163 N 0.11 0.00 0.00 2.37 3.07 -2.04 -3.04 114.58 115.05 1vsc h GLU 163 Ca 0.59 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.45 1vsc h GLU 163 Cb 2.11 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 30.02 1vsc h GLU 163 CO -0.10 0.31 0.00 -0.25 -1.40 0.00 0.00 179.01 177.57 1vsc n ASP 164 N -3.73 0.00 -4.61 1.42 8.00 -0.08 -4.55 116.55 113.01 1vsc n ASP 164 Ca -0.01 -0.24 -0.41 0.00 0.71 0.00 0.00 54.79 54.84 1vsc n ASP 164 Cb 0.41 -0.15 -0.06 0.00 -0.02 0.00 0.00 41.12 41.29 1vsc n ASP 164 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1vsc s ILE 165 N -2.31 4.92 0.00 0.53 -1.09 -1.15 -2.65 121.20 119.45 1vsc s ILE 165 Ca 0.21 0.97 0.00 0.00 -2.23 0.00 0.00 60.65 59.60 1vsc s ILE 165 Cb 0.12 -4.02 0.00 0.00 -1.58 0.00 0.00 42.46 36.98 1vsc s ILE 165 CO 0.24 -0.13 0.00 0.61 -1.23 0.00 0.00 174.94 174.42 1vsc n GLY 166 N 4.33 1.90 3.77 6.18 0.00 -1.19 -5.07 105.19 115.11 1vsc n GLY 166 Ca 0.00 -0.56 -0.40 0.00 0.00 0.00 0.00 46.02 45.06 1vsc n GLY 166 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vsc s LYS 167 N 0.00 4.24 -0.02 1.61 1.02 -1.08 -4.85 119.74 120.66 1vsc s LYS 167 Ca 0.00 2.08 -0.14 0.00 0.02 0.00 0.00 55.97 57.93 1vsc s LYS 167 Cb 0.00 -2.93 -0.05 0.00 -0.52 0.00 0.00 37.83 34.32 1vsc s LYS 167 CO 0.00 -0.24 0.38 0.08 -0.92 0.00 0.00 175.35 174.65 1vsc s VAL 168 N -1.22 5.08 0.03 3.17 1.01 -1.26 -3.08 120.40 124.13 1vsc s VAL 168 Ca 0.52 0.77 -0.19 0.00 0.00 0.00 0.00 61.98 63.09 1vsc s VAL 168 Cb -0.37 -3.68 -0.06 0.00 0.00 0.00 0.00 36.38 32.27 1vsc s VAL 168 CO 0.48 0.58 0.53 -0.76 0.00 0.00 0.00 175.10 175.93 1vsc s LEU 169 N -1.02 4.47 -0.06 3.92 1.43 -0.12 -2.77 118.68 124.53 1vsc s LEU 169 Ca 0.23 1.14 0.00 0.00 -1.03 0.00 0.00 54.13 54.48 1vsc s LEU 169 Cb -0.16 -2.82 0.02 0.00 0.03 0.00 0.00 46.19 43.26 1vsc s LEU 169 CO 0.12 0.23 -0.05 -0.69 0.23 0.00 0.00 176.35 176.19 1vsc s VAL 170 N -0.78 0.65 -0.19 -1.59 1.01 0.15 -0.97 120.40 118.68 1vsc s VAL 170 Ca 0.28 -0.14 -0.00 0.00 0.00 0.00 0.00 61.98 62.12 1vsc s VAL 170 Cb -0.18 -0.69 0.01 0.00 0.00 0.00 0.00 36.38 35.52 1vsc s VAL 170 CO 0.17 0.27 -0.15 0.00 0.00 0.00 0.00 175.10 175.38 1vsc s ARG 172 N 1.34 3.31 -0.22 0.00 0.52 0.15 -1.11 118.95 122.94 1vsc s ARG 172 Ca 0.05 -0.57 -0.02 0.00 -0.52 0.00 0.00 55.73 54.67 1vsc s ARG 172 Cb -0.14 -2.74 0.01 0.00 0.52 0.00 0.00 34.95 32.61 1vsc s ARG 172 CO -0.10 0.37 -0.08 0.00 0.02 0.00 0.00 175.30 175.51 1vsc s ALA 173 N -0.02 2.67 -0.16 2.13 0.00 0.65 0.64 121.76 127.67 1vsc s ALA 173 Ca -0.01 -1.28 -0.03 0.00 0.00 0.00 0.00 51.96 50.65 1vsc s ALA 173 Cb -0.14 -1.58 -0.02 0.00 0.00 0.00 0.00 23.12 21.38 1vsc s ALA 173 CO 0.03 -0.54 -0.05 0.15 0.00 0.00 0.00 175.76 175.35 1vsc s LYS 174 N 1.39 3.59 -0.23 0.00 1.02 0.11 -1.64 119.74 123.98 1vsc s LYS 174 Ca 0.04 -0.56 0.02 0.00 0.02 0.00 0.00 55.97 55.49 1vsc s LYS 174 Cb -0.15 -2.88 0.05 0.00 -0.52 0.00 0.00 37.83 34.33 1vsc s LYS 174 CO -0.06 0.19 -0.12 -1.17 -0.92 0.00 0.00 175.35 173.27 1vsc s LEU 175 N 0.49 2.86 -1.01 3.17 2.96 0.16 -1.55 118.68 125.76 1vsc s LEU 175 Ca -0.04 -1.13 -0.15 0.00 -0.22 0.00 0.00 54.13 52.59 1vsc s LEU 175 Cb -0.15 -1.43 0.19 0.00 0.50 0.00 0.00 46.19 45.30 1vsc s LEU 175 CO 0.03 -0.15 1.13 -2.28 -1.32 0.00 0.00 176.35 173.76 1vsc s HIS 176 N 1.23 3.55 -0.25 5.38 2.46 -0.88 0.19 115.29 126.97 1vsc s HIS 176 Ca -0.04 -1.94 -0.02 0.00 0.47 0.00 0.00 55.06 53.53 1vsc s HIS 176 Cb -0.18 -4.12 -0.17 0.00 -0.13 0.00 0.00 32.58 27.99 1vsc s HIS 176 CO -0.07 -1.27 -0.20 0.44 -2.47 0.00 0.00 174.74 171.17 1vsc n ILE 177 N 4.47 1.52 -2.57 0.89 -6.64 -1.26 -4.85 119.36 110.91 1vsc n ILE 177 Ca 0.25 -0.53 -0.43 0.00 -1.77 0.00 0.00 62.75 60.27 1vsc n ILE 177 Cb 0.45 -1.54 -0.02 0.00 -1.44 0.00 0.00 39.64 37.10 1vsc n ILE 177 CO 0.00 0.00 0.00 -0.62 -1.77 0.00 0.00 176.55 174.16 1vsc s ASP 178 N -6.74 6.60 0.24 7.28 -1.08 -1.26 -4.94 116.67 116.76 1vsc s ASP 178 Ca -0.35 0.49 0.26 0.00 -0.52 0.00 0.00 52.55 52.43 1vsc s ASP 178 Cb 0.10 -2.55 0.83 0.00 -1.46 0.00 0.00 42.92 39.84 1vsc s ASP 178 CO 0.59 -1.28 1.76 -0.33 0.52 0.00 0.00 175.17 176.43 1vsc h GLU 179 N 9.40 0.00 -0.63 4.34 4.39 -2.00 -3.01 114.58 127.07 1vsc h GLU 179 Ca -0.23 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.47 1vsc h GLU 179 Cb 1.06 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.71 1vsc h GLU 179 CO 1.13 0.00 0.00 -1.33 -1.16 0.00 0.00 179.01 177.65 1vsc n MET 180 N -2.33 3.14 -4.82 2.33 2.81 -1.26 -4.83 117.12 112.16 1vsc n MET 180 Ca 0.05 -2.38 -0.27 0.00 -1.81 0.00 0.00 57.70 53.29 1vsc n MET 180 Cb 0.39 -1.74 -0.16 0.00 -0.71 0.00 0.00 33.22 31.00 1vsc n MET 180 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 1vsc s ASP 181 N -0.86 2.21 0.45 7.83 -1.08 -1.14 -5.03 116.67 119.06 1vsc s ASP 181 Ca 0.43 -0.38 0.25 0.00 -0.52 0.00 0.00 52.55 52.33 1vsc s ASP 181 Cb 0.27 -0.88 0.61 0.00 -1.46 0.00 0.00 42.92 41.46 1vsc s ASP 181 CO 0.22 0.11 1.70 0.77 0.52 0.00 0.00 175.17 178.49 1vsc h SER 182 N 6.65 0.00 -3.32 -0.34 4.64 -1.88 -3.44 113.55 115.86 1vsc h SER 182 Ca -0.29 0.00 -0.63 0.00 -0.47 0.00 0.00 61.79 60.40 1vsc h SER 182 Cb 1.19 0.00 -0.21 0.00 -0.31 0.00 0.00 62.40 63.08 1vsc h SER 182 CO 0.47 0.09 -0.64 0.68 -0.87 0.00 0.00 176.83 176.56 1vsc s VAL 183 N -3.33 4.09 1.08 0.95 -7.23 -1.26 -5.09 120.40 109.61 1vsc s VAL 183 Ca 0.05 -0.28 -0.12 0.00 -1.81 0.00 0.00 61.98 59.82 1vsc s VAL 183 Cb 0.07 -2.81 0.24 0.00 0.56 0.00 0.00 36.38 34.43 1vsc s VAL 183 CO 0.65 0.48 1.07 -2.84 -0.31 0.00 0.00 175.10 174.14 1vsc s PRO 184 N 0.45 -0.26 0.11 4.82 0.02 -1.26 -4.94 135.00 133.94 1vsc s PRO 184 Ca -0.02 1.12 -0.30 0.00 0.02 0.00 0.00 61.00 61.83 1vsc s PRO 184 Cb -0.14 -1.61 -0.06 0.00 0.02 0.00 0.00 34.50 32.71 1vsc s PRO 184 CO 0.02 -3.36 0.95 0.99 -0.33 0.00 0.00 177.00 175.27 1vsc s THR 185 N -2.51 4.50 -0.02 0.99 2.01 0.13 -4.83 115.64 115.91 1vsc s THR 185 Ca 0.68 2.06 0.05 0.00 0.31 0.00 0.00 61.69 64.78 1vsc s THR 185 Cb -0.24 -4.32 -0.01 0.00 0.01 0.00 0.00 72.50 67.94 1vsc s THR 185 CO 0.62 0.32 -0.15 -0.69 -0.69 0.00 0.00 174.62 174.03 1vsc s VAL 186 N -0.02 1.21 -0.01 3.82 1.01 -1.26 0.39 120.40 125.53 1vsc s VAL 186 Ca 0.46 -0.64 0.02 0.00 0.00 0.00 0.00 61.98 61.83 1vsc s VAL 186 Cb -0.23 -1.01 -0.00 0.00 0.00 0.00 0.00 36.38 35.13 1vsc s VAL 186 CO 0.30 0.34 -0.07 -0.13 0.00 0.00 0.00 175.10 175.54 1vsc s ARG 187 N -0.27 0.70 0.08 2.72 0.52 -0.65 -5.00 118.95 117.05 1vsc s ARG 187 Ca 0.04 -0.25 -0.06 0.00 -0.52 0.00 0.00 55.73 54.93 1vsc s ARG 187 Cb -0.07 -0.68 -0.01 0.00 0.52 0.00 0.00 34.95 34.71 1vsc s ARG 187 CO -0.00 0.12 0.12 1.14 0.02 0.00 0.00 175.30 176.70 1vsc s GLN 188 N 0.03 0.78 0.05 3.54 -2.07 -1.26 -0.25 119.66 120.48 1vsc s GLN 188 Ca -0.00 -1.05 0.05 0.00 -1.82 0.00 0.00 55.36 52.54 1vsc s GLN 188 Cb -0.05 0.30 -0.02 0.00 -1.09 0.00 0.00 33.01 32.14 1vsc s GLN 188 CO -0.00 -0.22 -0.15 0.00 -1.32 0.00 0.00 175.29 173.60 1vsc s ALA 189 N -3.88 1.24 -0.01 2.60 0.00 -0.26 -4.60 121.76 116.84 1vsc s ALA 189 Ca 0.06 -0.91 0.04 0.00 0.00 0.00 0.00 51.96 51.15 1vsc s ALA 189 Cb 0.06 -0.17 -0.01 0.00 0.00 0.00 0.00 23.12 22.99 1vsc s ALA 189 CO -0.10 0.23 -0.13 0.14 0.00 0.00 0.00 175.76 175.90 1vsc s VAL 190 N -0.97 1.01 -0.10 0.00 -7.23 -1.26 -0.60 120.40 111.25 1vsc s VAL 190 Ca 0.01 -0.55 -0.02 0.00 -1.81 0.00 0.00 61.98 59.61 1vsc s VAL 190 Cb -0.09 -0.85 0.04 0.00 0.56 0.00 0.00 36.38 36.05 1vsc s VAL 190 CO 0.02 0.29 0.04 -0.75 -0.31 0.00 0.00 175.10 174.38 1vsc s LYS 191 N -0.29 0.32 0.14 4.82 2.20 -0.15 -4.95 119.74 121.83 1vsc s LYS 191 Ca 0.05 0.07 -0.30 0.00 -0.36 0.00 0.00 55.97 55.43 1vsc s LYS 191 Cb -0.05 -1.17 -0.06 0.00 -1.51 0.00 0.00 37.83 35.04 1vsc s LYS 191 CO -0.00 -0.43 0.95 -2.00 -0.36 0.00 0.00 175.35 173.51 1vsc s GLU 192 N 2.04 4.73 -0.94 4.03 2.12 -1.26 -0.95 118.70 128.47 1vsc s GLU 192 Ca 0.04 1.45 -0.20 0.00 0.36 0.00 0.00 54.97 56.61 1vsc s GLU 192 Cb -0.14 -3.35 0.10 0.00 0.26 0.00 0.00 34.13 31.00 1vsc s GLU 192 CO -0.06 0.28 1.23 -0.51 -0.54 0.00 0.00 175.26 175.66 1vsc s LEU 193 N -0.27 4.48 0.02 2.70 1.43 -1.18 -4.95 118.68 120.92 1vsc s LEU 193 Ca 0.45 -1.77 -0.05 0.00 -1.03 0.00 0.00 54.13 51.74 1vsc s LEU 193 Cb -0.24 -2.46 -0.05 0.00 0.03 0.00 0.00 46.19 43.48 1vsc s LEU 193 CO 0.30 -1.24 0.25 -1.10 0.23 0.00 0.00 176.35 174.79 1vsc s GLN 194 N 3.55 3.53 0.13 1.70 -0.21 -1.26 -3.15 119.66 123.95 1vsc s GLN 194 Ca 0.37 -0.18 -0.00 0.00 0.02 0.00 0.00 55.36 55.56 1vsc s GLN 194 Cb -0.04 -3.05 -0.04 0.00 1.00 0.00 0.00 33.01 30.88 1vsc s GLN 194 CO -0.08 0.63 0.03 0.08 -2.12 0.00 0.00 175.29 173.82 1vsc s VAL 195 N -1.37 0.30 -2.51 1.09 1.01 -1.26 -4.93 120.40 112.73 1vsc s VAL 195 Ca 0.30 -1.92 0.28 0.00 0.00 0.00 0.00 61.98 60.64 1vsc s VAL 195 Cb -0.13 -1.98 0.54 0.00 0.00 0.00 0.00 36.38 34.81 1vsc s VAL 195 CO 0.19 -0.55 1.73 0.47 0.00 0.00 0.00 175.10 176.94