#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2qam n ARG 2 N 0.00 0.05 -5.06 0.00 3.00 -1.26 -4.98 116.66 108.41 2qam n ARG 2 Ca 0.00 0.05 -0.32 0.00 -0.00 0.00 0.00 57.85 57.59 2qam n ARG 2 Cb 0.00 -1.70 -0.17 0.00 0.00 0.00 0.00 32.46 30.59 2qam n ARG 2 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 2qam s VAL 3 N -2.09 2.01 0.00 5.15 1.01 -1.26 -5.06 120.40 120.17 2qam s VAL 3 Ca 0.59 -0.98 0.00 0.00 0.00 0.00 0.00 61.98 61.59 2qam s VAL 3 Cb -0.29 -1.75 0.00 0.00 0.00 0.00 0.00 36.38 34.34 2qam s VAL 3 CO 0.65 0.55 0.27 0.29 0.00 0.00 0.00 175.10 176.85 2qam n LYS 4 N 3.67 0.00 -3.51 2.72 5.02 -1.26 -4.84 118.16 119.95 2qam n LYS 4 Ca -0.19 0.27 -0.20 0.00 -2.02 0.00 0.00 58.31 56.17 2qam n LYS 4 Cb 0.53 -0.44 0.06 0.00 -0.02 0.00 0.00 35.03 35.15 2qam n LYS 4 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 2qam n ARG 5 N -1.60 -4.46 0.00 1.97 0.63 -1.26 -4.94 116.66 107.00 2qam n ARG 5 Ca 0.00 0.73 0.00 0.00 -0.92 0.00 0.00 57.85 57.66 2qam n ARG 5 Cb 0.00 -5.43 0.00 0.00 0.45 0.00 0.00 32.46 27.48 2qam n ARG 5 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2qam n GLY 6 N -1.37 0.48 0.37 5.14 0.00 -1.26 -4.82 105.19 103.73 2qam n GLY 6 Ca -0.22 0.00 0.06 0.00 0.00 0.00 0.00 46.02 45.86 2qam n GLY 6 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2qam h VAL 7 N 0.00 0.99 0.00 1.61 -1.51 -1.97 0.13 116.25 115.50 2qam h VAL 7 Ca 0.00 -0.33 0.00 0.00 -1.23 0.00 0.00 66.70 65.14 2qam h VAL 7 Cb 0.00 -0.05 0.00 0.00 -2.13 0.00 0.00 31.29 29.11 2qam h VAL 7 CO 0.00 0.17 0.00 -0.29 -1.23 0.00 0.00 177.57 176.22 2qam h ILE 8 N 0.95 0.00 0.00 7.19 6.09 -1.99 -2.75 117.51 127.01 2qam h ILE 8 Ca 0.42 -0.13 0.00 0.00 -1.37 0.00 0.00 64.86 63.78 2qam h ILE 8 Cb 0.37 1.03 0.00 0.00 0.47 0.00 0.00 36.82 38.69 2qam h ILE 8 CO -0.18 0.00 0.00 0.00 -3.07 0.00 0.00 178.15 174.90 2qam n ALA 9 N -2.01 0.00 0.30 0.18 0.00 0.43 -3.95 120.51 115.46 2qam n ALA 9 Ca -0.02 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.39 2qam n ALA 9 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.58 2qam n ALA 9 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 2qam n ARG 10 N -1.90 0.30 -0.09 0.00 1.85 -1.10 -2.27 116.66 113.45 2qam n ARG 10 Ca 0.00 0.00 -0.09 0.00 -1.00 0.00 0.00 57.85 56.76 2qam n ARG 10 Cb 0.00 -1.18 -0.03 0.00 -1.05 0.00 0.00 32.46 30.20 2qam n ARG 10 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2qam n ALA 11 N 0.42 0.81 0.28 2.89 0.00 -1.04 -3.20 120.51 120.68 2qam n ALA 11 Ca 0.00 -0.76 0.17 0.00 0.00 0.00 0.00 53.44 52.86 2qam n ALA 11 Cb 0.09 0.03 0.78 0.00 0.00 0.00 0.00 19.45 20.34 2qam n ALA 11 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 177.50 177.57 2qam h ARG 12 N -1.00 0.00 0.35 0.00 0.11 -1.59 -1.04 114.38 111.21 2qam h ARG 12 Ca -0.03 0.00 -0.02 0.00 0.10 0.00 0.00 59.98 60.03 2qam h ARG 12 Cb 0.94 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.02 2qam h ARG 12 CO -0.02 0.03 -0.17 1.25 0.10 0.00 0.00 179.97 181.16 2qam h HIS 13 N 0.00 -0.44 -0.01 4.08 2.76 -1.63 -2.91 115.15 117.00 2qam h HIS 13 Ca -0.00 -0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.14 2qam h HIS 13 Cb 0.41 0.15 -0.00 0.00 1.55 0.00 0.00 27.41 29.52 2qam h HIS 13 CO 0.00 -0.11 -0.06 -0.22 -1.30 0.00 0.00 177.93 176.24 2qam h LYS 14 N -0.85 0.02 0.11 5.26 3.64 -1.40 -0.13 116.57 123.22 2qam h LYS 14 Ca -0.05 -0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.33 2qam h LYS 14 Cb 0.53 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.34 2qam h LYS 14 CO 0.08 0.08 -0.16 -0.22 -2.27 0.00 0.00 179.45 176.96 2qam h LYS 15 N 0.02 -0.27 -0.19 1.90 3.11 -1.06 -2.53 116.57 117.54 2qam h LYS 15 Ca 0.00 0.02 0.05 0.00 -2.81 0.00 0.00 60.65 57.92 2qam h LYS 15 Cb 0.12 0.06 -0.06 0.00 -1.00 0.00 0.00 32.23 31.36 2qam h LYS 15 CO 0.01 -0.18 -0.18 0.82 -2.81 0.00 0.00 179.45 177.10 2qam h ILE 16 N -0.28 0.51 0.00 2.00 5.03 -1.31 -3.12 117.51 120.33 2qam h ILE 16 Ca -0.01 0.00 -0.61 0.00 -0.12 0.00 0.00 64.86 64.12 2qam h ILE 16 Cb 0.26 0.51 0.08 0.00 -3.03 0.00 0.00 36.82 34.64 2qam h ILE 16 CO -0.05 0.00 1.97 -0.11 -0.68 0.00 0.00 178.15 179.28 2qam n LEU 17 N -5.33 2.97 0.00 1.44 7.94 -0.08 -1.57 117.00 122.38 2qam n LEU 17 Ca -0.02 -2.38 0.00 0.00 -1.11 0.00 0.00 56.01 52.51 2qam n LEU 17 Cb 0.25 -0.89 0.00 0.00 0.53 0.00 0.00 43.42 43.31 2qam n LEU 17 CO 0.19 -0.91 0.00 1.17 -1.11 0.00 0.00 177.39 176.72 2qam n LYS 18 N 7.22 0.00 0.00 1.96 4.81 -1.18 -4.72 118.16 126.25 2qam n LYS 18 Ca 0.48 0.00 0.04 0.00 -0.87 0.00 0.00 58.31 57.96 2qam n LYS 18 Cb 0.39 0.00 0.26 0.00 0.02 0.00 0.00 35.03 35.70 2qam n LYS 18 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 2qam n GLN 19 N -1.63 0.26 -0.00 1.64 6.02 -0.61 -0.14 117.38 122.92 2qam n GLN 19 Ca 0.00 0.02 0.09 0.00 -0.01 0.00 0.00 57.00 57.10 2qam n GLN 19 Cb 0.00 -1.50 -0.12 0.00 1.02 0.00 0.00 30.24 29.64 2qam n GLN 19 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2qam n ALA 20 N -1.03 3.61 -1.68 -1.58 0.00 -1.24 -4.85 120.51 113.73 2qam n ALA 20 Ca 0.06 -0.47 -0.60 0.00 0.00 0.00 0.00 53.44 52.44 2qam n ALA 20 Cb 0.03 -0.63 -0.08 0.00 0.00 0.00 0.00 19.45 18.78 2qam n ALA 20 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2qam n LYS 21 N -1.71 0.74 0.00 0.00 4.76 0.81 -1.18 118.16 121.58 2qam n LYS 21 Ca 0.01 0.27 0.00 0.00 -2.87 0.00 0.00 58.31 55.71 2qam n LYS 21 Cb 0.35 -1.88 0.00 0.00 -1.84 0.00 0.00 35.03 31.66 2qam n LYS 21 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2qam n GLY 22 N 3.60 2.42 3.79 0.72 0.00 -1.26 -5.09 105.19 109.37 2qam n GLY 22 Ca 0.26 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.92 2qam n GLY 22 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2qam s TYR 23 N -2.18 3.39 0.75 1.61 4.12 -0.32 -5.04 117.35 119.69 2qam s TYR 23 Ca 0.00 1.68 -0.11 0.00 0.02 0.00 0.00 57.07 58.66 2qam s TYR 23 Cb 0.00 -3.03 0.04 0.00 -1.52 0.00 0.00 41.96 37.45 2qam s TYR 23 CO 0.00 -0.32 1.08 -0.47 0.02 0.00 0.00 175.55 175.86 2qam s TYR 24 N -1.72 2.95 0.00 2.71 5.04 -1.26 -3.79 117.35 121.28 2qam s TYR 24 Ca 0.56 1.26 0.00 0.00 -2.44 0.00 0.00 57.07 56.46 2qam s TYR 24 Cb -0.19 -3.02 0.00 0.00 0.35 0.00 0.00 41.96 39.10 2qam s TYR 24 CO 0.25 -1.54 0.00 0.41 -1.34 0.00 0.00 175.55 173.32 2qam n GLY 25 N -2.06 -0.23 0.36 8.97 0.00 -1.26 -2.46 105.19 108.51 2qam n GLY 25 Ca 0.07 -0.73 0.12 0.00 0.00 0.00 0.00 46.02 45.48 2qam n GLY 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2qam h ALA 26 N -0.70 1.80 -0.97 4.61 0.00 -1.90 -1.99 119.26 120.10 2qam h ALA 26 Ca 0.00 -0.01 0.28 0.00 0.00 0.00 0.00 54.91 55.19 2qam h ALA 26 Cb 0.00 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 17.76 2qam h ALA 26 CO 0.00 -0.72 1.02 0.00 0.00 0.00 0.00 179.25 179.55 2qam h ARG 27 N 0.00 0.00 0.00 0.00 3.08 -1.76 1.31 114.38 117.01 2qam h ARG 27 Ca 0.07 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.12 2qam h ARG 27 Cb 1.36 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.40 2qam h ARG 27 CO -0.00 0.00 -0.18 0.43 -1.07 0.00 0.00 179.97 179.15 2qam n SER 28 N -3.47 1.94 -2.71 7.04 7.64 -0.75 -4.14 113.62 119.17 2qam n SER 28 Ca 0.21 -3.10 -0.03 0.00 1.01 0.00 0.00 58.87 56.96 2qam n SER 28 Cb 1.33 -0.42 0.02 0.00 -1.01 0.00 0.00 64.21 64.13 2qam n SER 28 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2qam s ARG 29 N -2.56 0.58 0.00 1.43 1.70 0.45 -4.83 118.95 115.71 2qam s ARG 29 Ca 0.30 -0.57 0.00 0.00 -0.47 0.00 0.00 55.73 54.99 2qam s ARG 29 Cb 0.27 -0.03 0.00 0.00 -0.57 0.00 0.00 34.95 34.63 2qam s ARG 29 CO 0.00 -0.72 0.00 1.55 -1.08 0.00 0.00 175.30 175.06 2qam n VAL 30 N 2.75 0.00 0.00 4.99 3.14 -1.20 -4.56 118.33 123.45 2qam n VAL 30 Ca 0.14 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.52 2qam n VAL 30 Cb 0.61 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.39 2qam n VAL 30 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2qam n TYR 31 N 0.00 0.00 -0.60 1.45 9.36 -1.26 -4.93 117.16 121.17 2qam n TYR 31 Ca 0.00 0.00 0.48 0.00 3.32 0.00 0.00 57.90 61.70 2qam n TYR 31 Cb 0.00 0.00 0.74 0.00 -0.63 0.00 0.00 39.34 39.45 2qam n TYR 31 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 2qam n ARG 32 N 0.00 0.00 -0.12 2.98 1.74 -1.26 0.13 116.66 120.13 2qam n ARG 32 Ca 0.00 1.07 -0.15 0.00 -0.77 0.00 0.00 57.85 58.00 2qam n ARG 32 Cb 0.00 -2.51 -0.13 0.00 -1.02 0.00 0.00 32.46 28.80 2qam n ARG 32 CO 0.00 0.00 0.00 1.33 -1.52 0.00 0.00 177.63 177.44 2qam n VAL 33 N -3.77 1.41 0.25 1.55 0.24 -1.26 -3.49 118.33 113.26 2qam n VAL 33 Ca 0.40 -0.62 0.08 0.00 -2.04 0.00 0.00 64.34 62.15 2qam n VAL 33 Cb 1.92 -1.15 0.61 0.00 -1.47 0.00 0.00 33.84 33.76 2qam n VAL 33 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2qam h ALA 34 N 0.25 1.83 0.25 2.33 0.00 0.06 0.40 119.26 124.38 2qam h ALA 34 Ca -0.55 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.28 2qam h ALA 34 Cb 1.96 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.74 2qam h ALA 34 CO -0.06 0.09 -0.12 0.35 0.00 0.00 0.00 179.25 179.51 2qam h PHE 35 N 0.00 -0.31 0.00 0.00 3.04 0.87 -1.03 116.94 119.51 2qam h PHE 35 Ca -0.00 -0.01 0.00 0.00 3.98 0.00 0.00 57.97 61.94 2qam h PHE 35 Cb 0.13 0.10 0.00 0.00 2.56 0.00 0.00 35.95 38.74 2qam h PHE 35 CO 0.00 0.02 0.04 1.04 -2.02 0.00 0.00 178.31 177.39 2qam n GLN 36 N -5.00 0.00 -0.01 1.11 6.02 -0.79 -1.57 117.38 117.14 2qam n GLN 36 Ca -0.07 0.39 -0.01 0.00 -0.01 0.00 0.00 57.00 57.30 2qam n GLN 36 Cb 0.24 -1.54 -0.00 0.00 1.02 0.00 0.00 30.24 29.96 2qam n GLN 36 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2qam h ALA 37 N 1.83 0.00 -0.71 -1.58 0.00 0.15 -3.29 119.26 115.67 2qam h ALA 37 Ca 0.00 -0.20 0.14 0.00 0.00 0.00 0.00 54.91 54.85 2qam h ALA 37 Cb 0.07 0.06 -0.13 0.00 0.00 0.00 0.00 17.79 17.79 2qam h ALA 37 CO 0.00 0.06 -0.22 0.28 0.00 0.00 0.00 179.25 179.37 2qam h VAL 38 N -0.18 0.24 -0.63 0.00 2.07 -0.74 -0.21 116.25 116.80 2qam h VAL 38 Ca 0.00 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.58 2qam h VAL 38 Cb 0.06 0.24 -0.08 0.00 -1.52 0.00 0.00 31.29 29.99 2qam h VAL 38 CO 0.00 0.00 -0.44 0.40 0.02 0.00 0.00 177.57 177.55 2qam h ILE 39 N -0.03 0.00 -0.27 4.57 1.08 -1.49 0.12 117.51 121.49 2qam h ILE 39 Ca 0.33 0.00 0.07 0.00 -0.39 0.00 0.00 64.86 64.86 2qam h ILE 39 Cb 0.54 0.00 -0.07 0.00 -3.07 0.00 0.00 36.82 34.22 2qam h ILE 39 CO -0.74 0.00 -0.25 0.11 -0.69 0.00 0.00 178.15 176.58 2qam h LYS 40 N -0.08 -0.24 -0.84 2.37 1.79 -1.15 -0.61 116.57 117.81 2qam h LYS 40 Ca 0.10 0.02 0.21 0.00 -2.18 0.00 0.00 60.65 58.80 2qam h LYS 40 Cb 0.35 0.05 -0.13 0.00 -1.58 0.00 0.00 32.23 30.92 2qam h LYS 40 CO -0.64 -0.16 0.24 0.00 -1.08 0.00 0.00 179.45 177.81 2qam h ALA 41 N 0.81 1.19 -0.39 3.86 0.00 0.10 0.50 119.26 125.33 2qam h ALA 41 Ca 0.14 0.20 0.03 0.00 0.00 0.00 0.00 54.91 55.29 2qam h ALA 41 Cb 0.47 0.27 -0.04 0.00 0.00 0.00 0.00 17.79 18.49 2qam h ALA 41 CO -0.41 -0.40 0.18 0.78 0.00 0.00 0.00 179.25 179.40 2qam h GLY 42 N 0.26 0.53 0.71 0.00 0.00 0.73 0.57 103.07 105.87 2qam h GLY 42 Ca 0.51 -0.12 -0.02 0.00 0.00 0.00 0.00 47.33 47.69 2qam h GLY 42 CO -0.59 0.08 -0.21 1.46 0.00 0.00 0.00 176.54 177.28 2qam h GLN 43 N 0.38 -0.58 -0.05 4.80 4.20 -0.08 0.34 115.11 124.12 2qam h GLN 43 Ca 0.17 0.04 0.02 0.00 0.06 0.00 0.00 58.65 58.94 2qam h GLN 43 Cb 0.10 0.13 -0.00 0.00 0.30 0.00 0.00 27.48 28.00 2qam h GLN 43 CO -0.13 -0.27 0.38 1.88 -0.67 0.00 0.00 178.83 180.01 2qam h TYR 44 N -0.90 0.00 0.00 2.96 0.99 -0.05 0.74 116.97 120.71 2qam h TYR 44 Ca -0.06 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.67 2qam h TYR 44 Cb 0.57 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.30 2qam h TYR 44 CO 0.01 0.00 -0.13 0.00 -0.00 0.00 0.00 178.16 178.05 2qam h ALA 45 N 1.29 0.00 -1.20 3.88 0.00 -0.49 -2.60 119.26 120.14 2qam h ALA 45 Ca 0.02 -0.19 0.35 0.00 0.00 0.00 0.00 54.91 55.10 2qam h ALA 45 Cb 0.78 0.13 -0.10 0.00 0.00 0.00 0.00 17.79 18.59 2qam h ALA 45 CO -0.00 0.13 0.79 -0.92 0.00 0.00 0.00 179.25 179.24 2qam h TYR 46 N -0.51 0.50 0.40 0.00 3.20 -0.42 0.78 116.97 120.93 2qam h TYR 46 Ca 0.00 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 61.87 2qam h TYR 46 Cb 0.13 -0.14 0.00 0.00 1.54 0.00 0.00 36.73 38.26 2qam h TYR 46 CO -0.05 -0.06 -0.19 -0.09 -1.64 0.00 0.00 178.16 176.13 2qam h ARG 47 N 0.21 -0.52 0.00 1.82 2.43 -1.01 -3.20 114.38 114.11 2qam h ARG 47 Ca 0.69 0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.90 2qam h ARG 47 Cb 2.10 0.12 0.00 0.00 -0.42 0.00 0.00 29.97 31.76 2qam h ARG 47 CO -0.30 -0.30 0.00 -0.25 -1.51 0.00 0.00 179.97 177.61 2qam n ASP 48 N -5.13 0.48 0.07 -3.80 10.43 -0.35 -1.31 116.55 116.95 2qam n ASP 48 Ca -0.07 0.67 0.07 0.00 2.57 0.00 0.00 54.79 58.03 2qam n ASP 48 Cb 0.23 -0.76 0.33 0.00 1.84 0.00 0.00 41.12 42.77 2qam n ASP 48 CO 0.00 0.00 0.00 -1.14 -1.07 0.00 0.00 177.20 174.99 2qam n ARG 49 N -2.09 0.08 -0.07 -1.24 3.00 0.26 -2.20 116.66 114.39 2qam n ARG 49 Ca 0.00 0.47 -0.11 0.00 -0.00 0.00 0.00 57.85 58.21 2qam n ARG 49 Cb 0.11 -1.71 -0.06 0.00 0.00 0.00 0.00 32.46 30.80 2qam n ARG 49 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 2qam n ARG 50 N -1.87 0.35 -0.09 -0.14 3.00 -0.43 -4.56 116.66 112.94 2qam n ARG 50 Ca 0.01 0.09 0.18 0.00 -0.01 0.00 0.00 57.85 58.12 2qam n ARG 50 Cb 0.10 -1.25 0.59 0.00 0.00 0.00 0.00 32.46 31.90 2qam n ARG 50 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.63 179.59 2qam h GLN 51 N -0.09 0.22 0.25 5.56 4.20 -1.46 -1.45 115.11 122.33 2qam h GLN 51 Ca -0.33 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.37 2qam h GLN 51 Cb 1.47 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 29.18 2qam h GLN 51 CO -0.08 0.15 -0.25 -0.09 -0.67 0.00 0.00 178.83 177.88 2qam h ARG 52 N 0.23 -0.51 0.00 1.46 2.43 -1.68 0.30 114.38 116.60 2qam h ARG 52 Ca 0.31 0.03 0.00 0.00 -0.81 0.00 0.00 59.98 59.52 2qam h ARG 52 Cb 0.92 0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.58 2qam h ARG 52 CO -0.06 -0.34 0.18 0.87 -1.51 0.00 0.00 179.97 179.10 2qam h LYS 53 N -0.53 0.00 0.00 0.20 1.57 -1.51 -2.78 116.57 113.52 2qam h LYS 53 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2qam h LYS 53 Cb 0.49 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.80 2qam h LYS 53 CO -0.06 0.00 -0.07 0.54 -0.57 0.00 0.00 179.45 179.29 2qam n ARG 54 N -2.24 0.06 -0.31 3.15 1.74 0.09 -3.96 116.66 115.17 2qam n ARG 54 Ca -0.01 0.23 -0.08 0.00 -0.77 0.00 0.00 57.85 57.22 2qam n ARG 54 Cb 0.21 -0.81 -0.07 0.00 -1.02 0.00 0.00 32.46 30.76 2qam n ARG 54 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2qam n GLN 55 N -2.57 -0.32 -0.20 5.56 6.02 0.83 0.33 117.38 127.02 2qam n GLN 55 Ca -0.01 1.13 -0.02 0.00 -0.01 0.00 0.00 57.00 58.09 2qam n GLN 55 Cb 0.04 -1.66 0.09 0.00 1.02 0.00 0.00 30.24 29.73 2qam n GLN 55 CO 0.00 0.00 0.00 0.74 -1.01 0.00 0.00 177.06 176.79 2qam h PHE 56 N 0.00 0.52 0.08 1.08 0.05 -1.75 0.69 116.94 117.60 2qam h PHE 56 Ca 0.13 0.03 0.00 0.00 3.82 0.00 0.00 57.97 61.94 2qam h PHE 56 Cb 0.31 -0.14 -0.01 0.00 2.00 0.00 0.00 35.95 38.11 2qam h PHE 56 CO -0.76 0.22 -0.15 -0.09 -0.18 0.00 0.00 178.31 177.34 2qam h ARG 57 N 0.53 -0.24 -0.98 1.51 2.43 -0.25 0.83 114.38 118.20 2qam h ARG 57 Ca 0.28 0.02 0.23 0.00 -0.81 0.00 0.00 59.98 59.70 2qam h ARG 57 Cb 0.24 0.05 -0.12 0.00 -0.42 0.00 0.00 29.97 29.72 2qam h ARG 57 CO -0.22 -0.16 0.56 1.96 -1.51 0.00 0.00 179.97 180.61 2qam h GLN 58 N -0.25 0.56 0.31 0.20 4.20 -0.99 -0.55 115.11 118.59 2qam h GLN 58 Ca -0.01 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.66 2qam h GLN 58 Cb 0.23 -0.13 -0.03 0.00 0.30 0.00 0.00 27.48 27.86 2qam h GLN 58 CO -0.06 0.37 -0.43 1.25 -0.67 0.00 0.00 178.83 179.30 2qam h LEU 59 N 0.58 -1.21 -0.29 1.46 7.12 0.20 0.32 115.31 123.50 2qam h LEU 59 Ca 0.62 0.11 0.06 0.00 0.13 0.00 0.00 57.88 58.80 2qam h LEU 59 Cb 1.14 0.41 -0.08 0.00 -0.53 0.00 0.00 40.66 41.61 2qam h LEU 59 CO -0.47 -0.52 -0.41 -0.50 -0.13 0.00 0.00 178.44 176.41 2qam h TRP 60 N -0.76 -1.19 -1.06 1.25 6.55 0.21 0.40 115.95 121.34 2qam h TRP 60 Ca -0.04 0.06 0.29 0.00 0.95 0.00 0.00 58.89 60.15 2qam h TRP 60 Cb 0.69 0.56 -0.12 0.00 -0.86 0.00 0.00 29.16 29.44 2qam h TRP 60 CO -0.29 -0.45 0.65 0.82 -1.05 0.00 0.00 178.44 178.12 2qam h ILE 61 N -0.38 0.43 0.00 1.49 2.04 -0.79 1.01 117.51 121.31 2qam h ILE 61 Ca 0.12 -0.14 -0.01 0.00 1.00 0.00 0.00 64.86 65.83 2qam h ILE 61 Cb 0.59 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 36.68 2qam h ILE 61 CO -0.50 0.07 -0.06 0.00 0.00 0.00 0.00 178.15 177.67 2qam h ALA 62 N 1.69 1.80 0.00 1.87 0.00 0.38 -2.14 119.26 122.87 2qam h ALA 62 Ca 0.67 -0.06 -0.20 0.00 0.00 0.00 0.00 54.91 55.32 2qam h ALA 62 Cb 1.60 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 19.35 2qam h ALA 62 CO -0.42 0.08 -1.20 0.54 0.00 0.00 0.00 179.25 178.24 2qam n ARG 63 N -4.33 0.54 -0.33 0.00 1.74 0.32 -3.24 116.66 111.36 2qam n ARG 63 Ca -0.03 0.54 -0.11 0.00 -0.77 0.00 0.00 57.85 57.48 2qam n ARG 63 Cb 0.14 -1.71 -0.10 0.00 -1.02 0.00 0.00 32.46 29.77 2qam n ARG 63 CO 0.00 0.00 0.00 0.82 -1.52 0.00 0.00 177.63 176.93 2qam h ILE 64 N -1.00 0.00 -0.63 0.55 1.08 -0.59 1.35 117.51 118.27 2qam h ILE 64 Ca -0.30 0.00 0.06 0.00 -0.39 0.00 0.00 64.86 64.23 2qam h ILE 64 Cb 1.16 0.00 -0.06 0.00 -3.07 0.00 0.00 36.82 34.86 2qam h ILE 64 CO -0.18 0.00 0.32 -1.13 -0.69 0.00 0.00 178.15 176.47 2qam h ASN 65 N -0.09 0.46 -0.78 1.72 -1.24 -1.59 0.45 115.58 114.50 2qam h ASN 65 Ca 0.13 0.04 0.08 0.00 0.71 0.00 0.00 56.30 57.26 2qam h ASN 65 Cb 0.44 -0.05 -0.06 0.00 0.73 0.00 0.00 38.32 39.38 2qam h ASN 65 CO -0.82 0.29 0.45 0.00 -1.29 0.00 0.00 177.43 176.07 2qam h ALA 66 N 1.35 1.09 0.24 1.57 0.00 0.18 0.86 119.26 124.56 2qam h ALA 66 Ca 0.29 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.20 2qam h ALA 66 Cb 0.22 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.86 2qam h ALA 66 CO -0.20 0.13 -0.12 0.00 0.00 0.00 0.00 179.25 179.06 2qam h ALA 67 N 1.41 -0.33 -0.83 0.00 0.00 0.26 -2.30 119.26 117.47 2qam h ALA 67 Ca 0.36 -0.19 0.16 0.00 0.00 0.00 0.00 54.91 55.25 2qam h ALA 67 Cb 0.26 0.13 -0.06 0.00 0.00 0.00 0.00 17.79 18.12 2qam h ALA 67 CO -0.21 -0.38 0.55 0.00 0.00 0.00 0.00 179.25 179.21 2qam h ALA 68 N -0.57 2.08 -0.47 0.00 0.00 0.03 0.51 119.26 120.84 2qam h ALA 68 Ca -0.03 0.01 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 2qam h ALA 68 Cb 0.48 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.19 2qam h ALA 68 CO 0.06 -0.31 0.03 -0.09 0.00 0.00 0.00 179.25 178.93 2qam h ARG 69 N 0.47 0.76 -0.69 0.00 9.65 0.79 -1.46 114.38 123.90 2qam h ARG 69 Ca 0.42 -0.18 0.16 0.00 -1.10 0.00 0.00 59.98 59.28 2qam h ARG 69 Cb 0.91 -0.10 -0.04 0.00 -1.39 0.00 0.00 29.97 29.35 2qam h ARG 69 CO -0.15 0.74 0.47 0.37 2.80 0.00 0.00 179.97 184.20 2qam h GLN 70 N 0.71 0.21 0.00 0.20 5.75 0.62 -3.41 115.11 119.20 2qam h GLN 70 Ca 0.15 -0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.63 2qam h GLN 70 Cb 0.39 -0.05 0.00 0.00 1.07 0.00 0.00 27.48 28.89 2qam h GLN 70 CO 0.01 0.14 0.00 0.09 -2.65 0.00 0.00 178.83 176.42 2qam n ASN 71 N -4.42 0.00 -0.40 -0.69 4.13 -0.55 -5.02 115.26 108.31 2qam n ASN 71 Ca 0.13 0.00 0.09 0.00 1.68 0.00 0.00 54.58 56.48 2qam n ASN 71 Cb 0.60 0.00 0.18 0.00 -1.54 0.00 0.00 39.78 39.03 2qam n ASN 71 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2qam n GLY 72 N 5.00 4.43 3.04 7.41 0.00 -1.25 -5.01 105.19 118.81 2qam n GLY 72 Ca 0.00 -1.04 -0.16 0.00 0.00 0.00 0.00 46.02 44.83 2qam n GLY 72 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2qam s ILE 73 N -2.74 0.62 0.57 -0.61 1.10 -1.22 -5.09 121.20 113.83 2qam s ILE 73 Ca 0.34 -0.75 -0.06 0.00 -0.51 0.00 0.00 60.65 59.67 2qam s ILE 73 Cb 0.29 -0.60 -0.01 0.00 0.15 0.00 0.00 42.46 42.29 2qam s ILE 73 CO 0.05 -0.11 0.89 -0.94 -2.11 0.00 0.00 174.94 172.72 2qam s SER 74 N -0.94 5.85 0.03 4.50 1.04 -1.26 -3.24 113.70 119.67 2qam s SER 74 Ca -0.03 0.87 -0.08 0.00 0.48 0.00 0.00 55.95 57.19 2qam s SER 74 Cb -0.07 -1.96 -0.03 0.00 0.10 0.00 0.00 66.02 64.07 2qam s SER 74 CO 0.00 -0.91 1.13 0.22 0.98 0.00 0.00 173.24 174.67 2qam h TYR 75 N -0.09 -0.40 -0.55 5.02 3.20 -1.91 0.46 116.97 122.70 2qam h TYR 75 Ca -0.46 0.02 0.05 0.00 3.14 0.00 0.00 58.73 61.48 2qam h TYR 75 Cb 1.23 0.18 -0.07 0.00 1.54 0.00 0.00 36.73 39.62 2qam h TYR 75 CO 0.53 -0.13 -0.32 -1.13 -1.64 0.00 0.00 178.16 175.46 2qam n SER 76 N -3.29 -0.58 -0.06 -2.11 3.41 -1.26 -0.39 113.62 109.34 2qam n SER 76 Ca -0.01 1.38 0.02 0.00 -0.26 0.00 0.00 58.87 60.00 2qam n SER 76 Cb 0.09 -0.33 0.33 0.00 -0.26 0.00 0.00 64.21 64.04 2qam n SER 76 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 2qam h LYS 77 N 0.00 0.65 0.21 4.33 1.57 -1.93 0.12 116.57 121.52 2qam h LYS 77 Ca 0.09 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 2qam h LYS 77 Cb 0.22 -0.13 -0.01 0.00 0.08 0.00 0.00 32.23 32.40 2qam h LYS 77 CO -0.51 0.51 -0.18 0.35 -0.57 0.00 0.00 179.45 179.05 2qam h PHE 78 N 0.66 -0.48 -0.22 -1.35 -0.00 0.28 0.43 116.94 116.26 2qam h PHE 78 Ca 0.17 0.00 0.05 0.00 -0.00 0.00 0.00 57.97 58.19 2qam h PHE 78 Cb 0.07 0.18 -0.01 0.00 -0.00 0.00 0.00 35.95 36.19 2qam h PHE 78 CO 0.00 -0.24 0.15 0.97 -0.00 0.00 0.00 178.31 179.20 2qam h ILE 79 N -0.37 0.92 0.00 1.41 -0.00 -0.97 0.77 117.51 119.27 2qam h ILE 79 Ca -0.03 -0.02 -0.03 0.00 -0.00 0.00 0.00 64.86 64.78 2qam h ILE 79 Cb 0.32 0.86 -0.00 0.00 -0.00 0.00 0.00 36.82 37.99 2qam h ILE 79 CO -0.01 0.01 -0.14 -1.13 -0.00 0.00 0.00 178.15 176.89 2qam h ASN 80 N 0.06 0.00 0.00 2.19 -0.00 0.03 0.36 115.58 118.22 2qam h ASN 80 Ca 0.10 0.00 -0.00 0.00 -0.00 0.00 0.00 56.30 56.40 2qam h ASN 80 Cb 0.33 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.65 2qam h ASN 80 CO -0.01 0.14 -0.00 1.23 -0.00 0.00 0.00 177.43 178.79 2qam h GLY 81 N 0.52 -0.00 0.78 1.57 0.00 0.51 -2.18 103.07 104.27 2qam h GLY 81 Ca -0.00 0.00 0.09 0.00 0.00 0.00 0.00 47.33 47.42 2qam h GLY 81 CO 0.02 -0.00 0.52 1.41 0.00 0.00 0.00 176.54 178.49 2qam h LEU 82 N -1.00 0.00 0.00 3.11 3.38 -0.84 1.47 115.31 121.44 2qam h LEU 82 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2qam h LEU 82 Cb 0.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.12 2qam h LEU 82 CO 0.00 0.00 0.00 1.17 0.09 0.00 0.00 178.44 179.70 2qam n LYS 83 N -3.31 0.00 -0.05 1.13 3.00 0.13 -3.52 118.16 115.52 2qam n LYS 83 Ca 0.05 0.43 0.16 0.00 -0.00 0.00 0.00 58.31 58.96 2qam n LYS 83 Cb 0.66 -1.16 0.59 0.00 0.00 0.00 0.00 35.03 35.12 2qam n LYS 83 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.40 178.27 2qam h LYS 84 N 0.00 0.20 -4.99 1.64 1.57 -0.57 -2.09 116.57 112.34 2qam h LYS 84 Ca 0.00 -0.01 -0.45 0.00 -1.87 0.00 0.00 60.65 58.32 2qam h LYS 84 Cb 0.00 -0.05 0.03 0.00 0.08 0.00 0.00 32.23 32.29 2qam h LYS 84 CO 0.00 0.13 1.44 0.00 -0.57 0.00 0.00 179.45 180.46 2qam n ALA 85 N -2.58 2.03 -3.07 3.86 0.00 0.49 -4.44 120.51 116.80 2qam n ALA 85 Ca 0.10 -2.99 -0.10 0.00 0.00 0.00 0.00 53.44 50.46 2qam n ALA 85 Cb 0.51 -3.56 0.00 0.00 0.00 0.00 0.00 19.45 16.40 2qam n ALA 85 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2qam n SER 86 N 11.73 -1.68 0.00 0.00 7.64 -1.23 -2.61 113.62 127.48 2qam n SER 86 Ca 0.46 -0.37 0.00 0.00 1.01 0.00 0.00 58.87 59.98 2qam n SER 86 Cb 0.44 -0.57 0.00 0.00 -1.01 0.00 0.00 64.21 63.07 2qam n SER 86 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 2qam n VAL 87 N -1.40 0.00 -3.21 0.44 0.31 -0.79 -4.75 118.33 108.93 2qam n VAL 87 Ca -0.11 0.00 -0.11 0.00 -0.01 0.00 0.00 64.34 64.11 2qam n VAL 87 Cb 0.24 0.00 0.01 0.00 -0.91 0.00 0.00 33.84 33.19 2qam n VAL 87 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 2qam n GLU 88 N 0.00 -1.20 0.00 5.55 0.00 -1.07 -4.26 120.64 119.65 2qam n GLU 88 Ca 0.00 1.25 0.00 0.00 0.00 0.00 0.00 57.16 58.41 2qam n GLU 88 Cb 0.00 -2.03 0.00 0.00 0.00 0.00 0.00 31.44 29.41 2qam n GLU 88 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.13 176.24 2qam n ILE 89 N 0.74 0.00 -1.30 6.31 2.08 -1.26 -4.80 119.36 121.12 2qam n ILE 89 Ca -0.02 0.39 -0.12 0.00 0.56 0.00 0.00 62.75 63.57 2qam n ILE 89 Cb 0.49 -1.31 -0.05 0.00 -0.75 0.00 0.00 39.64 38.02 2qam n ILE 89 CO 0.00 0.00 0.00 0.47 0.56 0.00 0.00 176.55 177.58 2qam n ASP 90 N 0.00 -5.02 0.00 4.38 9.92 -1.26 -4.77 116.55 119.79 2qam n ASP 90 Ca 0.00 0.29 0.00 0.00 -0.53 0.00 0.00 54.79 54.55 2qam n ASP 90 Cb 0.00 -3.92 0.00 0.00 -0.64 0.00 0.00 41.12 36.56 2qam n ASP 90 CO 0.00 0.00 0.00 -1.14 0.13 0.00 0.00 177.20 176.19 2qam n ARG 91 N -1.10 0.00 0.00 -1.24 3.00 -1.26 -3.31 116.66 112.75 2qam n ARG 91 Ca -0.12 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.73 2qam n ARG 91 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 32.46 33.01 2qam n ARG 91 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 2qam n LYS 92 N 7.26 0.18 -0.10 -0.14 5.02 -1.26 -4.65 118.16 124.46 2qam n LYS 92 Ca 0.00 -0.00 -0.23 0.00 -2.02 0.00 0.00 58.31 56.05 2qam n LYS 92 Cb 0.00 -0.12 -0.12 0.00 -0.02 0.00 0.00 35.03 34.77 2qam n LYS 92 CO 0.00 0.00 0.00 1.51 -0.52 0.00 0.00 177.40 178.39 2qam n ILE 93 N -0.03 1.57 0.31 -0.18 3.06 -1.26 -3.90 119.36 118.93 2qam n ILE 93 Ca 0.00 -0.40 0.08 0.00 -2.50 0.00 0.00 62.75 59.93 2qam n ILE 93 Cb 0.05 -1.78 0.35 0.00 0.54 0.00 0.00 39.64 38.80 2qam n ILE 93 CO 0.00 0.00 0.00 0.18 -2.50 0.00 0.00 176.55 174.23 2qam n LEU 94 N -3.90 0.30 -0.49 9.51 7.99 -1.25 -1.75 117.00 127.41 2qam n LEU 94 Ca -0.43 0.60 0.00 0.00 -0.01 0.00 0.00 56.01 56.17 2qam n LEU 94 Cb 0.90 -0.58 0.00 0.00 -0.11 0.00 0.00 43.42 43.62 2qam n LEU 94 CO 0.20 -0.52 0.17 0.00 -1.51 0.00 0.00 177.39 175.74 2qam n ALA 95 N -1.63 2.02 1.20 -1.18 0.00 -1.21 -2.65 120.51 117.07 2qam n ALA 95 Ca 0.02 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.59 2qam n ALA 95 Cb 0.13 -1.00 0.56 0.00 0.00 0.00 0.00 19.45 19.14 2qam n ALA 95 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2qam n ASP 96 N 0.14 0.28 0.00 0.00 5.68 -0.72 -3.28 116.55 118.65 2qam n ASP 96 Ca 0.00 -0.12 0.01 0.00 -0.50 0.00 0.00 54.79 54.18 2qam n ASP 96 Cb 0.17 -0.17 0.05 0.00 -1.14 0.00 0.00 41.12 40.03 2qam n ASP 96 CO 0.00 0.00 0.00 2.30 -1.33 0.00 0.00 177.20 178.17 2qam n ILE 97 N -1.27 0.91 1.25 2.12 -5.35 -1.08 0.12 119.36 116.06 2qam n ILE 97 Ca 0.10 0.23 0.10 0.00 -0.27 0.00 0.00 62.75 62.91 2qam n ILE 97 Cb 0.30 -1.20 0.38 0.00 -1.74 0.00 0.00 39.64 37.38 2qam n ILE 97 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2qam n ALA 98 N -1.24 2.52 0.00 -1.28 0.00 -1.21 -3.36 120.51 115.94 2qam n ALA 98 Ca 0.01 -0.51 -0.02 0.00 0.00 0.00 0.00 53.44 52.92 2qam n ALA 98 Cb 0.01 -1.09 -0.01 0.00 0.00 0.00 0.00 19.45 18.36 2qam n ALA 98 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2qam n VAL 99 N 0.28 0.84 -3.80 0.00 0.31 0.33 -4.79 118.33 111.50 2qam n VAL 99 Ca 0.16 0.26 -0.32 0.00 -0.01 0.00 0.00 64.34 64.43 2qam n VAL 99 Cb 0.32 -1.59 -0.05 0.00 -0.91 0.00 0.00 33.84 31.61 2qam n VAL 99 CO 0.00 0.00 0.00 -0.36 -1.32 0.00 0.00 176.83 175.15 2qam s PHE 100 N -1.82 3.52 -1.32 3.52 2.99 -1.09 -4.06 117.98 119.72 2qam s PHE 100 Ca -0.06 0.42 -0.07 0.00 0.00 0.00 0.00 56.93 57.22 2qam s PHE 100 Cb 0.01 -1.89 0.01 0.00 0.00 0.00 0.00 43.02 41.14 2qam s PHE 100 CO 0.09 0.54 1.15 -3.47 -0.00 0.00 0.00 175.22 173.53 2qam n ASP 101 N 0.40 -5.60 0.02 1.36 4.64 -1.26 -4.22 116.55 111.89 2qam n ASP 101 Ca -0.05 -0.55 0.21 0.00 -1.38 0.00 0.00 54.79 53.02 2qam n ASP 101 Cb 0.52 -5.03 0.73 0.00 -1.04 0.00 0.00 41.12 36.30 2qam n ASP 101 CO 0.00 0.00 0.00 0.50 -0.82 0.00 0.00 177.20 176.88 2qam h LYS 102 N -2.56 0.00 -0.72 -0.67 3.64 -1.69 0.76 116.57 115.33 2qam h LYS 102 Ca -0.57 0.00 0.02 0.00 -1.27 0.00 0.00 60.65 58.83 2qam h LYS 102 Cb 1.36 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 33.14 2qam h LYS 102 CO 0.55 0.00 0.47 0.28 -2.27 0.00 0.00 179.45 178.48 2qam h VAL 103 N 0.00 1.16 -2.62 2.00 2.07 -1.87 -3.39 116.25 113.60 2qam h VAL 103 Ca 0.25 -0.33 -0.26 0.00 0.82 0.00 0.00 66.70 67.17 2qam h VAL 103 Cb 1.11 0.12 0.14 0.00 -1.52 0.00 0.00 31.29 31.15 2qam h VAL 103 CO -0.00 0.17 0.01 0.00 0.02 0.00 0.00 177.57 177.77 2qam n ALA 104 N -2.30 -2.77 0.00 1.67 0.00 0.27 -3.38 120.51 113.99 2qam n ALA 104 Ca 0.07 -1.10 0.00 0.00 0.00 0.00 0.00 53.44 52.41 2qam n ALA 104 Cb 0.04 -0.08 0.00 0.00 0.00 0.00 0.00 19.45 19.41 2qam n ALA 104 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2qam n PHE 105 N -4.40 0.00 0.09 0.00 -0.00 -1.26 -4.43 117.46 107.46 2qam n PHE 105 Ca 0.10 0.00 0.13 0.00 -0.00 0.00 0.00 57.45 57.68 2qam n PHE 105 Cb 0.41 0.00 0.62 0.00 -0.00 0.00 0.00 39.48 40.51 2qam n PHE 105 CO 0.00 0.00 0.00 1.15 -0.00 0.00 0.00 176.76 177.91 2qam h THR 106 N 0.00 0.89 -0.35 -2.13 2.02 -1.74 0.39 112.91 111.99 2qam h THR 106 Ca 0.00 -0.03 -0.10 0.00 0.77 0.00 0.00 66.41 67.05 2qam h THR 106 Cb 0.00 0.78 -0.01 0.00 -1.74 0.00 0.00 68.15 67.18 2qam h THR 106 CO 0.00 0.02 -0.15 0.00 0.37 0.00 0.00 175.52 175.75 2qam h ALA 107 N 1.84 0.49 -0.29 6.16 0.00 -1.77 -1.97 119.26 123.71 2qam h ALA 107 Ca 0.15 -0.34 0.05 0.00 0.00 0.00 0.00 54.91 54.76 2qam h ALA 107 Cb 0.46 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.09 2qam h ALA 107 CO -0.02 0.40 0.03 -0.07 0.00 0.00 0.00 179.25 179.59 2qam h LEU 108 N 0.50 -0.05 -0.34 0.00 3.38 -0.71 0.39 115.31 118.48 2qam h LEU 108 Ca 0.08 0.06 0.06 0.00 0.09 0.00 0.00 57.88 58.17 2qam h LEU 108 Cb 0.69 0.09 -0.08 0.00 0.09 0.00 0.00 40.66 41.44 2qam h LEU 108 CO 0.05 0.01 -0.42 0.58 0.09 0.00 0.00 178.44 178.74 2qam h VAL 109 N 0.12 0.13 0.07 1.22 2.07 -0.54 0.19 116.25 119.51 2qam h VAL 109 Ca 0.14 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.67 2qam h VAL 109 Cb 0.17 0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.05 2qam h VAL 109 CO -0.21 0.00 -0.10 -0.08 0.02 0.00 0.00 177.57 177.20 2qam h GLU 110 N -0.36 -0.20 -1.03 1.57 4.57 -0.66 0.30 114.58 118.78 2qam h GLU 110 Ca 0.12 0.01 0.30 0.00 -1.18 0.00 0.00 59.36 58.62 2qam h GLU 110 Cb 0.59 0.04 -0.14 0.00 -0.16 0.00 0.00 28.75 29.09 2qam h GLU 110 CO -0.53 -0.13 0.60 -0.22 -1.18 0.00 0.00 179.01 177.55 2qam h LYS 111 N -0.21 0.38 0.01 1.92 1.63 0.90 0.27 116.57 121.48 2qam h LYS 111 Ca 0.01 -0.02 -0.09 0.00 -0.85 0.00 0.00 60.65 59.70 2qam h LYS 111 Cb 0.21 -0.09 0.01 0.00 -0.60 0.00 0.00 32.23 31.76 2qam h LYS 111 CO -0.05 0.25 -0.37 0.00 -3.45 0.00 0.00 179.45 175.84 2qam h ALA 112 N 1.78 0.03 -0.81 5.00 0.00 0.30 -3.10 119.26 122.46 2qam h ALA 112 Ca 0.70 -0.51 0.13 0.00 0.00 0.00 0.00 54.91 55.23 2qam h ALA 112 Cb 1.58 0.03 -0.09 0.00 0.00 0.00 0.00 17.79 19.30 2qam h ALA 112 CO -0.53 0.17 0.40 0.87 0.00 0.00 0.00 179.25 180.16 2qam h LYS 113 N -0.43 0.57 -0.37 0.00 1.57 0.22 -0.79 116.57 117.34 2qam h LYS 113 Ca -0.05 -0.03 -0.00 0.00 -1.87 0.00 0.00 60.65 58.69 2qam h LYS 113 Cb 1.14 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 33.30 2qam h LYS 113 CO 0.07 0.38 0.22 0.00 -0.57 0.00 0.00 179.45 179.55 2qam h ALA 114 N 1.53 0.48 -0.35 3.86 0.00 -0.69 0.32 119.26 124.41 2qam h ALA 114 Ca 0.43 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 55.33 2qam h ALA 114 Cb 0.58 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.19 2qam h ALA 114 CO -0.35 -0.02 0.11 0.00 0.00 0.00 0.00 179.25 178.99 2qam h ALA 115 N 1.09 0.40 0.00 0.00 0.00 -1.12 -0.25 119.26 119.38 2qam h ALA 115 Ca 0.13 0.05 -0.05 0.00 0.00 0.00 0.00 54.91 55.04 2qam h ALA 115 Cb 0.01 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2qam h ALA 115 CO -0.02 -0.28 -0.22 -0.07 0.00 0.00 0.00 179.25 178.66 2qam h LEU 116 N 0.25 0.00 0.00 0.00 4.07 -0.89 -3.49 115.31 115.25 2qam h LEU 116 Ca 0.16 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.12 2qam h LEU 116 Cb 0.14 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.88 2qam h LEU 116 CO -0.17 0.22 0.00 0.00 -1.08 0.00 0.00 178.44 177.40