#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vp0 n THR 3 N 0.00 0.00 -3.47 5.09 -1.04 -1.26 -5.10 114.28 108.50 1vp0 n THR 3 Ca 0.00 -1.47 0.01 0.00 -2.04 0.00 0.00 64.05 60.55 1vp0 n THR 3 Cb 0.00 1.49 -0.04 0.00 -1.82 0.00 0.00 70.33 69.96 1vp0 n THR 3 CO 0.00 0.00 0.00 -2.28 -0.64 0.00 0.00 175.07 172.15 1vp0 s HIS 4 N 0.54 -0.98 0.00 -1.42 5.65 -1.26 -5.10 115.29 112.72 1vp0 s HIS 4 Ca 0.29 1.62 0.00 0.00 0.25 0.00 0.00 55.06 57.22 1vp0 s HIS 4 Cb 0.25 0.56 0.00 0.00 -1.18 0.00 0.00 32.58 32.21 1vp0 s HIS 4 CO -0.18 -0.50 0.00 0.44 -0.65 0.00 0.00 174.74 173.85 1vp0 n ILE 5 N 5.21 0.00 -2.69 0.89 -6.64 -1.26 -5.06 119.36 109.81 1vp0 n ILE 5 Ca -0.10 0.00 -0.06 0.00 -1.77 0.00 0.00 62.75 60.83 1vp0 n ILE 5 Cb 0.51 0.00 0.07 0.00 -1.44 0.00 0.00 39.64 38.78 1vp0 n ILE 5 CO 0.00 0.00 0.00 1.17 -1.77 0.00 0.00 176.55 175.95 1vp0 n LYS 6 N -0.65 0.68 -3.78 6.28 4.81 -1.26 -5.14 118.16 119.11 1vp0 n LYS 6 Ca 0.00 -1.31 -0.13 0.00 -0.87 0.00 0.00 58.31 56.01 1vp0 n LYS 6 Cb 0.00 -0.22 -0.11 0.00 0.02 0.00 0.00 35.03 34.71 1vp0 n LYS 6 CO 0.00 0.00 0.00 0.42 1.17 0.00 0.00 177.40 178.99 1vp0 s ILE 7 N 0.13 -0.00 -0.71 3.15 1.01 -1.26 -5.11 121.20 118.41 1vp0 s ILE 7 Ca 0.16 0.01 -0.11 0.00 0.00 0.00 0.00 60.65 60.71 1vp0 s ILE 7 Cb 0.26 -0.38 0.19 0.00 0.01 0.00 0.00 42.46 42.53 1vp0 s ILE 7 CO -0.08 0.00 0.61 0.21 0.00 0.00 0.00 174.94 175.69 1vp0 s ASN 8 N 0.21 6.19 -0.45 3.58 2.47 -1.26 -5.00 114.94 120.68 1vp0 s ASN 8 Ca -0.01 -2.58 -0.09 0.00 0.42 0.00 0.00 52.86 50.60 1vp0 s ASN 8 Cb -0.02 -2.09 0.10 0.00 -1.45 0.00 0.00 41.25 37.78 1vp0 s ASN 8 CO -0.00 -0.55 0.31 -0.13 -3.72 0.00 0.00 177.10 173.01 1vp0 s ARG 9 N 0.35 2.55 -0.07 0.43 0.52 -1.26 -4.80 118.95 116.67 1vp0 s ARG 9 Ca 0.15 -1.62 0.08 0.00 -0.52 0.00 0.00 55.73 53.82 1vp0 s ARG 9 Cb -0.16 -3.87 0.18 0.00 0.52 0.00 0.00 34.95 31.61 1vp0 s ARG 9 CO -0.06 -1.09 1.13 0.41 0.02 0.00 0.00 175.30 175.72 1vp0 n GLY 10 N 4.92 0.92 1.19 -3.53 0.00 -1.26 -4.84 105.19 102.59 1vp0 n GLY 10 Ca -0.09 -0.25 0.08 0.00 0.00 0.00 0.00 46.02 45.76 1vp0 n GLY 10 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1vp0 n GLU 11 N -0.19 3.49 -0.02 1.61 0.28 -1.25 -1.31 120.64 123.25 1vp0 n GLU 11 Ca -0.18 -2.83 -0.03 0.00 -0.16 0.00 0.00 57.16 53.96 1vp0 n GLU 11 Cb 0.82 -1.88 -0.02 0.00 1.43 0.00 0.00 31.44 31.80 1vp0 n GLU 11 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 1vp0 n LEU 12 N 0.11 2.24 0.11 -1.84 4.32 -1.26 0.59 117.00 121.27 1vp0 n LEU 12 Ca 0.22 -0.00 0.13 0.00 -0.02 0.00 0.00 56.01 56.34 1vp0 n LEU 12 Cb 0.91 -0.12 0.42 0.00 -1.62 0.00 0.00 43.42 43.00 1vp0 n LEU 12 CO 0.20 0.43 0.88 -0.11 -1.22 0.00 0.00 177.39 177.57 1vp0 n LEU 13 N -2.76 0.79 -2.74 2.23 -0.00 -1.24 -1.39 117.00 111.88 1vp0 n LEU 13 Ca -0.07 0.59 -0.05 0.00 -0.00 0.00 0.00 56.01 56.49 1vp0 n LEU 13 Cb 0.56 -0.36 0.02 0.00 -0.00 0.00 0.00 43.42 43.65 1vp0 n LEU 13 CO 0.03 -0.24 0.22 -1.14 -0.00 0.00 0.00 177.39 176.26 1vp0 n ARG 14 N -2.25 0.49 0.00 1.96 0.63 -0.43 -4.75 116.66 112.31 1vp0 n ARG 14 Ca 0.05 -1.71 0.00 0.00 -0.92 0.00 0.00 57.85 55.27 1vp0 n ARG 14 Cb 0.40 -1.15 0.00 0.00 0.45 0.00 0.00 32.46 32.16 1vp0 n ARG 14 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1vp0 n GLY 15 N 2.59 -1.26 0.22 5.14 0.00 -1.14 -3.87 105.19 106.87 1vp0 n GLY 15 Ca 0.15 0.49 0.09 0.00 0.00 0.00 0.00 46.02 46.75 1vp0 n GLY 15 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1vp0 h ILE 16 N 0.00 0.75 0.14 -0.61 1.08 0.07 0.86 117.51 119.80 1vp0 h ILE 16 Ca 0.00 -1.05 -0.00 0.00 -0.39 0.00 0.00 64.86 63.42 1vp0 h ILE 16 Cb 0.00 1.65 -0.00 0.00 -3.07 0.00 0.00 36.82 35.40 1vp0 h ILE 16 CO 0.00 0.25 -0.09 -0.08 -0.69 0.00 0.00 178.15 177.53 1vp0 h GLU 17 N 0.00 -0.22 -0.39 2.37 4.57 -1.45 -2.16 114.58 117.30 1vp0 h GLU 17 Ca -0.00 0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.19 1vp0 h GLU 17 Cb 0.63 0.05 0.00 0.00 -0.16 0.00 0.00 28.75 29.27 1vp0 h GLU 17 CO 0.03 -0.15 0.00 0.94 -1.18 0.00 0.00 179.01 178.66 1vp0 n GLN 18 N -5.20 2.13 0.25 1.92 7.27 -0.60 -3.63 117.38 119.51 1vp0 n GLN 18 Ca -0.08 -1.73 0.16 0.00 0.07 0.00 0.00 57.00 55.42 1vp0 n GLN 18 Cb 0.13 -1.42 0.64 0.00 2.41 0.00 0.00 30.24 32.00 1vp0 n GLN 18 CO 0.00 0.00 0.00 0.22 0.07 0.00 0.00 177.06 177.35 1vp0 h ASP 19 N 3.09 0.00 -3.31 1.69 1.82 0.14 -3.35 116.42 116.50 1vp0 h ASP 19 Ca 0.00 0.00 -0.52 0.00 -0.39 0.00 0.00 57.03 56.12 1vp0 h ASP 19 Cb 0.69 0.00 -0.39 0.00 0.68 0.00 0.00 39.33 40.32 1vp0 h ASP 19 CO 0.00 0.00 -0.78 -1.00 -1.61 0.00 0.00 179.24 175.85 1vp0 s HIS 20 N -3.59 1.33 0.00 0.28 0.09 -1.24 -4.97 115.29 107.20 1vp0 s HIS 20 Ca 0.02 -0.88 0.00 0.00 -0.00 0.00 0.00 55.06 54.20 1vp0 s HIS 20 Cb 0.09 -1.14 0.00 0.00 -0.00 0.00 0.00 32.58 31.53 1vp0 s HIS 20 CO 0.51 -0.57 0.00 0.25 -0.00 0.00 0.00 174.74 174.93 1vp0 n THR 21 N 4.97 0.00 -2.57 1.30 -2.24 -1.26 -4.90 114.28 109.58 1vp0 n THR 21 Ca -0.10 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.66 1vp0 n THR 21 Cb 0.48 0.00 0.01 0.00 -2.10 0.00 0.00 70.33 68.72 1vp0 n THR 21 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 1vp0 n ARG 22 N 0.00 -1.01 -3.60 -0.78 5.12 -1.26 -5.07 116.66 110.06 1vp0 n ARG 22 Ca 0.00 1.06 -0.08 0.00 -1.93 0.00 0.00 57.85 56.91 1vp0 n ARG 22 Cb 0.00 -4.39 -0.05 0.00 -1.16 0.00 0.00 32.46 26.86 1vp0 n ARG 22 CO 0.00 0.00 0.00 1.14 -1.93 0.00 0.00 177.63 176.84 1vp0 s GLN 23 N -3.17 0.40 -0.53 5.56 0.00 -1.26 -5.03 119.66 115.63 1vp0 s GLN 23 Ca 0.06 0.13 0.07 0.00 -0.00 0.00 0.00 55.36 55.61 1vp0 s GLN 23 Cb -0.01 0.19 0.32 0.00 0.00 0.00 0.00 33.01 33.52 1vp0 s GLN 23 CO 0.50 -0.12 0.85 -0.11 0.00 0.00 0.00 175.29 176.41 1vp0 n LEU 24 N 0.79 3.33 0.00 2.60 -0.00 -1.26 -5.05 117.00 117.40 1vp0 n LEU 24 Ca -0.07 -5.45 0.00 0.00 -0.00 0.00 0.00 56.01 50.49 1vp0 n LEU 24 Cb 0.58 -0.22 0.00 0.00 -0.00 0.00 0.00 43.42 43.78 1vp0 n LEU 24 CO 0.12 2.28 0.00 -2.65 -0.00 0.00 0.00 177.39 177.14 1vp0 n PRO 25 N 0.13 0.00 0.11 1.96 -0.02 -1.26 -4.71 135.00 131.22 1vp0 n PRO 25 Ca 0.29 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.77 1vp0 n PRO 25 Cb 0.46 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.94 1vp0 n PRO 25 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1vp0 n ASP 26 N 0.00 -2.06 -3.20 2.55 4.64 -1.26 -4.82 116.55 112.40 1vp0 n ASP 26 Ca 0.00 0.66 -0.17 0.00 -1.38 0.00 0.00 54.79 53.91 1vp0 n ASP 26 Cb 0.00 2.15 0.08 0.00 -1.04 0.00 0.00 41.12 42.31 1vp0 n ASP 26 CO 0.00 0.00 0.00 0.33 -0.82 0.00 0.00 177.20 176.71 1vp0 n PHE 27 N -3.14 -2.10 -4.08 -0.67 7.35 -1.26 -5.03 117.46 108.53 1vp0 n PHE 27 Ca 0.00 0.86 -0.33 0.00 -0.76 0.00 0.00 57.45 57.22 1vp0 n PHE 27 Cb 0.00 -4.73 -0.15 0.00 0.35 0.00 0.00 39.48 34.94 1vp0 n PHE 27 CO 0.00 0.00 0.00 0.50 -0.76 0.00 0.00 176.76 176.50 1vp0 s ARG 28 N -5.43 2.86 0.00 -4.13 6.06 -1.26 -4.96 118.95 112.09 1vp0 s ARG 28 Ca 0.12 -0.93 0.28 0.00 -2.50 0.00 0.00 55.73 52.71 1vp0 s ARG 28 Cb -0.05 -2.71 1.16 0.00 0.06 0.00 0.00 34.95 33.41 1vp0 s ARG 28 CO 0.65 -0.30 1.81 -0.35 -2.50 0.00 0.00 175.30 174.62 1vp0 n PRO 29 N 4.60 1.02 -1.46 5.12 -0.04 -1.26 -4.46 135.00 138.52 1vp0 n PRO 29 Ca -0.19 -0.45 -0.44 0.00 -0.04 0.00 0.00 63.50 62.38 1vp0 n PRO 29 Cb 0.48 -1.49 -0.12 0.00 -0.04 0.00 0.00 33.50 32.33 1vp0 n PRO 29 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1vp0 n GLY 30 N 1.23 -0.26 3.75 0.55 0.00 -1.26 -3.60 105.19 105.59 1vp0 n GLY 30 Ca 0.16 1.06 -0.35 0.00 0.00 0.00 0.00 46.02 46.90 1vp0 n GLY 30 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1vp0 s ASP 31 N 8.84 4.86 -0.52 1.61 1.11 -1.12 -4.46 116.67 126.98 1vp0 s ASP 31 Ca 1.26 2.31 -0.13 0.00 0.18 0.00 0.00 52.55 56.17 1vp0 s ASP 31 Cb -1.12 -2.59 0.02 0.00 1.07 0.00 0.00 42.92 40.30 1vp0 s ASP 31 CO 0.49 -1.81 0.63 0.41 1.18 0.00 0.00 175.17 176.06 1vp0 n THR 32 N -2.09-10.24 -4.61 -1.27 -1.04 -0.68 -4.74 114.28 89.61 1vp0 n THR 32 Ca 0.13 0.52 -0.33 0.00 -2.04 0.00 0.00 64.05 62.33 1vp0 n THR 32 Cb 0.50 -6.87 -0.11 0.00 -1.82 0.00 0.00 70.33 62.03 1vp0 n THR 32 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 1vp0 s VAL 33 N -2.65 3.55 -2.00 12.58 1.01 -1.25 -4.79 120.40 126.84 1vp0 s VAL 33 Ca 0.19 -0.65 0.15 0.00 0.00 0.00 0.00 61.98 61.66 1vp0 s VAL 33 Cb -0.05 -2.48 0.42 0.00 0.00 0.00 0.00 36.38 34.27 1vp0 s VAL 33 CO 0.77 0.52 1.30 0.54 0.00 0.00 0.00 175.10 178.23 1vp0 n ARG 34 N 1.97 0.55 0.00 2.72 1.74 -1.26 -4.77 116.66 117.61 1vp0 n ARG 34 Ca -0.17 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.91 1vp0 n ARG 34 Cb 0.53 -1.42 0.00 0.00 -1.02 0.00 0.00 32.46 30.55 1vp0 n ARG 34 CO 0.00 0.00 0.00 1.55 -1.52 0.00 0.00 177.63 177.66 1vp0 n VAL 35 N -0.92 0.00 -2.79 1.55 3.14 -1.26 -5.17 118.33 112.88 1vp0 n VAL 35 Ca 0.11 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.49 1vp0 n VAL 35 Cb 0.05 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.83 1vp0 n VAL 35 CO 0.00 0.00 0.00 -0.67 -6.46 0.00 0.00 176.83 169.70 1vp0 n ASP 36 N 0.00 0.00 -4.46 6.55 4.64 -1.26 -4.64 116.55 117.38 1vp0 n ASP 36 Ca 0.00 -0.30 -0.28 0.00 -1.38 0.00 0.00 54.79 52.83 1vp0 n ASP 36 Cb 0.00 0.00 0.26 0.00 -1.04 0.00 0.00 41.12 40.34 1vp0 n ASP 36 CO 0.00 0.00 0.00 0.28 -0.82 0.00 0.00 177.20 176.66 1vp0 s THR 37 N -2.16 2.00 -0.30 5.18 -1.32 -1.26 -4.75 115.64 113.03 1vp0 s THR 37 Ca 0.00 0.00 -0.12 0.00 -1.21 0.00 0.00 61.69 60.36 1vp0 s THR 37 Cb 0.00 -2.00 0.15 0.00 -1.51 0.00 0.00 72.50 69.14 1vp0 s THR 37 CO 0.00 -0.00 0.82 -1.59 -2.21 0.00 0.00 174.62 171.64 1vp0 s LYS 38 N -4.40 0.43 0.73 7.08 -2.85 -1.26 -4.79 119.74 114.68 1vp0 s LYS 38 Ca 0.69 1.07 -0.17 0.00 -1.00 0.00 0.00 55.97 56.56 1vp0 s LYS 38 Cb -0.26 0.64 -0.08 0.00 -2.06 0.00 0.00 37.83 36.07 1vp0 s LYS 38 CO 0.66 -0.16 0.14 0.28 0.10 0.00 0.00 175.35 176.37 1vp0 n VAL 39 N 5.21 0.98 1.73 1.79 0.31 -1.26 -2.43 118.33 124.65 1vp0 n VAL 39 Ca -0.10 -0.43 0.15 0.00 -0.01 0.00 0.00 64.34 63.95 1vp0 n VAL 39 Cb 0.51 -0.43 0.76 0.00 -0.91 0.00 0.00 33.84 33.77 1vp0 n VAL 39 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1vp0 n ARG 40 N 0.30 1.09 -0.36 5.55 5.12 -1.25 -4.32 116.66 122.79 1vp0 n ARG 40 Ca 0.07 -0.30 0.05 0.00 -1.93 0.00 0.00 57.85 55.74 1vp0 n ARG 40 Cb 0.50 -1.49 -0.01 0.00 -1.16 0.00 0.00 32.46 30.30 1vp0 n ARG 40 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 1vp0 n GLU 41 N -0.69 -0.73 0.00 5.56 -0.58 -1.26 -3.19 120.64 119.75 1vp0 n GLU 41 Ca 0.20 0.48 0.00 0.00 -0.42 0.00 0.00 57.16 57.42 1vp0 n GLU 41 Cb 0.21 -0.88 0.00 0.00 -0.57 0.00 0.00 31.44 30.20 1vp0 n GLU 41 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1vp0 n GLY 42 N -1.07 1.32 5.18 0.62 0.00 -1.26 -4.88 105.19 105.09 1vp0 n GLY 42 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1vp0 n GLY 42 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1vp0 n ASN 43 N 0.00 0.00 -3.13 1.61 4.05 -1.26 -4.55 115.26 111.97 1vp0 n ASN 43 Ca 0.00 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.03 1vp0 n ASN 43 Cb 0.00 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.01 1vp0 n ASN 43 CO 0.00 0.00 0.00 -1.14 -3.05 0.00 0.00 177.26 173.07 1vp0 n ARG 44 N 0.00 2.82 0.24 1.20 0.63 -1.26 -4.91 116.66 115.37 1vp0 n ARG 44 Ca 0.00 0.00 -0.14 0.00 -0.92 0.00 0.00 57.85 56.79 1vp0 n ARG 44 Cb 0.00 0.00 -0.07 0.00 0.45 0.00 0.00 32.46 32.84 1vp0 n ARG 44 CO 0.00 0.00 0.00 1.79 -2.51 0.00 0.00 177.63 176.91 1vp0 h THR 45 N -0.00 0.00 0.00 5.15 1.35 -2.05 -3.46 112.91 113.90 1vp0 h THR 45 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 1vp0 h THR 45 Cb 0.00 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 66.42 1vp0 h THR 45 CO 0.00 0.00 0.00 -2.11 -0.25 0.00 0.00 175.52 173.16 1vp0 n ARG 46 N -4.68 0.00 -4.02 4.72 1.85 -1.26 -5.03 116.66 108.25 1vp0 n ARG 46 Ca -0.09 0.00 -0.31 0.00 -1.00 0.00 0.00 57.85 56.44 1vp0 n ARG 46 Cb 0.35 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.76 1vp0 n ARG 46 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 1vp0 n SER 47 N -0.43 -3.60 -4.27 2.89 2.88 -1.26 -4.60 113.62 105.23 1vp0 n SER 47 Ca 0.00 -0.89 -0.07 0.00 -1.33 0.00 0.00 58.87 56.58 1vp0 n SER 47 Cb 0.00 -3.42 -0.06 0.00 -0.75 0.00 0.00 64.21 59.99 1vp0 n SER 47 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1vp0 n GLN 48 N -4.53 0.05 -1.77 -1.46 6.02 -1.26 -4.87 117.38 109.57 1vp0 n GLN 48 Ca -0.00 -0.71 -0.30 0.00 -0.01 0.00 0.00 57.00 55.98 1vp0 n GLN 48 Cb 0.54 -2.27 0.08 0.00 1.02 0.00 0.00 30.24 29.60 1vp0 n GLN 48 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1vp0 s ALA 49 N 7.53 2.57 -0.54 -1.58 0.00 -1.19 -4.93 121.76 123.61 1vp0 s ALA 49 Ca 0.41 -0.39 0.06 0.00 0.00 0.00 0.00 51.96 52.04 1vp0 s ALA 49 Cb -0.06 -3.03 0.22 0.00 0.00 0.00 0.00 23.12 20.24 1vp0 s ALA 49 CO 0.10 -1.51 0.55 1.97 0.00 0.00 0.00 175.76 176.86 1vp0 n PHE 50 N -3.26 1.50 -2.74 0.00 1.16 -1.26 -4.05 117.46 108.82 1vp0 n PHE 50 Ca 0.07 -3.85 -0.09 0.00 -1.87 0.00 0.00 57.45 51.71 1vp0 n PHE 50 Cb 0.58 -0.35 0.09 0.00 -1.61 0.00 0.00 39.48 38.20 1vp0 n PHE 50 CO 0.00 0.00 0.00 -1.91 -1.87 0.00 0.00 176.76 172.98 1vp0 n GLU 51 N 1.65 1.07 0.00 3.97 0.00 -1.26 -4.96 120.64 121.11 1vp0 n GLU 51 Ca 0.25 -1.99 0.00 0.00 0.00 0.00 0.00 57.16 55.43 1vp0 n GLU 51 Cb 0.44 -0.81 0.00 0.00 0.00 0.00 0.00 31.44 31.08 1vp0 n GLU 51 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1vp0 n GLY 52 N 0.10 -0.38 2.91 8.31 0.00 -1.26 -4.96 105.19 109.91 1vp0 n GLY 52 Ca 0.05 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.93 1vp0 n GLY 52 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vp0 s VAL 53 N -0.19 -0.03 -1.19 1.61 1.01 -1.26 -5.04 120.40 115.32 1vp0 s VAL 53 Ca 0.00 0.11 -0.18 0.00 0.00 0.00 0.00 61.98 61.91 1vp0 s VAL 53 Cb 0.00 -0.16 0.09 0.00 0.00 0.00 0.00 36.38 36.31 1vp0 s VAL 53 CO 0.00 0.04 1.55 -0.69 0.00 0.00 0.00 175.10 176.01 1vp0 s VAL 54 N 0.66 4.34 0.93 2.92 1.01 -1.26 -4.89 120.40 124.12 1vp0 s VAL 54 Ca -0.05 -1.81 -0.12 0.00 0.00 0.00 0.00 61.98 60.00 1vp0 s VAL 54 Cb -0.07 -5.07 0.15 0.00 0.00 0.00 0.00 36.38 31.39 1vp0 s VAL 54 CO -0.03 -1.87 1.10 0.27 0.00 0.00 0.00 175.10 174.58 1vp0 s ILE 55 N 3.64 2.29 -0.61 2.22 -0.00 -1.26 -4.99 121.20 122.50 1vp0 s ILE 55 Ca 0.48 0.09 0.16 0.00 -0.00 0.00 0.00 60.65 61.38 1vp0 s ILE 55 Cb 0.01 -2.68 -0.19 0.00 -0.00 0.00 0.00 42.46 39.60 1vp0 s ILE 55 CO 0.01 -0.12 0.62 0.00 -0.00 0.00 0.00 174.94 175.44 1vp0 n ALA 56 N -3.93 3.80 -1.65 2.27 0.00 -1.26 -4.45 120.51 115.28 1vp0 n ALA 56 Ca 0.06 -0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.06 1vp0 n ALA 56 Cb 0.57 -0.58 0.00 0.00 0.00 0.00 0.00 19.45 19.44 1vp0 n ALA 56 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1vp0 n ILE 57 N -1.52-10.31 -3.65 0.00 5.41 -1.26 -1.69 119.36 106.34 1vp0 n ILE 57 Ca 0.02 2.44 -0.03 0.00 1.00 0.00 0.00 62.75 66.18 1vp0 n ILE 57 Cb 0.29 -4.61 -0.07 0.00 -0.71 0.00 0.00 39.64 34.54 1vp0 n ILE 57 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 176.55 176.76 1vp0 s ASN 58 N -0.37 -0.06 0.00 4.38 3.04 -1.24 -2.79 114.94 117.90 1vp0 s ASN 58 Ca 0.00 0.10 0.00 0.00 0.04 0.00 0.00 52.86 53.00 1vp0 s ASN 58 Cb 0.00 0.10 0.00 0.00 -1.54 0.00 0.00 41.25 39.81 1vp0 s ASN 58 CO 0.00 -0.02 0.00 0.61 -3.04 0.00 0.00 177.10 174.65 1vp0 n GLY 59 N 1.42 1.25 0.00 1.21 0.00 -1.26 -4.21 105.19 103.60 1vp0 n GLY 59 Ca -0.09 -2.29 0.00 0.00 0.00 0.00 0.00 46.02 43.65 1vp0 n GLY 59 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1vp0 n SER 60 N 0.00 0.00 0.00 1.61 7.64 -1.26 -4.65 113.62 116.95 1vp0 n SER 60 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1vp0 n SER 60 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1vp0 n SER 60 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1vp0 n GLY 61 N 0.00 0.64 3.05 0.23 0.00 -1.26 -4.39 105.19 103.47 1vp0 n GLY 61 Ca 0.00 -2.02 -0.01 0.00 0.00 0.00 0.00 46.02 43.99 1vp0 n GLY 61 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1vp0 s SER 62 N -4.00 -0.74 0.32 1.61 0.01 -1.26 -4.98 113.70 104.66 1vp0 s SER 62 Ca 0.00 0.51 0.00 0.00 1.31 0.00 0.00 55.95 57.77 1vp0 s SER 62 Cb 0.00 1.73 0.00 0.00 0.21 0.00 0.00 66.02 67.96 1vp0 s SER 62 CO 0.00 -0.28 0.00 0.54 0.41 0.00 0.00 173.24 173.91 1vp0 n ARG 63 N 5.40 -1.86 -1.14 12.44 5.12 -1.26 -4.37 116.66 131.00 1vp0 n ARG 63 Ca -0.01 1.22 -0.04 0.00 -1.93 0.00 0.00 57.85 57.09 1vp0 n ARG 63 Cb 0.51 -2.26 -0.03 0.00 -1.16 0.00 0.00 32.46 29.51 1vp0 n ARG 63 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 1vp0 n LYS 64 N -3.02 0.02 0.00 5.56 4.01 -1.26 -2.87 118.16 120.60 1vp0 n LYS 64 Ca 0.01 -0.45 0.00 0.00 -0.51 0.00 0.00 58.31 57.36 1vp0 n LYS 64 Cb 0.42 -1.77 0.00 0.00 -0.51 0.00 0.00 35.03 33.17 1vp0 n LYS 64 CO 0.00 0.00 0.00 0.43 -1.11 0.00 0.00 177.40 176.72 1vp0 n SER 65 N 8.46 0.00 -3.08 4.39 7.64 -1.26 -5.02 113.62 124.74 1vp0 n SER 65 Ca 0.11 0.00 -0.00 0.00 1.01 0.00 0.00 58.87 59.99 1vp0 n SER 65 Cb 0.48 0.12 -0.00 0.00 -1.01 0.00 0.00 64.21 63.79 1vp0 n SER 65 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1vp0 n PHE 66 N -1.38 -0.40 -2.05 1.43 3.72 -1.14 -3.57 117.46 114.07 1vp0 n PHE 66 Ca 0.00 0.21 -0.31 0.00 -0.05 0.00 0.00 57.45 57.30 1vp0 n PHE 66 Cb 0.00 -1.28 -0.05 0.00 -0.94 0.00 0.00 39.48 37.21 1vp0 n PHE 66 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 1vp0 n THR 67 N 1.94 2.14 0.00 4.37 -2.24 -1.26 -3.64 114.28 115.59 1vp0 n THR 67 Ca -0.02 -2.21 0.00 0.00 -2.27 0.00 0.00 64.05 59.55 1vp0 n THR 67 Cb 0.23 -2.20 0.00 0.00 -2.10 0.00 0.00 70.33 66.26 1vp0 n THR 67 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1vp0 n VAL 68 N 7.51 0.00 -1.73 2.28 0.31 -0.93 -4.72 118.33 121.05 1vp0 n VAL 68 Ca 0.46 1.20 -0.67 0.00 -0.01 0.00 0.00 64.34 65.32 1vp0 n VAL 68 Cb 0.46 -2.13 -0.10 0.00 -0.91 0.00 0.00 33.84 31.16 1vp0 n VAL 68 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 1vp0 n ARG 69 N -1.21 0.00 -2.76 5.55 3.00 -1.26 -4.66 116.66 115.31 1vp0 n ARG 69 Ca 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 57.85 57.75 1vp0 n ARG 69 Cb 0.00 -1.49 0.05 0.00 0.00 0.00 0.00 32.46 31.02 1vp0 n ARG 69 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 1vp0 n LYS 70 N 3.91 1.12 0.00 -0.14 4.76 -1.26 -4.44 118.16 122.12 1vp0 n LYS 70 Ca 0.31 -2.83 0.00 0.00 -2.87 0.00 0.00 58.31 52.91 1vp0 n LYS 70 Cb -0.06 -1.01 0.00 0.00 -1.84 0.00 0.00 35.03 32.12 1vp0 n LYS 70 CO 0.00 0.00 0.00 -0.89 -1.37 0.00 0.00 177.40 175.14 1vp0 n ILE 71 N -0.10 0.03 -3.24 -0.18 -0.00 -1.26 -4.66 119.36 109.94 1vp0 n ILE 71 Ca 0.09 0.01 0.00 0.00 -0.00 0.00 0.00 62.75 62.85 1vp0 n ILE 71 Cb 0.79 -0.69 0.00 0.00 -0.00 0.00 0.00 39.64 39.75 1vp0 n ILE 71 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.55 175.01 1vp0 n SER 72 N -2.54 -1.37 0.00 4.38 3.41 -1.24 -4.95 113.62 111.31 1vp0 n SER 72 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1vp0 n SER 72 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1vp0 n SER 72 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1vp0 n PHE 73 N 0.00 0.00 0.00 7.33 0.99 -0.46 -4.95 117.46 120.37 1vp0 n PHE 73 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 1vp0 n PHE 73 Cb 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 38.48 1vp0 n PHE 73 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1vp0 n GLY 74 N 0.00 0.00 0.28 1.37 0.00 -1.26 -4.58 105.19 101.00 1vp0 n GLY 74 Ca 0.00 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.05 1vp0 n GLY 74 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1vp0 h GLU 75 N 0.00 0.44 -1.74 1.61 5.08 -1.99 -2.55 114.58 115.43 1vp0 h GLU 75 Ca 0.00 -0.05 -0.68 0.00 -1.00 0.00 0.00 59.36 57.63 1vp0 h GLU 75 Cb 0.00 -0.08 -0.34 0.00 0.50 0.00 0.00 28.75 28.82 1vp0 h GLU 75 CO 0.00 0.37 0.20 0.41 -1.00 0.00 0.00 179.01 179.00 1vp0 n GLY 76 N -1.24 5.77 5.05 -3.84 0.00 -1.26 -4.98 105.19 104.68 1vp0 n GLY 76 Ca 0.02 -2.61 0.00 0.00 0.00 0.00 0.00 46.02 43.42 1vp0 n GLY 76 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1vp0 n VAL 77 N -0.52 0.00 0.00 1.61 0.31 -0.96 -4.17 118.33 114.60 1vp0 n VAL 77 Ca 0.47 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.80 1vp0 n VAL 77 Cb 0.45 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.38 1vp0 n VAL 77 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1vp0 n GLU 78 N 0.00 0.00 -1.67 5.55 -0.58 -1.26 -4.39 120.64 118.29 1vp0 n GLU 78 Ca 0.00 0.00 -0.01 0.00 -0.42 0.00 0.00 57.16 56.73 1vp0 n GLU 78 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.87 1vp0 n GLU 78 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1vp0 n ARG 79 N 0.00 -0.39 -3.60 3.49 5.12 -1.26 -1.35 116.66 118.67 1vp0 n ARG 79 Ca 0.00 0.76 -0.21 0.00 -1.93 0.00 0.00 57.85 56.47 1vp0 n ARG 79 Cb 0.00 -1.86 -0.01 0.00 -1.16 0.00 0.00 32.46 29.43 1vp0 n ARG 79 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1vp0 s VAL 80 N -0.78 4.76 -0.48 1.55 1.01 -1.26 -3.73 120.40 121.47 1vp0 s VAL 80 Ca 0.02 -0.83 0.05 0.00 0.00 0.00 0.00 61.98 61.21 1vp0 s VAL 80 Cb -0.01 -3.69 0.22 0.00 0.00 0.00 0.00 36.38 32.90 1vp0 s VAL 80 CO 0.10 -0.33 0.87 2.22 0.00 0.00 0.00 175.10 177.96 1vp0 n PHE 81 N -1.62 -3.16 -0.88 5.22 -1.74 -1.26 -4.99 117.46 109.02 1vp0 n PHE 81 Ca -0.05 -1.44 -0.12 0.00 -0.56 0.00 0.00 57.45 55.28 1vp0 n PHE 81 Cb 0.57 1.47 -0.13 0.00 1.52 0.00 0.00 39.48 42.91 1vp0 n PHE 81 CO 0.00 0.00 0.00 -2.30 -0.56 0.00 0.00 176.76 173.90 1vp0 n PRO 82 N 2.22 0.00 -1.59 3.97 -0.02 -1.26 -4.64 135.00 133.69 1vp0 n PRO 82 Ca 0.12 0.00 -0.31 0.00 -2.02 0.00 0.00 63.50 61.29 1vp0 n PRO 82 Cb 0.61 -0.61 0.05 0.00 -0.02 0.00 0.00 33.50 33.53 1vp0 n PRO 82 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1vp0 s PHE 83 N 0.00 3.14 -0.51 6.00 2.19 -1.26 -4.56 117.98 122.98 1vp0 s PHE 83 Ca 0.73 1.41 -0.27 0.00 0.33 0.00 0.00 56.93 59.12 1vp0 s PHE 83 Cb -0.47 -2.87 0.03 0.00 -1.31 0.00 0.00 43.02 38.40 1vp0 s PHE 83 CO 0.31 -1.21 1.07 0.00 1.83 0.00 0.00 175.22 177.22 1vp0 s ALA 84 N -3.05 3.14 0.46 11.12 0.00 -1.26 -2.18 121.76 129.98 1vp0 s ALA 84 Ca 0.58 -0.74 0.13 0.00 0.00 0.00 0.00 51.96 51.93 1vp0 s ALA 84 Cb -0.14 -3.84 1.07 0.00 0.00 0.00 0.00 23.12 20.22 1vp0 s ALA 84 CO 0.55 -2.31 2.06 1.03 0.00 0.00 0.00 175.76 177.09 1vp0 h SER 85 N 9.27 0.27 -2.33 0.00 0.87 -1.63 -3.35 113.55 116.65 1vp0 h SER 85 Ca -0.24 -0.00 -0.64 0.00 -1.23 0.00 0.00 61.79 59.68 1vp0 h SER 85 Cb 1.07 -0.06 -0.14 0.00 -0.44 0.00 0.00 62.40 62.82 1vp0 h SER 85 CO 1.11 0.18 0.82 -2.84 -0.53 0.00 0.00 176.83 175.57 1vp0 s PRO 86 N -5.30 3.36 -0.00 2.24 0.02 -1.26 -4.96 135.00 129.09 1vp0 s PRO 86 Ca -0.07 -1.16 -0.28 0.00 0.02 0.00 0.00 61.00 59.51 1vp0 s PRO 86 Cb 0.18 -4.63 0.07 0.00 0.02 0.00 0.00 34.50 30.14 1vp0 s PRO 86 CO 0.72 -1.88 0.63 -1.17 -0.33 0.00 0.00 177.00 174.97 1vp0 s LEU 87 N 3.82 -0.51 -0.28 -5.54 2.96 -1.26 -5.02 118.68 112.85 1vp0 s LEU 87 Ca 0.30 0.51 0.09 0.00 -0.22 0.00 0.00 54.13 54.81 1vp0 s LEU 87 Cb -0.09 2.45 0.47 0.00 0.50 0.00 0.00 46.19 49.51 1vp0 s LEU 87 CO 0.01 -0.67 1.38 0.52 -1.32 0.00 0.00 176.35 176.26 1vp0 n VAL 88 N 0.66 2.49 -3.13 1.68 0.31 -1.26 -4.72 118.33 114.35 1vp0 n VAL 88 Ca -0.19 -3.12 -0.21 0.00 -0.01 0.00 0.00 64.34 60.81 1vp0 n VAL 88 Cb 0.59 -0.43 -0.05 0.00 -0.91 0.00 0.00 33.84 33.03 1vp0 n VAL 88 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 1vp0 n ASN 89 N -1.06 -0.44 -3.58 4.52 2.85 -1.26 -5.10 115.26 111.19 1vp0 n ASN 89 Ca 0.32 -2.76 -0.08 0.00 -0.11 0.00 0.00 54.58 51.95 1vp0 n ASN 89 Cb 0.91 -0.20 -0.04 0.00 1.24 0.00 0.00 39.78 41.69 1vp0 n ASN 89 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1vp0 s GLN 90 N -0.73 0.50 0.30 1.20 0.00 -1.26 -3.83 119.66 115.84 1vp0 s GLN 90 Ca 0.34 0.01 -0.29 0.00 -0.00 0.00 0.00 55.36 55.42 1vp0 s GLN 90 Cb 0.16 0.23 -0.10 0.00 0.00 0.00 0.00 33.01 33.31 1vp0 s GLN 90 CO -0.14 -0.18 1.24 0.08 0.00 0.00 0.00 175.29 176.29 1vp0 s VAL 91 N -1.64 3.01 -1.21 3.63 1.01 -1.02 -4.90 120.40 119.27 1vp0 s VAL 91 Ca 0.03 1.00 -0.17 0.00 0.00 0.00 0.00 61.98 62.83 1vp0 s VAL 91 Cb -0.01 -3.64 -0.03 0.00 0.00 0.00 0.00 36.38 32.71 1vp0 s VAL 91 CO -0.03 0.23 2.07 1.07 0.00 0.00 0.00 175.10 178.44 1vp0 n THR 92 N 1.08 2.91 0.00 3.92 5.66 -1.26 -4.32 114.28 122.26 1vp0 n THR 92 Ca 0.00 -2.62 0.00 0.00 -3.05 0.00 0.00 64.05 58.38 1vp0 n THR 92 Cb 0.43 -2.47 0.00 0.00 -1.55 0.00 0.00 70.33 66.74 1vp0 n THR 92 CO 0.00 0.00 0.00 2.30 -3.05 0.00 0.00 175.07 174.32 1vp0 n ILE 93 N 5.66 0.00 -3.75 1.09 -6.64 -1.26 -4.99 119.36 109.47 1vp0 n ILE 93 Ca 0.51 0.00 -0.10 0.00 -1.77 0.00 0.00 62.75 61.39 1vp0 n ILE 93 Cb 0.41 0.00 -0.05 0.00 -1.44 0.00 0.00 39.64 38.55 1vp0 n ILE 93 CO 0.00 0.00 0.00 -0.69 -1.77 0.00 0.00 176.55 174.09 1vp0 s VAL 94 N -0.21 0.07 -0.24 7.28 1.01 -1.26 -4.60 120.40 122.45 1vp0 s VAL 94 Ca 0.00 -0.85 -0.12 0.00 0.00 0.00 0.00 61.98 61.01 1vp0 s VAL 94 Cb 0.00 -1.39 0.08 0.00 0.00 0.00 0.00 36.38 35.07 1vp0 s VAL 94 CO 0.00 -0.33 0.57 -1.83 0.00 0.00 0.00 175.10 173.52 1vp0 s GLU 95 N -3.85 0.56 -0.13 2.72 -1.05 -1.26 -4.76 118.70 110.92 1vp0 s GLU 95 Ca 0.07 1.11 -0.30 0.00 -0.15 0.00 0.00 54.97 55.71 1vp0 s GLU 95 Cb 0.02 0.22 0.10 0.00 -0.44 0.00 0.00 34.13 34.03 1vp0 s GLU 95 CO -0.08 -0.17 0.85 0.50 0.95 0.00 0.00 175.26 177.31 1vp0 s ARG 96 N 1.85 0.80 0.00 -4.83 6.06 -1.26 -5.13 118.95 116.44 1vp0 s ARG 96 Ca -0.08 0.30 0.00 0.00 -2.50 0.00 0.00 55.73 53.45 1vp0 s ARG 96 Cb -0.08 0.38 0.00 0.00 0.06 0.00 0.00 34.95 35.31 1vp0 s ARG 96 CO -0.17 -0.23 0.00 0.41 -2.50 0.00 0.00 175.30 172.81 1vp0 n GLY 97 N 1.09 2.42 0.29 8.12 0.00 -1.26 -4.51 105.19 111.35 1vp0 n GLY 97 Ca -0.14 -1.05 0.17 0.00 0.00 0.00 0.00 46.02 44.99 1vp0 n GLY 97 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1vp0 h LYS 98 N 0.00 0.00 -3.72 1.61 1.63 -1.96 -3.46 116.57 110.66 1vp0 h LYS 98 Ca 0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1vp0 h LYS 98 Cb 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.63 1vp0 h LYS 98 CO 0.00 0.05 -0.50 1.33 -3.45 0.00 0.00 179.45 176.88 1vp0 n VAL 99 N -3.41 -6.28 -3.01 2.00 0.24 -1.26 -4.90 118.33 101.72 1vp0 n VAL 99 Ca -0.02 1.72 -0.43 0.00 -2.04 0.00 0.00 64.34 63.57 1vp0 n VAL 99 Cb 0.18 -2.85 -0.06 0.00 -1.47 0.00 0.00 33.84 29.64 1vp0 n VAL 99 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 1vp0 s ARG 100 N -0.51 3.40 -0.21 7.34 3.00 -1.26 -5.01 118.95 125.71 1vp0 s ARG 100 Ca 0.00 -0.15 -0.13 0.00 0.00 0.00 0.00 55.73 55.45 1vp0 s ARG 100 Cb 0.00 -3.93 -0.05 0.00 0.00 0.00 0.00 34.95 30.97 1vp0 s ARG 100 CO 0.00 -1.06 0.26 -0.98 0.00 0.00 0.00 175.30 173.52 1vp0 s ARG 101 N 3.14 4.15 0.00 3.54 1.70 -1.26 -4.38 118.95 125.84 1vp0 s ARG 101 Ca 0.28 -0.04 0.00 0.00 -0.47 0.00 0.00 55.73 55.50 1vp0 s ARG 101 Cb -0.13 -3.51 0.00 0.00 -0.57 0.00 0.00 34.95 30.74 1vp0 s ARG 101 CO 0.21 0.07 0.19 0.00 -1.08 0.00 0.00 175.30 174.69 1vp0 n ALA 102 N 4.17 0.00 0.00 7.88 0.00 -1.26 -4.86 120.51 126.44 1vp0 n ALA 102 Ca -0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.32 1vp0 n ALA 102 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.97 1vp0 n ALA 102 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1vp0 n LYS 103 N -0.26 3.28 -0.92 0.00 3.00 -1.26 -5.04 118.16 116.95 1vp0 n LYS 103 Ca 0.00 0.00 0.12 0.00 -0.00 0.00 0.00 58.31 58.43 1vp0 n LYS 103 Cb 0.00 -0.60 -0.04 0.00 0.00 0.00 0.00 35.03 34.39 1vp0 n LYS 103 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 1vp0 n LEU 104 N -0.62 -0.53 0.00 3.14 4.32 -1.26 -4.95 117.00 117.11 1vp0 n LEU 104 Ca 0.00 1.19 0.00 0.00 -0.02 0.00 0.00 56.01 57.18 1vp0 n LEU 104 Cb 0.00 -2.92 0.00 0.00 -1.62 0.00 0.00 43.42 38.88 1vp0 n LEU 104 CO 0.00 -2.11 0.00 -1.22 -1.22 0.00 0.00 177.39 172.84 1vp0 n TYR 105 N -3.47 -0.54 -0.82 -1.77 4.01 -1.26 -4.75 117.16 108.56 1vp0 n TYR 105 Ca -0.01 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.48 1vp0 n TYR 105 Cb 0.43 0.15 0.21 0.00 -0.31 0.00 0.00 39.34 39.82 1vp0 n TYR 105 CO 0.00 0.00 0.00 2.48 -0.46 0.00 0.00 176.86 178.88 1vp0 n TYR 106 N 0.00 -3.70 0.17 -0.72 0.18 -1.26 -4.15 117.16 107.67 1vp0 n TYR 106 Ca 0.00 -0.79 0.00 0.00 1.88 0.00 0.00 57.90 58.99 1vp0 n TYR 106 Cb 0.00 -0.96 0.00 0.00 -0.38 0.00 0.00 39.34 38.00 1vp0 n TYR 106 CO 0.00 0.00 0.00 -0.11 -2.08 0.00 0.00 176.86 174.67 1vp0 n LEU 107 N 0.00 -2.60 0.00 -3.48 0.00 -1.26 -4.91 117.00 104.76 1vp0 n LEU 107 Ca 0.12 0.63 0.00 0.00 0.00 0.00 0.00 56.01 56.76 1vp0 n LEU 107 Cb 0.49 2.54 0.00 0.00 0.00 0.00 0.00 43.42 46.45 1vp0 n LEU 107 CO 0.33 -0.06 0.00 0.54 0.00 0.00 0.00 177.39 178.21 1vp0 n ARG 108 N -3.22 0.00 -1.38 1.96 5.12 -1.26 -4.89 116.66 112.99 1vp0 n ARG 108 Ca 0.00 0.00 -0.29 0.00 -1.93 0.00 0.00 57.85 55.63 1vp0 n ARG 108 Cb 0.00 -0.29 0.23 0.00 -1.16 0.00 0.00 32.46 31.23 1vp0 n ARG 108 CO 0.00 0.00 0.00 0.39 -1.93 0.00 0.00 177.63 176.09 1vp0 n GLU 109 N 0.00 -2.31 0.00 5.56 4.71 -1.26 -4.53 120.64 122.81 1vp0 n GLU 109 Ca 0.00 -1.84 0.00 0.00 -0.01 0.00 0.00 57.16 55.31 1vp0 n GLU 109 Cb 0.00 -1.49 0.00 0.00 -1.01 0.00 0.00 31.44 28.94 1vp0 n GLU 109 CO 0.00 0.00 0.00 -0.11 0.09 0.00 0.00 177.13 177.11 1vp0 n LEU 110 N 0.00 0.00 -3.73 -4.62 7.94 -1.26 -4.83 117.00 110.50 1vp0 n LEU 110 Ca 0.15 0.00 -0.33 0.00 -1.11 0.00 0.00 56.01 54.72 1vp0 n LEU 110 Cb 0.57 0.00 0.04 0.00 0.53 0.00 0.00 43.42 44.56 1vp0 n LEU 110 CO 0.40 0.00 -0.09 -1.14 -1.11 0.00 0.00 177.39 175.46 1vp0 n ARG 111 N 14.00 -1.19 0.00 1.96 0.63 -1.26 -4.29 116.66 126.50 1vp0 n ARG 111 Ca 0.00 0.42 0.00 0.00 -0.92 0.00 0.00 57.85 57.35 1vp0 n ARG 111 Cb 0.00 -3.97 0.00 0.00 0.45 0.00 0.00 32.46 28.94 1vp0 n ARG 111 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1vp0 n GLY 112 N -1.73 0.20 1.73 5.14 0.00 -1.26 -4.96 105.19 104.31 1vp0 n GLY 112 Ca -0.10 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.78 1vp0 n GLY 112 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1vp0 n LYS 113 N 0.00 1.70 0.00 1.61 5.02 -1.26 -4.70 118.16 120.53 1vp0 n LYS 113 Ca 0.00 -1.52 0.00 0.00 -2.02 0.00 0.00 58.31 54.77 1vp0 n LYS 113 Cb 0.00 -1.60 0.00 0.00 -0.02 0.00 0.00 35.03 33.41 1vp0 n LYS 113 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1vp0 n ALA 114 N -0.02 0.00 -0.80 7.82 0.00 -1.26 -4.71 120.51 121.54 1vp0 n ALA 114 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.74 1vp0 n ALA 114 Cb 0.85 0.09 0.00 0.00 0.00 0.00 0.00 19.45 20.40 1vp0 n ALA 114 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1vp0 n ALA 115 N -1.24 0.00 0.12 0.00 0.00 -1.26 -4.22 120.51 113.92 1vp0 n ALA 115 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1vp0 n ALA 115 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1vp0 n ALA 115 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1vp0 n ARG 116 N 0.00 0.00 -1.54 0.00 0.00 -1.26 -5.00 116.66 108.86 1vp0 n ARG 116 Ca 0.00 0.00 -0.36 0.00 -0.00 0.00 0.00 57.85 57.49 1vp0 n ARG 116 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 32.46 32.39 1vp0 n ARG 116 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.63 176.74 1vp0 n ILE 117 N -3.15 1.69 -2.76 5.15 5.41 -1.26 -4.21 119.36 120.22 1vp0 n ILE 117 Ca 0.00 -1.62 -0.09 0.00 1.00 0.00 0.00 62.75 62.04 1vp0 n ILE 117 Cb 0.00 -2.22 0.06 0.00 -0.71 0.00 0.00 39.64 36.77 1vp0 n ILE 117 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 176.55 176.84 1vp0 n LYS 118 N 7.69 0.88 -0.11 0.38 4.76 -1.26 -5.01 118.16 125.49 1vp0 n LYS 118 Ca 0.47 -1.88 -0.18 0.00 -2.87 0.00 0.00 58.31 53.85 1vp0 n LYS 118 Cb 0.44 -1.28 -0.07 0.00 -1.84 0.00 0.00 35.03 32.27 1vp0 n LYS 118 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 1vp0 n SER 119 N 1.07 1.91 -2.66 4.39 3.41 -1.26 -4.94 113.62 115.54 1vp0 n SER 119 Ca 0.08 0.41 -0.04 0.00 -0.26 0.00 0.00 58.87 59.06 1vp0 n SER 119 Cb 0.66 -0.84 0.01 0.00 -0.26 0.00 0.00 64.21 63.78 1vp0 n SER 119 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1vp0 n ASP 120 N -4.41 -1.18 -3.84 4.04 2.03 -1.26 -4.74 116.55 107.19 1vp0 n ASP 120 Ca -0.31 -1.71 -0.09 0.00 0.52 0.00 0.00 54.79 53.19 1vp0 n ASP 120 Cb 0.64 1.03 -0.05 0.00 -0.72 0.00 0.00 41.12 42.02 1vp0 n ASP 120 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1vp0 s ARG 121 N 0.04 1.30 -0.34 -0.67 0.52 -1.26 -4.01 118.95 114.52 1vp0 s ARG 121 Ca 0.07 -1.01 -0.01 0.00 -0.52 0.00 0.00 55.73 54.26 1vp0 s ARG 121 Cb 0.11 0.46 0.19 0.00 0.52 0.00 0.00 34.95 36.23 1vp0 s ARG 121 CO -0.05 -0.52 0.81 0.45 0.02 0.00 0.00 175.30 176.02 1vp0 s SER 122 N -2.92 -1.02 0.36 0.23 0.15 -1.26 -4.90 113.70 104.34 1vp0 s SER 122 Ca 0.13 -0.23 0.00 0.00 0.70 0.00 0.00 55.95 56.55 1vp0 s SER 122 Cb 0.01 1.44 0.00 0.00 -1.71 0.00 0.00 66.02 65.76 1vp0 s SER 122 CO -0.01 -0.15 0.00 0.54 1.20 0.00 0.00 173.24 174.82 1vp0 n ARG 123 N 4.61 0.00 -1.16 5.44 1.74 -1.26 -4.82 116.66 121.22 1vp0 n ARG 123 Ca 0.08 0.00 0.06 0.00 -0.77 0.00 0.00 57.85 57.22 1vp0 n ARG 123 Cb 0.58 0.00 -0.03 0.00 -1.02 0.00 0.00 32.46 31.99 1vp0 n ARG 123 CO 0.00 0.00 0.00 1.33 -1.52 0.00 0.00 177.63 177.44 1vp0 n VAL 124 N -3.36 -0.97 0.92 1.55 0.24 -1.26 -4.84 118.33 110.62 1vp0 n VAL 124 Ca 0.00 0.65 0.10 0.00 -2.04 0.00 0.00 64.34 63.06 1vp0 n VAL 124 Cb 0.00 -1.03 0.02 0.00 -1.47 0.00 0.00 33.84 31.36 1vp0 n VAL 124 CO 0.00 0.00 0.00 0.80 -2.14 0.00 0.00 176.83 175.49 1vp0 n MET 125 N -3.23 1.51 0.00 7.34 1.56 -1.26 -5.34 117.12 117.70 1vp0 n MET 125 Ca -0.03 -1.15 0.00 0.00 -0.27 0.00 0.00 57.70 56.24 1vp0 n MET 125 Cb 0.34 -1.42 0.00 0.00 2.15 0.00 0.00 33.22 34.29 1vp0 n MET 125 CO 0.00 0.00 0.00 1.63 -0.73 0.00 0.00 175.97 176.87