#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qp1 n LYS 2 N 0.00 1.42 -2.80 2.12 0.00 -1.26 -4.97 118.16 112.66 2qp1 n LYS 2 Ca 0.00 0.50 -0.20 0.00 -0.00 0.00 0.00 58.31 58.62 2qp1 n LYS 2 Cb 0.00 -2.01 0.03 0.00 -0.00 0.00 0.00 35.03 33.05 2qp1 n LYS 2 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 2qp1 s THR 3 N -0.34 2.72 1.07 0.58 -4.23 -1.26 -5.09 115.64 109.10 2qp1 s THR 3 Ca 0.69 -0.81 -0.22 0.00 -1.18 0.00 0.00 61.69 60.17 2qp1 s THR 3 Cb -0.77 -2.91 0.01 0.00 1.34 0.00 0.00 72.50 70.16 2qp1 s THR 3 CO 0.53 0.00 -0.52 0.33 -0.54 0.00 0.00 174.62 174.42 2qp1 n PHE 4 N -2.18 -1.41 0.00 3.99 -0.00 -1.26 -5.03 117.46 111.57 2qp1 n PHE 4 Ca 0.09 0.32 0.00 0.00 -0.00 0.00 0.00 57.45 57.86 2qp1 n PHE 4 Cb 0.60 -1.49 0.00 0.00 -0.00 0.00 0.00 39.48 38.59 2qp1 n PHE 4 CO 0.00 0.00 0.00 -2.37 -0.00 0.00 0.00 176.76 174.39 2qp1 n THR 5 N -4.12 0.00 -1.01 -2.13 5.66 -1.26 -4.91 114.28 106.53 2qp1 n THR 5 Ca -0.00 0.00 -0.39 0.00 -3.05 0.00 0.00 64.05 60.61 2qp1 n THR 5 Cb 0.65 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.38 2qp1 n THR 5 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2qp1 n ALA 6 N 0.00 -1.68 -2.35 1.79 0.00 -1.07 -4.88 120.51 112.32 2qp1 n ALA 6 Ca 0.00 0.34 -0.40 0.00 0.00 0.00 0.00 53.44 53.38 2qp1 n ALA 6 Cb 0.00 -1.14 -0.05 0.00 0.00 0.00 0.00 19.45 18.26 2qp1 n ALA 6 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2qp1 s LYS 7 N 0.90 4.50 0.08 0.00 -0.14 -1.26 -4.88 119.74 118.94 2qp1 s LYS 7 Ca 0.61 1.08 0.03 0.00 -1.36 0.00 0.00 55.97 56.33 2qp1 s LYS 7 Cb -0.86 -3.35 0.18 0.00 -1.68 0.00 0.00 37.83 32.12 2qp1 s LYS 7 CO 0.43 0.31 0.93 -2.30 -0.76 0.00 0.00 175.35 173.96 2qp1 n PRO 8 N 2.67 0.02 -0.10 -1.68 -0.02 -1.26 -1.44 135.00 133.19 2qp1 n PRO 8 Ca -0.03 0.37 -0.20 0.00 -2.02 0.00 0.00 63.50 61.62 2qp1 n PRO 8 Cb 0.50 -1.78 -0.11 0.00 -0.02 0.00 0.00 33.50 32.09 2qp1 n PRO 8 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 2qp1 n GLU 9 N -1.49 0.55 -2.26 -0.52 4.71 -1.26 -4.55 120.64 115.83 2qp1 n GLU 9 Ca -0.00 0.57 -0.43 0.00 -0.01 0.00 0.00 57.16 57.29 2qp1 n GLU 9 Cb 0.22 -1.74 0.00 0.00 -1.01 0.00 0.00 31.44 28.91 2qp1 n GLU 9 CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47 2qp1 n THR 10 N -4.45 4.05 -4.77 2.62 -2.24 -0.52 -4.93 114.28 104.04 2qp1 n THR 10 Ca -0.30 -4.03 -0.24 0.00 -2.27 0.00 0.00 64.05 57.21 2qp1 n THR 10 Cb 0.65 -2.44 -0.15 0.00 -2.10 0.00 0.00 70.33 66.29 2qp1 n THR 10 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2qp1 s VAL 11 N 1.60 1.33 -0.14 2.28 1.01 -1.26 -4.53 120.40 120.69 2qp1 s VAL 11 Ca 0.43 -0.75 -0.12 0.00 0.00 0.00 0.00 61.98 61.55 2qp1 s VAL 11 Cb 0.09 -1.11 -0.09 0.00 0.00 0.00 0.00 36.38 35.27 2qp1 s VAL 11 CO -0.02 0.35 0.13 0.07 0.00 0.00 0.00 175.10 175.63 2qp1 h LYS 12 N 5.66 0.00 0.00 2.72 -0.00 -1.92 -3.48 116.57 119.55 2qp1 h LYS 12 Ca -0.37 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.28 2qp1 h LYS 12 Cb 1.15 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.38 2qp1 h LYS 12 CO 0.48 0.35 0.00 0.54 -0.00 0.00 0.00 179.45 180.82 2qp1 n ARG 13 N -4.64 0.00 -1.05 0.07 5.12 -1.26 -4.93 116.66 109.96 2qp1 n ARG 13 Ca -0.09 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.83 2qp1 n ARG 13 Cb 0.28 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.58 2qp1 n ARG 13 CO 0.00 0.00 0.00 -0.25 -1.93 0.00 0.00 177.63 175.45 2qp1 n ASP 14 N 3.95 -5.94 -4.85 0.55 10.43 -1.26 -3.64 116.55 115.79 2qp1 n ASP 14 Ca 0.00 0.93 -0.24 0.00 2.57 0.00 0.00 54.79 58.05 2qp1 n ASP 14 Cb 0.00 -2.90 -0.04 0.00 1.84 0.00 0.00 41.12 40.01 2qp1 n ASP 14 CO 0.00 0.00 0.00 0.26 -1.07 0.00 0.00 177.20 176.39 2qp1 s TRP 15 N -3.46 3.22 0.10 1.24 0.52 -1.26 0.61 118.94 119.90 2qp1 s TRP 15 Ca 0.00 -0.03 -0.19 0.00 0.02 0.00 0.00 56.10 55.90 2qp1 s TRP 15 Cb 0.00 -1.50 0.04 0.00 -1.15 0.00 0.00 33.47 30.86 2qp1 s TRP 15 CO 0.00 0.51 0.45 0.71 0.02 0.00 0.00 176.95 178.64 2qp1 s TYR 16 N -1.90 -0.30 -0.24 -1.98 1.51 0.23 -3.61 117.35 111.06 2qp1 s TYR 16 Ca 0.32 0.13 -0.02 0.00 -1.01 0.00 0.00 57.07 56.49 2qp1 s TYR 16 Cb -0.09 0.31 0.08 0.00 -0.11 0.00 0.00 41.96 42.14 2qp1 s TYR 16 CO 0.25 -0.68 0.06 0.08 -1.11 0.00 0.00 175.55 174.15 2qp1 s VAL 17 N -3.26 0.66 0.21 0.71 1.01 -1.08 -1.52 120.40 117.13 2qp1 s VAL 17 Ca -0.01 -0.90 0.06 0.00 0.00 0.00 0.00 61.98 61.13 2qp1 s VAL 17 Cb 0.00 -1.29 -0.04 0.00 0.00 0.00 0.00 36.38 35.06 2qp1 s VAL 17 CO -0.08 -0.40 0.20 0.54 0.00 0.00 0.00 175.10 175.36 2qp1 s VAL 18 N 1.77 4.63 -0.21 2.92 0.11 0.70 -2.84 120.40 127.48 2qp1 s VAL 18 Ca 0.03 -1.17 -0.01 0.00 -2.93 0.00 0.00 61.98 57.90 2qp1 s VAL 18 Cb -0.17 -3.44 0.02 0.00 -1.53 0.00 0.00 36.38 31.26 2qp1 s VAL 18 CO -0.16 -0.23 -0.12 -0.62 -3.33 0.00 0.00 175.10 170.64 2qp1 s ASP 19 N -3.52 3.78 -1.07 3.54 3.68 -1.26 -1.64 116.67 120.18 2qp1 s ASP 19 Ca 0.32 -0.70 -0.11 0.00 2.13 0.00 0.00 52.55 54.19 2qp1 s ASP 19 Cb -0.09 -1.59 0.24 0.00 -1.45 0.00 0.00 42.92 40.03 2qp1 s ASP 19 CO 0.25 -0.05 1.11 0.00 0.13 0.00 0.00 175.17 176.61 2qp1 s ALA 20 N 1.33 4.45 0.00 3.66 0.00 -1.26 -4.81 121.76 125.12 2qp1 s ALA 20 Ca 0.03 -3.63 0.00 0.00 0.00 0.00 0.00 51.96 48.36 2qp1 s ALA 20 Cb -0.15 -3.68 0.00 0.00 0.00 0.00 0.00 23.12 19.30 2qp1 s ALA 20 CO -0.08 -2.35 0.00 2.41 0.00 0.00 0.00 175.76 175.74 2qp1 n THR 21 N 3.36 0.00 0.10 0.00 -1.04 -1.26 -1.26 114.28 114.18 2qp1 n THR 21 Ca 0.24 0.00 0.06 0.00 -2.04 0.00 0.00 64.05 62.31 2qp1 n THR 21 Cb 0.42 -0.09 0.31 0.00 -1.82 0.00 0.00 70.33 69.15 2qp1 n THR 21 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2qp1 n GLY 22 N 4.51 -0.71 3.72 3.41 0.00 -1.26 -3.26 105.19 111.61 2qp1 n GLY 22 Ca 0.00 0.10 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 2qp1 n GLY 22 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2qp1 n LYS 23 N -1.90 2.12 -0.14 1.61 4.76 -1.26 -4.60 118.16 118.76 2qp1 n LYS 23 Ca -0.01 0.75 0.02 0.00 -2.87 0.00 0.00 58.31 56.21 2qp1 n LYS 23 Cb 0.02 -2.45 0.08 0.00 -1.84 0.00 0.00 35.03 30.84 2qp1 n LYS 23 CO 0.00 0.00 0.00 0.25 -1.37 0.00 0.00 177.40 176.28 2qp1 n THR 24 N -0.02 0.39 -4.97 -0.18 -2.24 -1.26 -0.87 114.28 105.14 2qp1 n THR 24 Ca 0.05 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.57 2qp1 n THR 24 Cb 0.39 -0.14 0.00 0.00 -2.10 0.00 0.00 70.33 68.48 2qp1 n THR 24 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 2qp1 n LEU 25 N 0.05 0.00 0.00 3.22 -0.00 -1.25 -4.29 117.00 114.73 2qp1 n LEU 25 Ca 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.07 2qp1 n LEU 25 Cb 0.28 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.70 2qp1 n LEU 25 CO 0.05 -1.01 0.00 0.61 -0.00 0.00 0.00 177.39 177.05 2qp1 n GLY 26 N 0.00 0.34 0.34 -3.96 0.00 -1.26 -1.76 105.19 98.89 2qp1 n GLY 26 Ca 0.00 0.40 0.17 0.00 0.00 0.00 0.00 46.02 46.59 2qp1 n GLY 26 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2qp1 h ARG 27 N 0.00 0.01 0.25 1.61 3.08 -2.00 1.62 114.38 118.96 2qp1 h ARG 27 Ca 0.00 -0.00 0.01 0.00 0.07 0.00 0.00 59.98 60.06 2qp1 h ARG 27 Cb 0.00 -0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.02 2qp1 h ARG 27 CO 0.00 0.01 -0.34 1.25 -1.07 0.00 0.00 179.97 179.82 2qp1 h LEU 28 N 0.01 -0.93 -0.55 3.04 5.85 -1.67 -2.33 115.31 118.73 2qp1 h LEU 28 Ca 0.63 0.09 0.10 0.00 0.84 0.00 0.00 57.88 59.54 2qp1 h LEU 28 Cb 1.37 0.33 -0.11 0.00 0.37 0.00 0.00 40.66 42.62 2qp1 h LEU 28 CO -0.90 -0.45 -0.34 0.00 -0.34 0.00 0.00 178.44 176.41 2qp1 h ALA 29 N -0.09 -0.09 -0.44 1.25 0.00 0.20 0.39 119.26 120.48 2qp1 h ALA 29 Ca -0.00 0.15 0.07 0.00 0.00 0.00 0.00 54.91 55.13 2qp1 h ALA 29 Cb 0.62 0.77 -0.09 0.00 0.00 0.00 0.00 17.79 19.09 2qp1 h ALA 29 CO -0.12 -0.70 -0.42 1.79 0.00 0.00 0.00 179.25 179.81 2qp1 h THR 30 N -0.19 0.12 -0.39 0.00 1.35 -0.50 1.26 112.91 114.56 2qp1 h THR 30 Ca 0.22 0.00 0.03 0.00 -0.55 0.00 0.00 66.41 66.11 2qp1 h THR 30 Cb 0.55 0.12 -0.03 0.00 -1.73 0.00 0.00 68.15 67.05 2qp1 h THR 30 CO -0.65 0.00 0.18 -0.08 -0.25 0.00 0.00 175.52 174.72 2qp1 h GLU 31 N -0.30 0.36 0.00 4.72 4.57 -0.68 0.46 114.58 123.71 2qp1 h GLU 31 Ca 0.15 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.31 2qp1 h GLU 31 Cb 0.58 -0.08 0.00 0.00 -0.16 0.00 0.00 28.75 29.09 2qp1 h GLU 31 CO -0.59 0.24 0.00 1.28 -1.18 0.00 0.00 179.01 178.75 2qp1 n LEU 32 N -4.95 0.00 -0.32 1.64 4.77 0.12 -1.64 117.00 116.62 2qp1 n LEU 32 Ca 0.02 0.97 0.19 0.00 -0.03 0.00 0.00 56.01 57.15 2qp1 n LEU 32 Cb 0.11 -0.47 0.37 0.00 -2.33 0.00 0.00 43.42 41.10 2qp1 n LEU 32 CO 0.29 -0.47 0.94 0.00 -1.33 0.00 0.00 177.39 176.82 2qp1 h ALA 33 N -1.74 1.50 -0.27 -1.18 0.00 0.16 0.54 119.26 118.27 2qp1 h ALA 33 Ca 0.00 0.27 0.06 0.00 0.00 0.00 0.00 54.91 55.25 2qp1 h ALA 33 Cb 0.00 0.40 -0.08 0.00 0.00 0.00 0.00 17.79 18.12 2qp1 h ALA 33 CO 0.00 -0.62 -0.30 -0.09 0.00 0.00 0.00 179.25 178.24 2qp1 h ARG 34 N 0.10 -0.29 -0.99 0.00 1.12 0.39 0.29 114.38 115.00 2qp1 h ARG 34 Ca 0.65 0.02 0.13 0.00 -1.11 0.00 0.00 59.98 59.67 2qp1 h ARG 34 Cb 1.45 0.07 -0.09 0.00 -0.01 0.00 0.00 29.97 31.39 2qp1 h ARG 34 CO -0.77 -0.19 0.62 0.00 -3.11 0.00 0.00 179.97 176.53 2qp1 h ARG 35 N -0.30 0.91 -0.96 0.20 -0.00 0.10 0.37 114.38 114.70 2qp1 h ARG 35 Ca 0.14 -0.05 0.00 0.00 -0.50 0.00 0.00 59.98 59.56 2qp1 h ARG 35 Cb 0.52 -0.20 0.00 0.00 0.00 0.00 0.00 29.97 30.28 2qp1 h ARG 35 CO -0.44 0.60 0.00 1.28 0.00 0.00 0.00 179.97 181.41 2qp1 n LEU 36 N -4.63 0.87 -0.16 3.04 7.99 1.00 -0.99 117.00 124.12 2qp1 n LEU 36 Ca 0.19 -0.44 0.00 0.00 -0.01 0.00 0.00 56.01 55.76 2qp1 n LEU 36 Cb 0.40 -0.23 0.00 0.00 -0.11 0.00 0.00 43.42 43.48 2qp1 n LEU 36 CO 0.27 0.17 0.10 -1.14 -1.51 0.00 0.00 177.39 175.27 2qp1 n ARG 37 N 0.50 0.00 -1.73 3.23 0.63 0.10 -4.56 116.66 114.84 2qp1 n ARG 37 Ca 0.00 -0.07 -0.06 0.00 -0.92 0.00 0.00 57.85 56.80 2qp1 n ARG 37 Cb 0.17 -0.06 -0.02 0.00 0.45 0.00 0.00 32.46 33.01 2qp1 n ARG 37 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2qp1 n GLY 38 N 0.00 0.10 0.48 5.14 0.00 -0.64 -4.48 105.19 105.79 2qp1 n GLY 38 Ca 0.00 0.00 0.29 0.00 0.00 0.00 0.00 46.02 46.31 2qp1 n GLY 38 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2qp1 h LYS 39 N 0.00 0.00 0.12 1.61 1.63 -1.82 0.61 116.57 118.72 2qp1 h LYS 39 Ca -0.13 0.00 -0.32 0.00 -0.85 0.00 0.00 60.65 59.35 2qp1 h LYS 39 Cb 0.69 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.31 2qp1 h LYS 39 CO 0.17 0.00 -1.63 1.12 -3.45 0.00 0.00 179.45 175.66 2qp1 h HIS 40 N 0.00 0.47 0.00 1.91 2.07 -1.85 -3.44 115.15 114.31 2qp1 h HIS 40 Ca 0.42 -0.34 0.00 0.00 -2.85 0.00 0.00 60.37 57.60 2qp1 h HIS 40 Cb 1.91 -0.02 0.00 0.00 2.57 0.00 0.00 27.41 31.88 2qp1 h HIS 40 CO 0.00 1.45 0.00 1.63 -3.07 0.00 0.00 177.93 177.94 2qp1 n LYS 41 N -3.45 2.39 -2.45 5.12 5.02 0.20 -4.81 118.16 120.17 2qp1 n LYS 41 Ca -0.20 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.69 2qp1 n LYS 41 Cb 1.05 0.00 0.01 0.00 -0.02 0.00 0.00 35.03 36.07 2qp1 n LYS 41 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2qp1 n ALA 42 N -3.00 6.28 0.00 7.82 0.00 -1.26 -4.81 120.51 125.54 2qp1 n ALA 42 Ca 0.00 -4.46 0.00 0.00 0.00 0.00 0.00 53.44 48.98 2qp1 n ALA 42 Cb 0.00 -2.36 0.00 0.00 0.00 0.00 0.00 19.45 17.09 2qp1 n ALA 42 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2qp1 n GLU 43 N 0.47 0.00 -1.41 0.00 0.00 -1.23 -4.54 120.64 113.93 2qp1 n GLU 43 Ca 0.51 0.09 -0.12 0.00 0.00 0.00 0.00 57.16 57.64 2qp1 n GLU 43 Cb 0.26 -1.60 -0.10 0.00 0.00 0.00 0.00 31.44 29.99 2qp1 n GLU 43 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.13 178.11 2qp1 n TYR 44 N -0.92 0.54 0.00 4.31 -0.00 -1.26 -3.02 117.16 116.81 2qp1 n TYR 44 Ca 0.00 -0.05 0.00 0.00 -0.00 0.00 0.00 57.90 57.85 2qp1 n TYR 44 Cb 0.10 -1.62 0.00 0.00 -0.00 0.00 0.00 39.34 37.82 2qp1 n TYR 44 CO 0.00 0.00 0.00 -2.37 -0.00 0.00 0.00 176.86 174.49 2qp1 n THR 45 N 7.09 0.00 -0.44 2.97 5.66 -1.26 -2.59 114.28 125.70 2qp1 n THR 45 Ca 0.37 0.00 0.41 0.00 -3.05 0.00 0.00 64.05 61.78 2qp1 n THR 45 Cb 0.40 0.00 0.77 0.00 -1.55 0.00 0.00 70.33 69.95 2qp1 n THR 45 CO 0.00 0.00 0.00 -0.65 -3.05 0.00 0.00 175.07 171.37 2qp1 h PRO 46 N 0.00 0.00 -0.84 1.09 0.11 -1.95 0.40 132.00 130.81 2qp1 h PRO 46 Ca 0.00 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.10 2qp1 h PRO 46 Cb 0.00 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.10 2qp1 h PRO 46 CO 0.00 0.00 0.01 -2.39 -0.21 0.00 0.00 178.00 175.41 2qp1 n HIS 47 N -4.11 0.85 -3.68 0.65 1.44 -1.26 -4.75 115.22 104.36 2qp1 n HIS 47 Ca 0.31 -0.32 -0.15 0.00 -2.01 0.00 0.00 57.72 55.56 2qp1 n HIS 47 Cb 1.49 -0.28 -0.14 0.00 0.12 0.00 0.00 29.99 31.17 2qp1 n HIS 47 CO 0.00 0.00 0.00 0.08 -2.81 0.00 0.00 176.34 173.61 2qp1 s VAL 48 N -1.69 -0.27 -0.47 0.61 1.01 0.14 -5.05 120.40 114.68 2qp1 s VAL 48 Ca 0.22 0.29 -0.27 0.00 0.00 0.00 0.00 61.98 62.22 2qp1 s VAL 48 Cb 0.17 -0.34 -0.04 0.00 0.00 0.00 0.00 36.38 36.16 2qp1 s VAL 48 CO 0.06 0.12 2.12 -0.62 0.00 0.00 0.00 175.10 176.78 2qp1 s ASP 49 N 2.11 5.05 0.00 3.32 2.15 -1.26 -4.76 116.67 123.27 2qp1 s ASP 49 Ca -0.00 0.97 0.12 0.00 0.43 0.00 0.00 52.55 54.07 2qp1 s ASP 49 Cb -0.12 -2.51 0.32 0.00 -0.30 0.00 0.00 42.92 40.30 2qp1 s ASP 49 CO -0.07 -2.43 1.24 0.35 -0.17 0.00 0.00 175.17 174.09 2qp1 n THR 50 N 7.63 0.88 -0.41 1.71 -2.24 -1.26 -4.98 114.28 115.60 2qp1 n THR 50 Ca 0.28 -0.94 -0.29 0.00 -2.27 0.00 0.00 64.05 60.84 2qp1 n THR 50 Cb 0.52 0.59 0.26 0.00 -2.10 0.00 0.00 70.33 69.60 2qp1 n THR 50 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2qp1 n GLY 51 N 0.66 -2.70 3.62 3.38 0.00 -1.26 -4.09 105.19 104.79 2qp1 n GLY 51 Ca 0.12 -1.30 -0.34 0.00 0.00 0.00 0.00 46.02 44.50 2qp1 n GLY 51 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2qp1 s ASP 52 N -2.50 5.02 -0.97 1.61 -0.00 -0.16 -4.27 116.67 115.39 2qp1 s ASP 52 Ca 0.66 0.04 -0.25 0.00 -0.00 0.00 0.00 52.55 53.00 2qp1 s ASP 52 Cb -0.20 -1.49 -0.12 0.00 -0.00 0.00 0.00 42.92 41.11 2qp1 s ASP 52 CO 0.62 0.32 2.12 -0.31 -0.00 0.00 0.00 175.17 177.92 2qp1 s TYR 53 N -0.54 1.50 -0.16 4.23 2.02 0.20 -4.53 117.35 120.07 2qp1 s TYR 53 Ca 0.09 1.39 -0.07 0.00 -0.37 0.00 0.00 57.07 58.11 2qp1 s TYR 53 Cb -0.12 -3.69 -0.04 0.00 -0.40 0.00 0.00 41.96 37.71 2qp1 s TYR 53 CO 0.02 -1.33 0.07 -1.50 -1.57 0.00 0.00 175.55 171.24 2qp1 s ILE 54 N 13.28 4.86 -0.04 2.71 1.10 -1.14 -0.60 121.20 141.37 2qp1 s ILE 54 Ca 0.79 -0.02 0.07 0.00 -0.51 0.00 0.00 60.65 60.98 2qp1 s ILE 54 Cb -0.07 -3.16 -0.01 0.00 0.15 0.00 0.00 42.46 39.37 2qp1 s ILE 54 CO 0.09 0.50 -0.24 0.27 -2.11 0.00 0.00 174.94 173.45 2qp1 s ILE 55 N -0.02 1.93 0.00 2.00 -4.36 -0.57 -3.36 121.20 116.83 2qp1 s ILE 55 Ca 0.06 -1.02 0.00 0.00 -0.26 0.00 0.00 60.65 59.43 2qp1 s ILE 55 Cb -0.12 -1.62 0.00 0.00 1.25 0.00 0.00 42.46 41.97 2qp1 s ILE 55 CO 0.01 0.54 0.00 0.52 0.24 0.00 0.00 174.94 176.25 2qp1 n VAL 56 N 2.76 0.00 0.00 8.37 0.31 -1.25 -0.21 118.33 128.31 2qp1 n VAL 56 Ca -0.17 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.16 2qp1 n VAL 56 Cb 0.52 -1.98 0.00 0.00 -0.91 0.00 0.00 33.84 31.47 2qp1 n VAL 56 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 2qp1 n LEU 57 N 0.00 0.00 -0.11 7.52 7.94 -0.65 -4.59 117.00 127.10 2qp1 n LEU 57 Ca 0.00 0.00 -0.09 0.00 -1.11 0.00 0.00 56.01 54.81 2qp1 n LEU 57 Cb 0.00 0.00 -0.06 0.00 0.53 0.00 0.00 43.42 43.89 2qp1 n LEU 57 CO 0.00 0.00 0.50 0.78 -1.11 0.00 0.00 177.39 177.56 2qp1 h ASN 58 N 0.00 -1.24 0.00 1.96 -0.26 -1.79 -3.14 115.58 111.11 2qp1 h ASN 58 Ca 0.00 0.17 0.00 0.00 -0.56 0.00 0.00 56.30 55.91 2qp1 h ASN 58 Cb 0.00 0.51 0.00 0.00 -1.06 0.00 0.00 38.32 37.77 2qp1 h ASN 58 CO 0.00 -0.25 0.00 0.00 -1.06 0.00 0.00 177.43 176.12 2qp1 n ALA 59 N -2.98 0.00 0.00 -0.83 0.00 -0.39 -3.95 120.51 112.36 2qp1 n ALA 59 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 2qp1 n ALA 59 Cb 0.22 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.67 2qp1 n ALA 59 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2qp1 n ASP 60 N 0.67 0.00 -1.37 0.00 5.75 -1.26 0.91 116.55 121.25 2qp1 n ASP 60 Ca 0.00 0.34 0.01 0.00 -0.01 0.00 0.00 54.79 55.14 2qp1 n ASP 60 Cb 0.00 -0.34 0.27 0.00 -1.03 0.00 0.00 41.12 40.02 2qp1 n ASP 60 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2qp1 n LYS 61 N -1.33 3.09 -3.24 0.11 5.02 -1.25 -5.00 118.16 115.56 2qp1 n LYS 61 Ca 0.00 -3.01 -0.31 0.00 -2.02 0.00 0.00 58.31 52.97 2qp1 n LYS 61 Cb 0.10 -1.99 -0.04 0.00 -0.02 0.00 0.00 35.03 33.08 2qp1 n LYS 61 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2qp1 s VAL 62 N -2.97 4.90 0.75 -0.18 0.11 0.26 -4.01 120.40 119.27 2qp1 s VAL 62 Ca 0.48 0.42 -0.03 0.00 -2.93 0.00 0.00 61.98 59.91 2qp1 s VAL 62 Cb 0.39 -3.68 0.15 0.00 -1.53 0.00 0.00 36.38 31.72 2qp1 s VAL 62 CO 0.09 -0.26 1.03 0.00 -3.33 0.00 0.00 175.10 172.62 2qp1 n ALA 63 N -0.68 -0.15 -1.93 1.54 0.00 -0.05 -4.99 120.51 114.25 2qp1 n ALA 63 Ca 0.01 -1.84 0.00 0.00 0.00 0.00 0.00 53.44 51.61 2qp1 n ALA 63 Cb 0.53 0.23 0.00 0.00 0.00 0.00 0.00 19.45 20.21 2qp1 n ALA 63 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 2qp1 n VAL 64 N -3.00 0.00 -1.15 0.00 3.14 -1.26 -3.96 118.33 112.10 2qp1 n VAL 64 Ca 0.16 0.00 0.05 0.00 -2.96 0.00 0.00 64.34 61.59 2qp1 n VAL 64 Cb 0.56 0.10 -0.01 0.00 -1.06 0.00 0.00 33.84 33.44 2qp1 n VAL 64 CO 0.00 0.00 0.00 1.07 -6.46 0.00 0.00 176.83 171.44 2qp1 n THR 65 N 0.00 0.00 -0.73 1.55 5.66 -1.26 -4.58 114.28 114.91 2qp1 n THR 65 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 2qp1 n THR 65 Cb 0.40 -0.12 0.00 0.00 -1.55 0.00 0.00 70.33 69.06 2qp1 n THR 65 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2qp1 n GLY 66 N -1.18 1.13 0.80 1.09 0.00 -1.26 -3.19 105.19 102.57 2qp1 n GLY 66 Ca 0.00 -0.47 0.07 0.00 0.00 0.00 0.00 46.02 45.62 2qp1 n GLY 66 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2qp1 n ASN 67 N -2.90 3.13 0.24 1.61 3.02 -1.26 -4.57 115.26 114.53 2qp1 n ASN 67 Ca 0.00 -1.99 0.14 0.00 -0.03 0.00 0.00 54.58 52.71 2qp1 n ASN 67 Cb 0.00 -0.28 0.60 0.00 -0.61 0.00 0.00 39.78 39.49 2qp1 n ASN 67 CO 0.00 0.00 0.00 0.11 -2.62 0.00 0.00 177.26 174.75 2qp1 h LYS 68 N 2.56 0.00 -0.72 3.52 1.57 -1.76 0.27 116.57 122.00 2qp1 h LYS 68 Ca 0.00 0.00 0.09 0.00 -1.87 0.00 0.00 60.65 58.87 2qp1 h LYS 68 Cb 0.78 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 33.02 2qp1 h LYS 68 CO 0.00 0.00 0.37 -0.09 -0.57 0.00 0.00 179.45 179.16 2qp1 h ARG 69 N 0.00 0.60 0.00 3.15 9.65 -1.80 -2.92 114.38 123.06 2qp1 h ARG 69 Ca 0.08 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.92 2qp1 h ARG 69 Cb 1.22 -0.14 0.00 0.00 -1.39 0.00 0.00 29.97 29.66 2qp1 h ARG 69 CO -0.00 0.40 0.00 0.25 2.80 0.00 0.00 179.97 183.42 2qp1 n THR 70 N -4.85 0.24 -2.61 0.20 -2.24 0.29 -1.26 114.28 104.05 2qp1 n THR 70 Ca 0.11 -0.57 -0.14 0.00 -2.27 0.00 0.00 64.05 61.18 2qp1 n THR 70 Cb 0.27 0.95 0.02 0.00 -2.10 0.00 0.00 70.33 69.47 2qp1 n THR 70 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2qp1 n ASP 71 N -0.12 2.39 0.00 3.42 9.92 0.68 -4.93 116.55 127.91 2qp1 n ASP 71 Ca 0.00 -2.99 0.00 0.00 -0.53 0.00 0.00 54.79 51.27 2qp1 n ASP 71 Cb 0.09 -0.51 0.00 0.00 -0.64 0.00 0.00 41.12 40.06 2qp1 n ASP 71 CO 0.00 0.00 0.00 1.17 0.13 0.00 0.00 177.20 178.50 2qp1 n LYS 72 N -0.19 0.00 0.00 -1.24 0.00 -1.11 -4.46 118.16 111.16 2qp1 n LYS 72 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.49 2qp1 n LYS 72 Cb 0.78 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.81 2qp1 n LYS 72 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.40 178.73 2qp1 n VAL 73 N 0.00 0.00 -2.85 3.15 0.24 -1.26 -4.89 118.33 112.72 2qp1 n VAL 73 Ca 0.00 0.00 -0.03 0.00 -2.04 0.00 0.00 64.34 62.27 2qp1 n VAL 73 Cb 0.00 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.37 2qp1 n VAL 73 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 2qp1 n TYR 74 N -0.23 -3.26 -3.94 6.34 4.02 -1.25 -3.21 117.16 115.63 2qp1 n TYR 74 Ca 0.00 1.42 -0.21 0.00 -0.01 0.00 0.00 57.90 59.09 2qp1 n TYR 74 Cb 0.00 -3.48 -0.04 0.00 -0.02 0.00 0.00 39.34 35.80 2qp1 n TYR 74 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 176.86 176.56 2qp1 s TYR 75 N -1.71 3.07 -0.30 -0.72 2.02 -1.26 -1.98 117.35 116.47 2qp1 s TYR 75 Ca 0.06 -0.18 -0.22 0.00 -0.37 0.00 0.00 57.07 56.36 2qp1 s TYR 75 Cb -0.01 -1.61 0.19 0.00 -0.40 0.00 0.00 41.96 40.13 2qp1 s TYR 75 CO 0.67 0.35 1.36 -3.38 -1.57 0.00 0.00 175.55 172.98 2qp1 s HIS 76 N -2.18 -0.09 -0.08 2.71 -3.43 -0.95 -5.02 115.29 106.25 2qp1 s HIS 76 Ca 0.37 0.21 -0.00 0.00 -0.80 0.00 0.00 55.06 54.84 2qp1 s HIS 76 Cb -0.07 0.35 -0.03 0.00 -1.43 0.00 0.00 32.58 31.40 2qp1 s HIS 76 CO 0.26 -0.05 -0.04 -1.58 -2.00 0.00 0.00 174.74 171.34 2qp1 s HIS 77 N 0.35 3.02 -0.85 0.38 2.46 -1.26 -1.30 115.29 118.09 2qp1 s HIS 77 Ca 0.03 0.05 0.18 0.00 0.47 0.00 0.00 55.06 55.79 2qp1 s HIS 77 Cb -0.04 -1.76 0.76 0.00 -0.13 0.00 0.00 32.58 31.41 2qp1 s HIS 77 CO -0.14 0.35 1.57 0.25 -2.47 0.00 0.00 174.74 174.30 2qp1 n THR 78 N 2.31 0.89 -1.02 0.89 -2.24 -1.26 -4.85 114.28 109.00 2qp1 n THR 78 Ca -0.18 0.22 -0.01 0.00 -2.27 0.00 0.00 64.05 61.81 2qp1 n THR 78 Cb 0.53 -1.01 -0.00 0.00 -2.10 0.00 0.00 70.33 67.75 2qp1 n THR 78 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2qp1 n GLY 79 N 0.11 0.43 0.00 3.38 0.00 -1.26 -5.03 105.19 102.82 2qp1 n GLY 79 Ca 0.03 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 44.99 2qp1 n GLY 79 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2qp1 n HIS 80 N -2.98 -0.01 0.00 1.61 8.25 -1.26 -5.07 115.22 115.76 2qp1 n HIS 80 Ca -0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.45 2qp1 n HIS 80 Cb 0.02 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.13 2qp1 n HIS 80 CO 0.00 0.00 0.00 1.51 0.64 0.00 0.00 176.34 178.49 2qp1 n ILE 81 N -0.00 0.00 -0.01 1.59 3.06 -1.26 -4.51 119.36 118.22 2qp1 n ILE 81 Ca 0.00 0.94 -0.04 0.00 -2.50 0.00 0.00 62.75 61.15 2qp1 n ILE 81 Cb 0.00 -1.34 -0.01 0.00 0.54 0.00 0.00 39.64 38.82 2qp1 n ILE 81 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 2qp1 n GLY 82 N -0.94 -0.26 7.00 4.50 0.00 -1.26 -5.00 105.19 109.23 2qp1 n GLY 82 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.87 2qp1 n GLY 82 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2qp1 n GLY 83 N 2.57 1.05 3.93 -0.02 0.00 -1.26 -4.78 105.19 106.68 2qp1 n GLY 83 Ca -0.07 0.72 -0.30 0.00 0.00 0.00 0.00 46.02 46.37 2qp1 n GLY 83 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2qp1 n ILE 84 N 0.00 -1.52 -2.89 -0.61 0.13 -1.26 -4.87 119.36 108.34 2qp1 n ILE 84 Ca 0.00 -0.39 -0.32 0.00 -1.10 0.00 0.00 62.75 60.94 2qp1 n ILE 84 Cb 0.00 -1.32 -0.05 0.00 -0.84 0.00 0.00 39.64 37.44 2qp1 n ILE 84 CO 0.00 0.00 0.00 -0.54 2.80 0.00 0.00 176.55 178.81 2qp1 s LYS 85 N -6.57 3.92 0.05 9.51 1.02 -0.42 -4.88 119.74 122.38 2qp1 s LYS 85 Ca 0.26 0.66 0.01 0.00 0.02 0.00 0.00 55.97 56.92 2qp1 s LYS 85 Cb -0.14 -2.35 -0.03 0.00 -0.52 0.00 0.00 37.83 34.78 2qp1 s LYS 85 CO 0.68 -0.00 -0.05 1.14 -0.92 0.00 0.00 175.35 176.20 2qp1 s GLN 86 N -3.52 0.57 -0.11 1.68 -2.07 -1.26 -2.23 119.66 112.73 2qp1 s GLN 86 Ca 0.54 -0.96 -0.05 0.00 -1.82 0.00 0.00 55.36 53.07 2qp1 s GLN 86 Cb -0.10 -0.08 0.05 0.00 -1.09 0.00 0.00 33.01 31.79 2qp1 s GLN 86 CO 0.25 -0.02 0.24 0.00 -1.32 0.00 0.00 175.29 174.44 2qp1 s ALA 87 N -2.48 -0.53 0.65 2.60 0.00 -0.84 -5.04 121.76 116.13 2qp1 s ALA 87 Ca -0.02 0.96 -0.11 0.00 0.00 0.00 0.00 51.96 52.78 2qp1 s ALA 87 Cb -0.03 -0.69 -0.02 0.00 0.00 0.00 0.00 23.12 22.39 2qp1 s ALA 87 CO -0.03 -0.27 1.04 -0.08 0.00 0.00 0.00 175.76 176.42 2qp1 s THR 88 N 1.47 4.36 0.12 0.00 -1.32 -1.24 -3.87 115.64 115.16 2qp1 s THR 88 Ca -0.07 0.79 -0.24 0.00 -1.21 0.00 0.00 61.69 60.95 2qp1 s THR 88 Cb -0.11 -3.63 -0.05 0.00 -1.51 0.00 0.00 72.50 67.19 2qp1 s THR 88 CO -0.08 -0.98 1.42 0.33 -2.21 0.00 0.00 174.62 173.09 2qp1 n PHE 89 N -2.86 -0.34 -0.26 9.09 -0.00 -1.26 -1.17 117.46 120.65 2qp1 n PHE 89 Ca 0.07 0.97 -0.11 0.00 -0.00 0.00 0.00 57.45 58.38 2qp1 n PHE 89 Cb 0.54 -0.56 -0.07 0.00 -0.00 0.00 0.00 39.48 39.38 2qp1 n PHE 89 CO 0.00 0.00 0.00 1.49 -0.00 0.00 0.00 176.76 178.25 2qp1 h GLU 90 N 0.00 -0.19 -0.53 -4.13 4.81 -1.42 0.41 114.58 113.52 2qp1 h GLU 90 Ca 0.12 0.01 0.15 0.00 -0.13 0.00 0.00 59.36 59.52 2qp1 h GLU 90 Cb 0.32 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.72 2qp1 h GLU 90 CO -0.73 -0.13 0.42 0.93 -0.73 0.00 0.00 179.01 178.77 2qp1 h GLU 91 N -0.20 0.00 0.00 1.92 5.08 -1.44 0.16 114.58 120.10 2qp1 h GLU 91 Ca 0.15 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.43 2qp1 h GLU 91 Cb 0.53 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.77 2qp1 h GLU 91 CO -0.76 0.00 -0.36 0.52 -1.00 0.00 0.00 179.01 177.41 2qp1 h MET 92 N 0.00 0.00 0.15 2.33 2.86 0.12 -3.12 114.93 117.27 2qp1 h MET 92 Ca 0.25 0.00 -0.26 0.00 -2.06 0.00 0.00 59.70 57.63 2qp1 h MET 92 Cb 1.08 0.00 0.03 0.00 0.06 0.00 0.00 31.60 32.77 2qp1 h MET 92 CO -0.00 0.36 -1.12 0.82 1.06 0.00 0.00 176.91 178.02 2qp1 h ILE 93 N 0.00 1.36 0.00 -1.22 5.03 -0.31 -2.95 117.51 119.43 2qp1 h ILE 93 Ca -0.00 -2.50 0.00 0.00 -0.12 0.00 0.00 64.86 62.23 2qp1 h ILE 93 Cb 0.77 2.92 0.00 0.00 -3.03 0.00 0.00 36.82 37.48 2qp1 h ILE 93 CO 0.05 0.74 0.14 0.00 -0.68 0.00 0.00 178.15 178.40 2qp1 n ALA 94 N -2.68 0.82 -3.49 1.87 0.00 -1.04 -4.21 120.51 111.78 2qp1 n ALA 94 Ca -0.14 0.12 -0.02 0.00 0.00 0.00 0.00 53.44 53.40 2qp1 n ALA 94 Cb 0.94 -0.98 -0.05 0.00 0.00 0.00 0.00 19.45 19.36 2qp1 n ALA 94 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 2qp1 s ARG 95 N -3.27 0.51 -0.80 0.00 1.70 -1.21 -5.01 118.95 110.87 2qp1 s ARG 95 Ca -0.01 1.18 -0.01 0.00 -0.47 0.00 0.00 55.73 56.41 2qp1 s ARG 95 Cb 0.04 0.57 -0.00 0.00 -0.57 0.00 0.00 34.95 34.99 2qp1 s ARG 95 CO 0.12 -0.36 0.66 0.54 -1.08 0.00 0.00 175.30 175.17 2qp1 n ARG 96 N 5.43 -1.42 0.26 3.89 1.74 -1.25 -4.69 116.66 120.62 2qp1 n ARG 96 Ca -0.08 1.09 0.14 0.00 -0.77 0.00 0.00 57.85 58.23 2qp1 n ARG 96 Cb 0.50 -4.02 0.69 0.00 -1.02 0.00 0.00 32.46 28.60 2qp1 n ARG 96 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 2qp1 h PRO 97 N -0.03 0.00 -0.70 5.56 0.11 -1.69 -3.24 132.00 132.02 2qp1 h PRO 97 Ca -0.34 0.00 0.14 0.00 0.11 0.00 0.00 66.00 65.91 2qp1 h PRO 97 Cb 1.21 0.00 -0.13 0.00 0.11 0.00 0.00 31.00 32.19 2qp1 h PRO 97 CO 0.34 0.10 -0.14 0.93 -0.21 0.00 0.00 178.00 179.03 2qp1 h GLU 98 N 0.00 0.02 -0.88 1.05 3.07 -1.87 0.12 114.58 116.09 2qp1 h GLU 98 Ca -0.00 -0.00 0.21 0.00 -0.50 0.00 0.00 59.36 59.07 2qp1 h GLU 98 Cb 0.48 -0.00 -0.06 0.00 -0.84 0.00 0.00 28.75 28.33 2qp1 h GLU 98 CO 0.01 0.01 0.59 0.00 -1.40 0.00 0.00 179.01 178.23 2qp1 h ARG 99 N 0.02 0.29 -0.32 2.33 3.08 -1.93 0.25 114.38 118.11 2qp1 h ARG 99 Ca 0.35 -0.02 0.09 0.00 0.07 0.00 0.00 59.98 60.47 2qp1 h ARG 99 Cb 0.54 -0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.51 2qp1 h ARG 99 CO -0.70 0.19 0.44 0.28 -1.07 0.00 0.00 179.97 179.12 2qp1 h VAL 100 N 0.30 0.27 0.00 2.04 2.07 -0.97 0.30 116.25 120.26 2qp1 h VAL 100 Ca 0.45 0.00 -0.37 0.00 0.82 0.00 0.00 66.70 67.59 2qp1 h VAL 100 Cb 1.27 0.63 -0.06 0.00 -1.52 0.00 0.00 31.29 31.60 2qp1 h VAL 100 CO -0.13 0.00 -2.34 -0.38 0.02 0.00 0.00 177.57 174.73 2qp1 n ILE 101 N -3.49 1.34 -0.07 4.57 2.08 0.79 -3.65 119.36 120.94 2qp1 n ILE 101 Ca 0.05 -0.45 -0.07 0.00 0.56 0.00 0.00 62.75 62.85 2qp1 n ILE 101 Cb 0.59 -1.51 -0.01 0.00 -0.75 0.00 0.00 39.64 37.95 2qp1 n ILE 101 CO 0.00 0.00 0.00 -0.33 0.56 0.00 0.00 176.55 176.78 2qp1 h GLU 102 N -0.34 -0.08 -0.01 0.38 5.08 -0.16 0.32 114.58 119.78 2qp1 h GLU 102 Ca -0.56 0.01 -0.18 0.00 -1.00 0.00 0.00 59.36 57.62 2qp1 h GLU 102 Cb 1.71 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.96 2qp1 h GLU 102 CO -0.19 -0.05 -0.82 -0.84 -1.00 0.00 0.00 179.01 176.11 2qp1 h ILE 103 N -0.08 1.49 0.00 3.13 -0.00 -0.70 0.91 117.51 122.26 2qp1 h ILE 103 Ca 0.14 -2.52 -0.02 0.00 -0.00 0.00 0.00 64.86 62.46 2qp1 h ILE 103 Cb 0.30 2.39 -0.00 0.00 -0.00 0.00 0.00 36.82 39.50 2qp1 h ILE 103 CO -0.33 0.73 -0.10 0.00 -0.00 0.00 0.00 178.15 178.45 2qp1 h ALA 104 N 1.05 1.52 0.00 0.16 0.00 -1.39 -1.81 119.26 118.78 2qp1 h ALA 104 Ca -0.03 -0.09 -0.24 0.00 0.00 0.00 0.00 54.91 54.54 2qp1 h ALA 104 Cb 1.42 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 19.15 2qp1 h ALA 104 CO 0.12 0.13 -2.11 1.33 0.00 0.00 0.00 179.25 178.72 2qp1 n VAL 105 N -3.96 0.91 -0.27 0.00 0.24 0.10 -4.10 118.33 111.26 2qp1 n VAL 105 Ca -0.02 -0.66 0.00 0.00 -2.04 0.00 0.00 64.34 61.62 2qp1 n VAL 105 Cb 0.19 -0.40 0.21 0.00 -1.47 0.00 0.00 33.84 32.37 2qp1 n VAL 105 CO 0.00 0.00 0.00 0.50 -2.14 0.00 0.00 176.83 175.19 2qp1 h LYS 106 N 0.00 1.08 0.00 7.34 1.63 0.13 0.23 116.57 126.98 2qp1 h LYS 106 Ca -0.36 -0.07 -0.03 0.00 -0.85 0.00 0.00 60.65 59.34 2qp1 h LYS 106 Cb 1.78 -0.24 -0.00 0.00 -0.60 0.00 0.00 32.23 33.16 2qp1 h LYS 106 CO 0.02 0.72 -0.16 0.78 -3.45 0.00 0.00 179.45 177.35 2qp1 h GLY 107 N 1.11 0.00 1.64 5.01 0.00 -1.54 -2.71 103.07 106.60 2qp1 h GLY 107 Ca 0.31 0.00 -0.17 0.00 0.00 0.00 0.00 47.33 47.47 2qp1 h GLY 107 CO -0.07 0.00 -0.66 -0.33 0.00 0.00 0.00 176.54 175.48 2qp1 h MET 108 N 0.00 0.36 -6.96 4.80 2.86 -0.75 -3.44 114.93 111.79 2qp1 h MET 108 Ca -0.00 -0.27 -0.48 0.00 -2.06 0.00 0.00 59.70 56.90 2qp1 h MET 108 Cb 0.74 0.05 0.01 0.00 0.06 0.00 0.00 31.60 32.46 2qp1 h MET 108 CO 0.02 0.89 0.39 -0.51 1.06 0.00 0.00 176.91 178.76 2qp1 s LEU 109 N -7.99 4.14 0.61 1.22 1.43 -0.40 -5.03 118.68 112.66 2qp1 s LEU 109 Ca -0.05 1.97 -0.01 0.00 -1.03 0.00 0.00 54.13 55.00 2qp1 s LEU 109 Cb 0.11 -4.21 0.05 0.00 0.03 0.00 0.00 46.19 42.17 2qp1 s LEU 109 CO 0.82 -0.43 0.86 -2.16 0.23 0.00 0.00 176.35 175.68 2qp1 s PRO 110 N -2.53 2.38 1.03 1.29 0.04 -1.26 -4.96 135.00 130.99 2qp1 s PRO 110 Ca 0.57 -0.64 0.00 0.00 0.04 0.00 0.00 61.00 60.97 2qp1 s PRO 110 Cb -0.20 -2.38 0.00 0.00 0.04 0.00 0.00 34.50 31.96 2qp1 s PRO 110 CO 0.25 -0.92 0.00 1.63 0.04 0.00 0.00 177.00 178.00 2qp1 n LYS 111 N -2.55 0.00 0.06 4.56 5.02 -1.26 -3.52 118.16 120.47 2qp1 n LYS 111 Ca 0.08 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.37 2qp1 n LYS 111 Cb 0.60 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.61 2qp1 n LYS 111 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2qp1 n GLY 112 N 0.00 -0.08 0.15 0.72 0.00 -1.26 -4.56 105.19 100.15 2qp1 n GLY 112 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.97 2qp1 n GLY 112 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2qp1 h PRO 113 N 0.00 -0.31 -0.62 1.61 0.13 -1.98 0.54 132.00 131.37 2qp1 h PRO 113 Ca 0.00 0.02 -0.08 0.00 -0.87 0.00 0.00 66.00 65.07 2qp1 h PRO 113 Cb 0.13 0.07 -0.02 0.00 0.13 0.00 0.00 31.00 31.31 2qp1 h PRO 113 CO 0.00 -0.21 0.05 1.25 -0.23 0.00 0.00 178.00 178.86 2qp1 h LEU 114 N -0.32 1.01 0.61 1.56 5.85 -1.92 -2.13 115.31 119.97 2qp1 h LEU 114 Ca -0.03 -0.26 -0.02 0.00 0.84 0.00 0.00 57.88 58.41 2qp1 h LEU 114 Cb 0.27 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 41.02 2qp1 h LEU 114 CO 0.01 1.03 -0.37 1.23 -0.34 0.00 0.00 178.44 180.00 2qp1 h GLY 115 N 1.02 -1.00 1.98 3.75 0.00 -1.59 -0.47 103.07 106.76 2qp1 h GLY 115 Ca 0.18 0.41 0.00 0.00 0.00 0.00 0.00 47.33 47.93 2qp1 h GLY 115 CO 0.02 -0.36 0.01 -0.09 0.00 0.00 0.00 176.54 176.13 2qp1 h ARG 116 N -0.93 0.00 0.00 4.80 9.65 0.09 0.35 114.38 128.35 2qp1 h ARG 116 Ca -0.08 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.80 2qp1 h ARG 116 Cb 0.75 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.33 2qp1 h ARG 116 CO 0.08 0.00 -0.07 0.00 2.80 0.00 0.00 179.97 182.78 2qp1 h ALA 117 N 1.98 0.96 0.00 2.80 0.00 -0.57 -3.27 119.26 121.17 2qp1 h ALA 117 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 54.91 54.59 2qp1 h ALA 117 Cb 0.02 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.76 2qp1 h ALA 117 CO -0.00 0.00 -2.12 -1.33 0.00 0.00 0.00 179.25 175.80 2qp1 n MET 118 N -2.94 0.67 0.32 0.00 2.81 0.11 -4.15 117.12 113.94 2qp1 n MET 118 Ca 0.04 0.09 0.22 0.00 -1.81 0.00 0.00 57.70 56.24 2qp1 n MET 118 Cb 0.52 -1.62 1.13 0.00 -0.71 0.00 0.00 33.22 32.53 2qp1 n MET 118 CO 0.00 0.00 0.00 0.35 1.51 0.00 0.00 175.97 177.83 2qp1 h PHE 119 N 0.00 0.00 -0.12 2.03 3.04 -1.09 -0.35 116.94 120.45 2qp1 h PHE 119 Ca -0.43 0.00 0.00 0.00 3.98 0.00 0.00 57.97 61.52 2qp1 h PHE 119 Cb 2.10 0.00 0.00 0.00 2.56 0.00 0.00 35.95 40.61 2qp1 h PHE 119 CO 0.00 0.00 0.00 2.89 -2.02 0.00 0.00 178.31 179.18 2qp1 n ARG 120 N -3.05 1.49 0.00 1.11 1.85 -1.25 -3.32 116.66 113.49 2qp1 n ARG 120 Ca -0.02 -0.73 0.12 0.00 -1.00 0.00 0.00 57.85 56.22 2qp1 n ARG 120 Cb 0.10 -1.34 0.28 0.00 -1.05 0.00 0.00 32.46 30.45 2qp1 n ARG 120 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 2qp1 n LYS 121 N -0.03 1.01 -4.64 2.89 5.02 -0.14 -4.90 118.16 117.38 2qp1 n LYS 121 Ca 0.14 -0.69 -0.29 0.00 -2.02 0.00 0.00 58.31 55.46 2qp1 n LYS 121 Cb 0.23 -1.49 -0.14 0.00 -0.02 0.00 0.00 35.03 33.62 2qp1 n LYS 121 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 2qp1 s LEU 122 N -2.46 2.23 0.00 -0.35 0.20 -1.21 -2.87 118.68 114.23 2qp1 s LEU 122 Ca 0.24 -0.65 0.00 0.00 0.69 0.00 0.00 54.13 54.41 2qp1 s LEU 122 Cb 0.19 -1.19 0.00 0.00 -0.43 0.00 0.00 46.19 44.76 2qp1 s LEU 122 CO 0.52 0.20 0.00 0.29 -0.29 0.00 0.00 176.35 177.07 2qp1 n LYS 123 N 1.42 3.79 0.00 1.98 4.01 -1.21 -5.00 118.16 123.14 2qp1 n LYS 123 Ca -0.18 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.62 2qp1 n LYS 123 Cb 0.53 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 35.05 2qp1 n LYS 123 CO 0.00 0.00 0.00 1.33 -1.11 0.00 0.00 177.40 177.62 2qp1 n VAL 124 N 0.00 0.00 -0.80 -0.18 0.24 -1.26 -3.85 118.33 112.48 2qp1 n VAL 124 Ca 0.00 0.00 0.10 0.00 -2.04 0.00 0.00 64.34 62.40 2qp1 n VAL 124 Cb 0.00 0.00 -0.04 0.00 -1.47 0.00 0.00 33.84 32.33 2qp1 n VAL 124 CO 0.00 0.00 0.00 -1.22 -2.14 0.00 0.00 176.83 173.47 2qp1 n TYR 125 N -1.46 -2.08 -0.03 6.34 4.01 -1.26 -3.25 117.16 119.43 2qp1 n TYR 125 Ca 0.00 1.11 -0.13 0.00 -0.16 0.00 0.00 57.90 58.71 2qp1 n TYR 125 Cb 0.00 -1.89 -0.09 0.00 -0.31 0.00 0.00 39.34 37.04 2qp1 n TYR 125 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2qp1 h ALA 126 N -0.77 0.06 0.00 -0.72 0.00 -1.82 -3.43 119.26 112.58 2qp1 h ALA 126 Ca -0.06 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.57 2qp1 h ALA 126 Cb 0.75 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.53 2qp1 h ALA 126 CO 0.03 -0.13 0.00 0.41 0.00 0.00 0.00 179.25 179.56 2qp1 n GLY 127 N 0.29 3.10 2.77 0.00 0.00 -1.19 -4.12 105.19 106.04 2qp1 n GLY 127 Ca -0.08 -0.10 -0.14 0.00 0.00 0.00 0.00 46.02 45.70 2qp1 n GLY 127 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2qp1 n ASN 128 N 0.00 -3.25 0.00 1.61 3.02 -1.26 -4.80 115.26 110.58 2qp1 n ASN 128 Ca 0.00 -0.40 0.00 0.00 -0.03 0.00 0.00 54.58 54.15 2qp1 n ASN 128 Cb 0.00 -3.62 0.00 0.00 -0.61 0.00 0.00 39.78 35.55 2qp1 n ASN 128 CO 0.00 0.00 0.00 -1.84 -2.62 0.00 0.00 177.26 172.80 2qp1 n GLU 129 N -3.31 0.00 -4.25 3.52 -0.00 -1.26 -5.13 120.64 110.21 2qp1 n GLU 129 Ca -0.11 0.00 -0.35 0.00 -0.00 0.00 0.00 57.16 56.70 2qp1 n GLU 129 Cb 0.58 0.00 -0.09 0.00 -0.00 0.00 0.00 31.44 31.93 2qp1 n GLU 129 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.13 173.75 2qp1 s HIS 130 N 0.00 3.21 -0.38 -1.84 -3.43 -1.26 -4.83 115.29 106.77 2qp1 s HIS 130 Ca 0.00 0.16 0.02 0.00 -0.80 0.00 0.00 55.06 54.44 2qp1 s HIS 130 Cb 0.00 -1.88 0.23 0.00 -1.43 0.00 0.00 32.58 29.51 2qp1 s HIS 130 CO 0.00 0.39 1.15 0.09 -2.00 0.00 0.00 174.74 174.37 2qp1 n ASN 131 N 2.52 2.98 -0.89 7.38 3.02 -1.26 -3.84 115.26 125.16 2qp1 n ASN 131 Ca -0.18 -2.44 0.07 0.00 -0.03 0.00 0.00 54.58 52.00 2qp1 n ASN 131 Cb 0.53 -0.59 0.23 0.00 -0.61 0.00 0.00 39.78 39.34 2qp1 n ASN 131 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 2qp1 n HIS 132 N 0.06 0.81 -0.33 3.10 8.25 -1.26 -4.70 115.22 121.14 2qp1 n HIS 132 Ca 0.15 -0.65 0.29 0.00 -0.26 0.00 0.00 57.72 57.25 2qp1 n HIS 132 Cb 0.76 -0.16 0.55 0.00 1.12 0.00 0.00 29.99 32.25 2qp1 n HIS 132 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2qp1 h ALA 133 N 2.30 2.11 -0.26 -1.41 0.00 -2.02 0.34 119.26 120.32 2qp1 h ALA 133 Ca 0.00 0.23 0.08 0.00 0.00 0.00 0.00 54.91 55.22 2qp1 h ALA 133 Cb 1.11 0.26 -0.01 0.00 0.00 0.00 0.00 17.79 19.14 2qp1 h ALA 133 CO 0.12 -0.82 0.66 0.00 0.00 0.00 0.00 179.25 179.20 2qp1 h ALA 134 N 1.93 1.93 0.00 0.00 0.00 -1.94 1.32 119.26 122.50 2qp1 h ALA 134 Ca 0.80 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.71 2qp1 h ALA 134 Cb 2.04 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.85 2qp1 h ALA 134 CO -0.69 -0.79 -0.76 1.04 0.00 0.00 0.00 179.25 178.05 2qp1 n GLN 135 N -3.05 0.05 -3.92 0.00 3.00 0.12 -5.00 117.38 108.58 2qp1 n GLN 135 Ca 0.05 -0.00 -0.35 0.00 -0.01 0.00 0.00 57.00 56.69 2qp1 n GLN 135 Cb 0.76 -1.52 0.01 0.00 0.00 0.00 0.00 30.24 29.50 2qp1 n GLN 135 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.06 178.10 2qp1 n GLN 136 N -1.58 -0.55 -2.30 -1.09 3.00 0.45 -4.86 117.38 110.44 2qp1 n GLN 136 Ca 0.04 0.08 -0.42 0.00 -0.01 0.00 0.00 57.00 56.70 2qp1 n GLN 136 Cb 0.35 -1.77 -0.03 0.00 0.00 0.00 0.00 30.24 28.79 2qp1 n GLN 136 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.06 174.92 2qp1 s PRO 137 N -6.46 4.42 0.38 -1.09 0.02 -1.26 -4.99 135.00 126.01 2qp1 s PRO 137 Ca 0.31 1.94 -0.26 0.00 0.02 0.00 0.00 61.00 63.01 2qp1 s PRO 137 Cb -0.18 -3.26 -0.09 0.00 0.02 0.00 0.00 34.50 31.00 2qp1 s PRO 137 CO 0.78 -0.24 1.18 1.14 -0.33 0.00 0.00 177.00 179.52 2qp1 s GLN 138 N 0.38 4.16 0.17 5.54 -2.07 -1.24 -4.36 119.66 122.25 2qp1 s GLN 138 Ca 0.58 1.89 -0.32 0.00 -1.82 0.00 0.00 55.36 55.69 2qp1 s GLN 138 Cb -0.34 -2.79 -0.11 0.00 -1.09 0.00 0.00 33.01 28.68 2qp1 s GLN 138 CO 0.34 -0.24 1.78 0.14 -1.32 0.00 0.00 175.29 175.99 2qp1 s VAL 139 N -1.35 2.24 -0.33 3.63 -7.23 -1.26 -2.63 120.40 113.47 2qp1 s VAL 139 Ca 0.55 0.01 0.03 0.00 -1.81 0.00 0.00 61.98 60.76 2qp1 s VAL 139 Cb -0.32 -3.01 0.09 0.00 0.56 0.00 0.00 36.38 33.71 2qp1 s VAL 139 CO 0.41 0.00 0.03 -0.22 -0.31 0.00 0.00 175.10 175.01 2qp1 s LEU 140 N 1.94 4.34 -0.35 1.32 0.20 -1.13 -4.86 118.68 120.14 2qp1 s LEU 140 Ca 0.78 -2.00 -0.28 0.00 0.69 0.00 0.00 54.13 53.32 2qp1 s LEU 140 Cb -0.48 -1.54 -0.04 0.00 -0.43 0.00 0.00 46.19 43.70 2qp1 s LEU 140 CO 0.34 -0.36 2.05 -0.62 -0.29 0.00 0.00 176.35 177.47 2qp1 s ASP 141 N 1.00 5.43 0.00 3.68 -1.08 -1.26 -4.22 116.67 120.22 2qp1 s ASP 141 Ca 0.08 1.35 0.00 0.00 -0.52 0.00 0.00 52.55 53.46 2qp1 s ASP 141 Cb -0.19 -2.52 0.00 0.00 -1.46 0.00 0.00 42.92 38.75 2qp1 s ASP 141 CO -0.09 -2.07 0.00 -0.38 0.52 0.00 0.00 175.17 173.15