#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vs8 s VAL 2 N 0.00 0.59 0.28 0.00 1.01 -1.26 -5.15 120.40 115.88 1vs8 s VAL 2 Ca 0.00 -2.00 -0.13 0.00 0.00 0.00 0.00 61.98 59.85 1vs8 s VAL 2 Cb 0.00 -2.62 -0.08 0.00 0.00 0.00 0.00 36.38 33.68 1vs8 s VAL 2 CO 0.00 -0.02 0.66 0.00 0.00 0.00 0.00 175.10 175.74 1vs8 s GLN 3 N -4.02 3.92 0.00 2.72 -2.07 -1.26 -4.99 119.66 113.96 1vs8 s GLN 3 Ca 0.37 0.51 0.25 0.00 -1.82 0.00 0.00 55.36 54.67 1vs8 s GLN 3 Cb 0.08 -2.52 0.45 0.00 -1.09 0.00 0.00 33.01 29.92 1vs8 s GLN 3 CO 0.13 0.22 1.37 1.04 -1.32 0.00 0.00 175.29 176.73 1vs8 n GLN 4 N -0.26 0.73 -3.56 9.60 6.02 -1.26 -4.94 117.38 123.71 1vs8 n GLN 4 Ca 0.02 -0.50 -0.13 0.00 -0.01 0.00 0.00 57.00 56.38 1vs8 n GLN 4 Cb 0.53 -1.49 -0.06 0.00 1.02 0.00 0.00 30.24 30.24 1vs8 n GLN 4 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1vs8 s ASN 5 N -2.61 -0.49 0.20 1.08 2.20 -1.26 -5.15 114.94 108.91 1vs8 s ASN 5 Ca 0.19 0.56 -0.32 0.00 -0.94 0.00 0.00 52.86 52.35 1vs8 s ASN 5 Cb 0.18 0.44 -0.13 0.00 -2.00 0.00 0.00 41.25 39.74 1vs8 s ASN 5 CO 0.59 -0.44 1.65 0.29 -2.94 0.00 0.00 177.10 176.26 1vs8 n LYS 6 N 0.89 2.53 -2.52 3.55 5.02 -1.26 -4.95 118.16 121.42 1vs8 n LYS 6 Ca -0.14 0.91 -0.43 0.00 -2.02 0.00 0.00 58.31 56.63 1vs8 n LYS 6 Cb 0.57 -2.72 -0.02 0.00 -0.02 0.00 0.00 35.03 32.85 1vs8 n LYS 6 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1vs8 s PRO 7 N 0.88 4.09 0.98 1.97 0.04 -1.26 -5.00 135.00 136.69 1vs8 s PRO 7 Ca 0.75 1.32 -0.13 0.00 0.04 0.00 0.00 61.00 62.98 1vs8 s PRO 7 Cb -0.57 -3.78 0.11 0.00 0.04 0.00 0.00 34.50 30.30 1vs8 s PRO 7 CO 0.36 -0.88 0.66 0.25 0.04 0.00 0.00 177.00 177.43 1vs8 n THR 8 N 5.78 0.00 -0.08 1.26 -2.24 -1.26 -4.68 114.28 113.06 1vs8 n THR 8 Ca 0.13 -0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.75 1vs8 n THR 8 Cb 0.46 -0.78 0.29 0.00 -2.10 0.00 0.00 70.33 68.20 1vs8 n THR 8 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 1vs8 h ARG 9 N -1.85 0.70 -0.02 -0.78 3.08 -1.99 0.11 114.38 113.63 1vs8 h ARG 9 Ca -0.46 -0.10 0.00 0.00 0.07 0.00 0.00 59.98 59.49 1vs8 h ARG 9 Cb 1.29 -0.13 -0.00 0.00 0.08 0.00 0.00 29.97 31.21 1vs8 h ARG 9 CO 0.38 0.57 0.04 0.66 -1.07 0.00 0.00 179.97 180.56 1vs8 h SER 10 N 0.69 0.00 0.17 7.04 4.64 -2.00 -1.19 113.55 122.90 1vs8 h SER 10 Ca 0.17 0.00 -0.35 0.00 -0.47 0.00 0.00 61.79 61.13 1vs8 h SER 10 Cb 0.14 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.18 1vs8 h SER 10 CO -0.02 0.00 -2.09 0.29 -0.87 0.00 0.00 176.83 174.15 1vs8 n LYS 11 N -3.38 0.70 0.15 4.77 4.76 0.23 -3.07 118.16 122.32 1vs8 n LYS 11 Ca -0.03 0.21 -0.12 0.00 -2.87 0.00 0.00 58.31 55.51 1vs8 n LYS 11 Cb 0.11 -1.66 -0.07 0.00 -1.84 0.00 0.00 35.03 31.57 1vs8 n LYS 11 CO 0.00 0.00 0.00 -0.09 -1.37 0.00 0.00 177.40 175.94 1vs8 h ARG 12 N 0.03 -0.60 -0.62 1.97 9.65 0.05 0.40 114.38 125.27 1vs8 h ARG 12 Ca -0.44 0.04 -0.05 0.00 -1.10 0.00 0.00 59.98 58.43 1vs8 h ARG 12 Cb 2.03 0.14 -0.03 0.00 -1.39 0.00 0.00 29.97 30.72 1vs8 h ARG 12 CO 0.04 -0.40 0.20 0.78 2.80 0.00 0.00 179.97 183.39 1vs8 h GLY 13 N -0.62 1.02 1.56 2.80 0.00 -1.63 -0.96 103.07 105.24 1vs8 h GLY 13 Ca -0.03 -0.60 0.05 0.00 0.00 0.00 0.00 47.33 46.75 1vs8 h GLY 13 CO -0.10 0.56 0.18 1.98 0.00 0.00 0.00 176.54 179.15 1vs8 h MET 14 N 0.88 0.00 0.16 4.80 1.85 -1.43 0.35 114.93 121.54 1vs8 h MET 14 Ca 0.20 0.00 -0.30 0.00 -0.61 0.00 0.00 59.70 58.99 1vs8 h MET 14 Cb 0.28 0.00 0.01 0.00 0.43 0.00 0.00 31.60 32.32 1vs8 h MET 14 CO -0.01 0.00 -1.38 -0.09 -0.40 0.00 0.00 176.91 175.03 1vs8 h ARG 15 N 0.00 0.35 -1.03 0.39 1.12 0.99 -3.28 114.38 112.92 1vs8 h ARG 15 Ca 0.08 -0.59 -0.36 0.00 -1.11 0.00 0.00 59.98 57.99 1vs8 h ARG 15 Cb 0.43 0.22 -0.21 0.00 -0.01 0.00 0.00 29.97 30.40 1vs8 h ARG 15 CO -0.00 1.27 0.45 0.54 -3.11 0.00 0.00 179.97 179.12 1vs8 n ARG 16 N -3.57 1.86 0.00 0.20 5.12 0.11 -4.56 116.66 115.83 1vs8 n ARG 16 Ca -0.13 -2.03 0.00 0.00 -1.93 0.00 0.00 57.85 53.76 1vs8 n ARG 16 Cb 1.05 -1.79 0.00 0.00 -1.16 0.00 0.00 32.46 30.56 1vs8 n ARG 16 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 1vs8 n SER 17 N -0.55 0.98 -3.08 0.55 3.41 -0.48 -3.75 113.62 110.70 1vs8 n SER 17 Ca 0.40 -1.27 -0.18 0.00 -0.26 0.00 0.00 58.87 57.57 1vs8 n SER 17 Cb 1.22 -0.32 -0.02 0.00 -0.26 0.00 0.00 64.21 64.84 1vs8 n SER 17 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1vs8 n HIS 18 N 0.32 -0.87 0.01 7.33 8.25 -1.26 -4.94 115.22 124.06 1vs8 n HIS 18 Ca 0.00 -3.24 -0.12 0.00 -0.26 0.00 0.00 57.72 54.10 1vs8 n HIS 18 Cb 0.20 0.12 0.01 0.00 1.12 0.00 0.00 29.99 31.44 1vs8 n HIS 18 CO 0.00 0.00 0.00 0.38 0.64 0.00 0.00 176.34 177.36 1vs8 h ASP 19 N 3.50 0.66 -3.91 0.41 2.03 -1.98 -3.49 116.42 113.64 1vs8 h ASP 19 Ca 0.03 -0.40 0.00 0.00 -0.73 0.00 0.00 57.03 55.93 1vs8 h ASP 19 Cb 0.96 -0.19 0.00 0.00 -0.83 0.00 0.00 39.33 39.27 1vs8 h ASP 19 CO 0.42 1.15 -0.76 0.00 -1.03 0.00 0.00 179.24 179.02 1vs8 n ALA 20 N -2.54 -1.68 -3.52 4.15 0.00 -1.26 -5.07 120.51 110.60 1vs8 n ALA 20 Ca -0.05 0.38 -0.15 0.00 0.00 0.00 0.00 53.44 53.63 1vs8 n ALA 20 Cb 0.68 -1.26 -0.07 0.00 0.00 0.00 0.00 19.45 18.80 1vs8 n ALA 20 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1vs8 s LEU 21 N -4.64 -0.41 0.00 0.00 1.43 -1.26 -5.17 118.68 108.64 1vs8 s LEU 21 Ca 0.00 1.07 0.00 0.00 -1.03 0.00 0.00 54.13 54.17 1vs8 s LEU 21 Cb 0.00 2.21 0.00 0.00 0.03 0.00 0.00 46.19 48.43 1vs8 s LEU 21 CO 0.00 -0.33 0.00 0.41 0.23 0.00 0.00 176.35 176.66 1vs8 n THR 22 N 2.21 0.00 -2.95 5.49 -1.04 -1.26 -4.98 114.28 111.75 1vs8 n THR 22 Ca -0.16 0.00 -0.12 0.00 -2.04 0.00 0.00 64.05 61.73 1vs8 n THR 22 Cb 0.56 0.00 0.06 0.00 -1.82 0.00 0.00 70.33 69.13 1vs8 n THR 22 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1vs8 n ALA 23 N -3.00 -1.97 0.43 2.41 0.00 -1.26 -4.85 120.51 112.28 1vs8 n ALA 23 Ca 0.00 0.07 0.03 0.00 0.00 0.00 0.00 53.44 53.55 1vs8 n ALA 23 Cb 0.00 -4.09 0.19 0.00 0.00 0.00 0.00 19.45 15.55 1vs8 n ALA 23 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1vs8 n VAL 24 N -3.02 0.00 -4.29 0.00 0.31 -1.26 -4.80 118.33 105.27 1vs8 n VAL 24 Ca -0.10 0.00 -0.35 0.00 -0.01 0.00 0.00 64.34 63.89 1vs8 n VAL 24 Cb 0.60 -0.84 -0.09 0.00 -0.91 0.00 0.00 33.84 32.60 1vs8 n VAL 24 CO 0.00 0.00 0.00 1.07 -1.32 0.00 0.00 176.83 176.58 1vs8 n THR 25 N -0.95 -0.49 -1.79 2.52 5.66 -1.26 -4.91 114.28 113.06 1vs8 n THR 25 Ca 0.05 -0.24 -0.24 0.00 -3.05 0.00 0.00 64.05 60.56 1vs8 n THR 25 Cb 0.02 -0.71 0.17 0.00 -1.55 0.00 0.00 70.33 68.25 1vs8 n THR 25 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 175.07 170.82 1vs8 n SER 26 N -2.49 0.12 -4.49 1.09 7.64 -1.26 -4.88 113.62 109.36 1vs8 n SER 26 Ca -0.11 -1.42 -0.45 0.00 1.01 0.00 0.00 58.87 57.91 1vs8 n SER 26 Cb 0.55 -0.83 -0.07 0.00 -1.01 0.00 0.00 64.21 62.85 1vs8 n SER 26 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1vs8 n LEU 27 N 0.00 1.87 -0.04 -3.43 7.99 -1.26 -4.79 117.00 117.33 1vs8 n LEU 27 Ca 0.14 0.12 -0.18 0.00 -0.01 0.00 0.00 56.01 56.08 1vs8 n LEU 27 Cb 0.48 -1.29 -0.14 0.00 -0.11 0.00 0.00 43.42 42.36 1vs8 n LEU 27 CO 0.35 -0.95 -0.95 -1.20 -1.51 0.00 0.00 177.39 173.13 1vs8 n SER 28 N 11.62 1.80 -4.73 -1.43 7.64 -1.26 -4.00 113.62 123.26 1vs8 n SER 28 Ca 0.44 0.12 -0.23 0.00 1.01 0.00 0.00 58.87 60.22 1vs8 n SER 28 Cb 0.28 -0.52 -0.06 0.00 -1.01 0.00 0.00 64.21 62.90 1vs8 n SER 28 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1vs8 s VAL 29 N -2.55 3.50 0.00 0.44 0.11 -1.08 -3.82 120.40 117.00 1vs8 s VAL 29 Ca -0.23 -1.69 0.00 0.00 -2.93 0.00 0.00 61.98 57.13 1vs8 s VAL 29 Cb 0.07 -3.03 0.00 0.00 -1.53 0.00 0.00 36.38 31.90 1vs8 s VAL 29 CO 0.73 -0.29 0.00 -0.90 -3.33 0.00 0.00 175.10 171.32 1vs8 n ASP 30 N -1.08 0.09 -1.41 3.54 3.85 -1.26 -4.96 116.55 115.33 1vs8 n ASP 30 Ca -0.05 -0.00 -0.00 0.00 -0.71 0.00 0.00 54.79 54.03 1vs8 n ASP 30 Cb 0.60 0.03 0.00 0.00 -1.35 0.00 0.00 41.12 40.39 1vs8 n ASP 30 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.20 177.36 1vs8 n LYS 31 N -0.04 0.01 0.00 0.11 4.81 -1.26 -5.11 118.16 116.68 1vs8 n LYS 31 Ca 0.00 -0.01 0.00 0.00 -0.87 0.00 0.00 58.31 57.43 1vs8 n LYS 31 Cb 0.00 0.05 0.00 0.00 0.02 0.00 0.00 35.03 35.10 1vs8 n LYS 31 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 1vs8 n THR 32 N -0.01 0.00 -0.65 3.15 -2.24 -1.26 -5.03 114.28 108.24 1vs8 n THR 32 Ca -0.00 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.65 1vs8 n THR 32 Cb 0.48 0.00 0.04 0.00 -2.10 0.00 0.00 70.33 68.75 1vs8 n THR 32 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1vs8 n SER 33 N 0.00 5.75 0.00 3.42 3.41 -1.26 -4.77 113.62 120.17 1vs8 n SER 33 Ca 0.00 -2.89 0.00 0.00 -0.26 0.00 0.00 58.87 55.72 1vs8 n SER 33 Cb 0.00 -0.99 0.00 0.00 -0.26 0.00 0.00 64.21 62.96 1vs8 n SER 33 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1vs8 n GLY 34 N 0.43 1.66 0.00 5.00 0.00 -1.26 -4.98 105.19 106.04 1vs8 n GLY 34 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.26 1vs8 n GLY 34 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1vs8 n GLU 35 N -2.00 1.99 -1.42 1.61 -0.58 -1.26 -3.83 120.64 115.15 1vs8 n GLU 35 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 1vs8 n GLU 35 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.87 1vs8 n GLU 35 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 1vs8 n LYS 36 N 0.00 -4.07 -0.02 3.49 4.81 -1.25 -2.63 118.16 118.50 1vs8 n LYS 36 Ca 0.00 3.04 0.00 0.00 -0.87 0.00 0.00 58.31 60.48 1vs8 n LYS 36 Cb 0.00 -3.43 0.00 0.00 0.02 0.00 0.00 35.03 31.62 1vs8 n LYS 36 CO 0.00 0.00 0.00 1.58 1.17 0.00 0.00 177.40 180.15 1vs8 n HIS 37 N -0.93 -2.11 0.57 5.64 -0.00 -0.91 -4.23 115.22 113.24 1vs8 n HIS 37 Ca 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 57.72 57.70 1vs8 n HIS 37 Cb 0.01 0.00 0.02 0.00 -0.00 0.00 0.00 29.99 30.01 1vs8 n HIS 37 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.34 177.62 1vs8 n LEU 38 N 0.00 3.71 0.18 0.27 7.99 -1.26 -4.31 117.00 123.59 1vs8 n LEU 38 Ca 0.00 -1.84 0.00 0.00 -0.01 0.00 0.00 56.01 54.16 1vs8 n LEU 38 Cb 0.00 -0.62 0.00 0.00 -0.11 0.00 0.00 43.42 42.69 1vs8 n LEU 38 CO 0.00 0.63 0.00 -1.14 -1.51 0.00 0.00 177.39 175.37 1vs8 n ARG 39 N 0.49 0.00 -4.79 3.23 3.00 -1.26 -5.06 116.66 112.27 1vs8 n ARG 39 Ca 0.06 0.00 -0.28 0.00 -0.00 0.00 0.00 57.85 57.62 1vs8 n ARG 39 Cb 0.60 0.00 -0.14 0.00 0.00 0.00 0.00 32.46 32.91 1vs8 n ARG 39 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.63 176.05 1vs8 s HIS 40 N -2.00 2.13 0.00 -0.14 2.46 -1.26 -4.77 115.29 111.70 1vs8 s HIS 40 Ca 0.00 -0.40 0.00 0.00 0.47 0.00 0.00 55.06 55.13 1vs8 s HIS 40 Cb 0.00 -1.27 0.00 0.00 -0.13 0.00 0.00 32.58 31.18 1vs8 s HIS 40 CO 0.00 0.12 0.00 1.58 -2.47 0.00 0.00 174.74 173.97 1vs8 n HIS 41 N 1.76 -0.24 -2.48 3.88 -0.00 -1.25 -2.14 115.22 114.74 1vs8 n HIS 41 Ca -0.17 0.00 -0.39 0.00 0.46 0.00 0.00 57.72 57.62 1vs8 n HIS 41 Cb 0.52 0.00 -0.03 0.00 -0.12 0.00 0.00 29.99 30.37 1vs8 n HIS 41 CO 0.00 0.00 0.00 -1.50 0.46 0.00 0.00 176.34 175.30 1vs8 s ILE 42 N 0.00 3.89 0.05 3.57 1.10 -1.26 -4.69 121.20 123.86 1vs8 s ILE 42 Ca 0.00 -0.99 -0.13 0.00 -0.51 0.00 0.00 60.65 59.02 1vs8 s ILE 42 Cb 0.00 -4.94 -0.07 0.00 0.15 0.00 0.00 42.46 37.60 1vs8 s ILE 42 CO 0.00 -1.79 0.29 0.35 -2.11 0.00 0.00 174.94 171.67 1vs8 n THR 43 N 6.94 0.54 -1.20 4.00 -2.24 -1.26 0.29 114.28 121.35 1vs8 n THR 43 Ca 0.38 -0.13 -0.07 0.00 -2.27 0.00 0.00 64.05 61.96 1vs8 n THR 43 Cb 0.49 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.69 1vs8 n THR 43 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1vs8 n ALA 44 N 0.21 -0.11 0.00 6.98 0.00 -1.26 -4.22 120.51 122.11 1vs8 n ALA 44 Ca 0.08 0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.63 1vs8 n ALA 44 Cb 0.08 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 18.46 1vs8 n ALA 44 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1vs8 n ASP 45 N 0.27 0.00 -4.99 0.00 2.03 0.47 -4.53 116.55 109.79 1vs8 n ASP 45 Ca -0.07 0.00 -0.21 0.00 0.52 0.00 0.00 54.79 55.03 1vs8 n ASP 45 Cb 0.28 0.00 0.04 0.00 -0.72 0.00 0.00 41.12 40.72 1vs8 n ASP 45 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 1vs8 s GLY 46 N 0.00 1.93 0.00 0.27 0.00 0.85 -4.39 107.32 105.98 1vs8 s GLY 46 Ca 0.00 -1.87 0.00 0.00 0.00 0.00 0.00 44.72 42.85 1vs8 s GLY 46 CO 0.00 -1.74 0.00 1.58 0.00 0.00 0.00 173.10 172.94 1vs8 n TYR 47 N -2.06 0.00 0.00 1.90 0.18 -1.26 -2.18 117.16 113.73 1vs8 n TYR 47 Ca 0.10 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.88 1vs8 n TYR 47 Cb 0.62 0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.58 1vs8 n TYR 47 CO 0.00 0.00 0.00 0.98 -2.08 0.00 0.00 176.86 175.76 1vs8 n TYR 48 N -0.80 0.00 0.02 -3.48 9.36 -1.26 -3.96 117.16 117.03 1vs8 n TYR 48 Ca 0.00 0.00 -0.15 0.00 3.32 0.00 0.00 57.90 61.07 1vs8 n TYR 48 Cb 0.00 -0.06 -0.14 0.00 -0.63 0.00 0.00 39.34 38.51 1vs8 n TYR 48 CO 0.00 0.00 0.00 -0.09 0.22 0.00 0.00 176.86 176.99 1vs8 h ARG 49 N 0.00 0.17 -3.63 2.98 2.43 -1.99 -3.47 114.38 110.87 1vs8 h ARG 49 Ca 0.00 -0.29 -0.23 0.00 -0.81 0.00 0.00 59.98 58.65 1vs8 h ARG 49 Cb 0.00 0.11 -0.29 0.00 -0.42 0.00 0.00 29.97 29.37 1vs8 h ARG 49 CO 0.00 0.94 -0.69 0.20 -1.51 0.00 0.00 179.97 178.91 1vs8 s GLY 50 N -5.20 -0.00 -0.05 2.80 0.00 -1.26 -5.06 107.32 98.55 1vs8 s GLY 50 Ca -0.12 0.13 -0.05 0.00 0.00 0.00 0.00 44.72 44.68 1vs8 s GLY 50 CO 0.82 0.18 0.16 -2.13 0.00 0.00 0.00 173.10 172.13 1vs8 n ARG 51 N 3.26 0.00 -3.57 2.90 0.00 -1.26 -4.73 116.66 113.26 1vs8 n ARG 51 Ca -0.15 0.00 -0.41 0.00 -0.00 0.00 0.00 57.85 57.30 1vs8 n ARG 51 Cb 0.58 -0.15 -0.09 0.00 0.00 0.00 0.00 32.46 32.80 1vs8 n ARG 51 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.63 177.84 1vs8 s LYS 52 N 0.33 2.55 0.00 -0.14 2.36 -0.93 -4.76 119.74 119.15 1vs8 s LYS 52 Ca 0.11 -1.62 0.00 0.00 -2.55 0.00 0.00 55.97 51.91 1vs8 s LYS 52 Cb -0.15 -3.87 0.00 0.00 -1.05 0.00 0.00 37.83 32.76 1vs8 s LYS 52 CO 0.08 -1.08 0.00 1.55 1.55 0.00 0.00 175.35 177.45 1vs8 n VAL 53 N 4.92 0.00 -3.75 4.02 3.14 -1.26 -4.61 118.33 120.78 1vs8 n VAL 53 Ca -0.09 0.00 -0.13 0.00 -2.96 0.00 0.00 64.34 61.16 1vs8 n VAL 53 Cb 0.42 0.00 -0.11 0.00 -1.06 0.00 0.00 33.84 33.09 1vs8 n VAL 53 CO 0.00 0.00 0.00 -0.63 -6.46 0.00 0.00 176.83 169.74 1vs8 s ILE 54 N 0.00 0.00 0.00 1.55 1.01 -1.26 -5.05 121.20 117.45 1vs8 s ILE 54 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 60.65 60.65 1vs8 s ILE 54 Cb 0.00 -0.49 0.00 0.00 0.01 0.00 0.00 42.46 41.98 1vs8 s ILE 54 CO 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 174.94 174.94 1vs8 n ALA 55 N 2.88 0.00 0.00 9.38 0.00 -1.26 -2.37 120.51 129.13 1vs8 n ALA 55 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.31 1vs8 n ALA 55 Cb 0.58 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.03 1vs8 n ALA 55 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67