#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vs6 n LYS 2 N 0.00 -1.74 0.00 0.00 5.02 -1.26 -4.50 118.16 115.68 1vs6 n LYS 2 Ca 0.00 1.20 0.00 0.00 -2.02 0.00 0.00 58.31 57.49 1vs6 n LYS 2 Cb 0.00 -2.90 0.00 0.00 -0.02 0.00 0.00 35.03 32.11 1vs6 n LYS 2 CO 0.00 0.00 0.00 -2.37 -0.52 0.00 0.00 177.40 174.51 1vs6 n THR 3 N -1.45 0.00 -1.93 -0.18 5.66 -1.26 -4.70 114.28 110.41 1vs6 n THR 3 Ca -0.16 0.00 -0.42 0.00 -3.05 0.00 0.00 64.05 60.42 1vs6 n THR 3 Cb 0.65 0.00 -0.03 0.00 -1.55 0.00 0.00 70.33 69.40 1vs6 n THR 3 CO 0.00 0.00 0.00 -0.51 -3.05 0.00 0.00 175.07 171.51 1vs6 s ILE 4 N -0.24 3.34 -0.18 1.09 2.07 -1.19 -4.01 121.20 122.07 1vs6 s ILE 4 Ca 0.00 0.53 -0.02 0.00 -1.41 0.00 0.00 60.65 59.75 1vs6 s ILE 4 Cb 0.00 -3.34 0.00 0.00 0.13 0.00 0.00 42.46 39.25 1vs6 s ILE 4 CO 0.00 -0.03 0.09 0.29 -1.91 0.00 0.00 174.94 173.38 1vs6 n LYS 5 N 6.76 -1.71 -4.34 3.50 5.02 -1.24 -4.91 118.16 121.24 1vs6 n LYS 5 Ca 0.17 1.63 -0.21 0.00 -2.02 0.00 0.00 58.31 57.88 1vs6 n LYS 5 Cb 0.42 -3.47 -0.16 0.00 -0.02 0.00 0.00 35.03 31.80 1vs6 n LYS 5 CO 0.00 0.00 0.00 0.96 -0.52 0.00 0.00 177.40 177.84 1vs6 s ILE 6 N -1.16 0.77 -0.14 -0.18 -0.00 0.20 -4.76 121.20 115.93 1vs6 s ILE 6 Ca 0.04 -0.28 -0.04 0.00 -0.00 0.00 0.00 60.65 60.36 1vs6 s ILE 6 Cb -0.01 -0.73 -0.03 0.00 -0.00 0.00 0.00 42.46 41.69 1vs6 s ILE 6 CO 0.42 0.27 0.01 0.42 -0.00 0.00 0.00 174.94 176.05 1vs6 s THR 7 N 0.66 4.34 0.50 8.37 -4.23 -1.09 0.53 115.64 124.73 1vs6 s THR 7 Ca -0.11 -0.21 -0.20 0.00 -1.18 0.00 0.00 61.69 59.99 1vs6 s THR 7 Cb -0.14 -2.90 -0.11 0.00 1.34 0.00 0.00 72.50 70.70 1vs6 s THR 7 CO 0.01 0.52 0.52 1.67 -0.54 0.00 0.00 174.62 176.80 1vs6 n GLN 8 N 3.08 0.55 0.00 3.99 7.27 -0.19 -3.49 117.38 128.59 1vs6 n GLN 8 Ca -0.18 0.21 0.00 0.00 0.07 0.00 0.00 57.00 57.10 1vs6 n GLN 8 Cb 0.53 -1.59 0.00 0.00 2.41 0.00 0.00 30.24 31.58 1vs6 n GLN 8 CO 0.00 0.00 0.00 -2.37 0.07 0.00 0.00 177.06 174.76 1vs6 n THR 9 N -1.28 0.00 -2.90 1.69 5.66 -1.26 -3.02 114.28 113.17 1vs6 n THR 9 Ca 0.11 0.00 0.03 0.00 -3.05 0.00 0.00 64.05 61.15 1vs6 n THR 9 Cb 0.44 -0.74 0.00 0.00 -1.55 0.00 0.00 70.33 68.48 1vs6 n THR 9 CO 0.00 0.00 0.00 -0.60 -3.05 0.00 0.00 175.07 171.42 1vs6 s ARG 10 N 0.00 0.10 -0.29 1.09 6.06 -1.26 -3.81 118.95 120.83 1vs6 s ARG 10 Ca 0.00 0.01 -0.16 0.00 -2.50 0.00 0.00 55.73 53.08 1vs6 s ARG 10 Cb 0.00 0.02 0.16 0.00 0.06 0.00 0.00 34.95 35.20 1vs6 s ARG 10 CO 0.00 -0.16 1.05 0.45 -2.50 0.00 0.00 175.30 174.14 1vs6 s SER 11 N 2.38 -0.40 0.00 -2.12 0.15 -1.26 -5.09 113.70 107.36 1vs6 s SER 11 Ca 0.21 0.63 0.00 0.00 0.70 0.00 0.00 55.95 57.49 1vs6 s SER 11 Cb 0.02 1.21 0.00 0.00 -1.71 0.00 0.00 66.02 65.54 1vs6 s SER 11 CO -0.18 -0.10 0.00 0.00 1.20 0.00 0.00 173.24 174.16 1vs6 n ALA 12 N 3.73 0.00 -2.62 5.45 0.00 -1.26 -4.87 120.51 120.94 1vs6 n ALA 12 Ca -0.17 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 52.87 1vs6 n ALA 12 Cb 0.57 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.94 1vs6 n ALA 12 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1vs6 s ILE 13 N 0.00 5.06 0.00 0.00 -1.09 -1.26 -4.71 121.20 119.20 1vs6 s ILE 13 Ca 0.00 0.92 0.00 0.00 -2.23 0.00 0.00 60.65 59.34 1vs6 s ILE 13 Cb 0.00 -3.84 0.00 0.00 -1.58 0.00 0.00 42.46 37.04 1vs6 s ILE 13 CO 0.00 0.09 0.00 0.61 -1.23 0.00 0.00 174.94 174.41 1vs6 n GLY 14 N 4.30 0.00 0.00 6.18 0.00 -1.26 -5.14 105.19 109.28 1vs6 n GLY 14 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 1vs6 n GLY 14 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vs6 n ARG 15 N -0.15 0.06 0.07 1.61 5.12 -1.26 -5.06 116.66 117.04 1vs6 n ARG 15 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 1vs6 n ARG 15 Cb 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.30 1vs6 n ARG 15 CO 0.00 0.00 0.00 1.28 -1.93 0.00 0.00 177.63 176.98 1vs6 n LEU 16 N 0.00 0.14 -0.00 0.55 4.32 -1.26 -4.96 117.00 115.79 1vs6 n LEU 16 Ca 0.00 0.23 0.05 0.00 -0.02 0.00 0.00 56.01 56.27 1vs6 n LEU 16 Cb 0.00 0.11 -0.07 0.00 -1.62 0.00 0.00 43.42 41.84 1vs6 n LEU 16 CO 0.00 -0.67 -0.36 -0.81 -1.22 0.00 0.00 177.39 174.33 1vs6 n PRO 17 N -3.09 1.81 0.23 3.23 -0.04 -1.26 -4.60 135.00 131.28 1vs6 n PRO 17 Ca 0.00 -0.05 0.16 0.00 -0.04 0.00 0.00 63.50 63.56 1vs6 n PRO 17 Cb 0.00 -1.13 0.78 0.00 -0.04 0.00 0.00 33.50 33.11 1vs6 n PRO 17 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 1vs6 h LYS 18 N 0.00 0.00 -0.19 0.54 1.57 -1.95 -3.12 116.57 113.41 1vs6 h LYS 18 Ca 0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1vs6 h LYS 18 Cb 0.37 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.67 1vs6 h LYS 18 CO 0.00 0.00 0.12 0.45 -0.57 0.00 0.00 179.45 179.45 1vs6 h HIS 19 N 0.00 0.25 0.00 -1.35 3.86 -1.95 0.62 115.15 116.58 1vs6 h HIS 19 Ca 0.00 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.20 1vs6 h HIS 19 Cb 0.14 -0.08 -0.00 0.00 1.06 0.00 0.00 27.41 28.53 1vs6 h HIS 19 CO 0.00 0.19 -0.04 0.87 0.86 0.00 0.00 177.93 179.81 1vs6 h LYS 20 N 0.24 0.00 0.00 2.45 1.57 -1.90 0.83 116.57 119.76 1vs6 h LYS 20 Ca 0.07 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1vs6 h LYS 20 Cb 0.01 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.32 1vs6 h LYS 20 CO -0.01 0.04 -0.16 0.00 -0.57 0.00 0.00 179.45 178.75 1vs6 n ALA 21 N -2.14 2.59 -1.96 3.86 0.00 -0.16 -1.90 120.51 120.81 1vs6 n ALA 21 Ca -0.01 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.29 1vs6 n ALA 21 Cb 0.24 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.32 1vs6 n ALA 21 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1vs6 n THR 22 N -1.81 0.00 -0.34 0.00 -2.24 0.03 -4.20 114.28 105.73 1vs6 n THR 22 Ca 0.06 0.00 0.04 0.00 -2.27 0.00 0.00 64.05 61.88 1vs6 n THR 22 Cb 0.38 0.00 0.12 0.00 -2.10 0.00 0.00 70.33 68.73 1vs6 n THR 22 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1vs6 h LEU 23 N 0.00 -0.91 -0.09 3.22 3.38 -1.62 1.36 115.31 120.65 1vs6 h LEU 23 Ca 0.00 0.28 -0.13 0.00 0.09 0.00 0.00 57.88 58.12 1vs6 h LEU 23 Cb 0.00 0.59 -0.02 0.00 0.09 0.00 0.00 40.66 41.32 1vs6 h LEU 23 CO 0.00 -0.31 -0.62 -0.07 0.09 0.00 0.00 178.44 177.53 1vs6 h LEU 24 N -0.00 0.00 0.00 1.67 3.38 -1.16 -2.88 115.31 116.31 1vs6 h LEU 24 Ca 0.44 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.41 1vs6 h LEU 24 Cb 0.68 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.43 1vs6 h LEU 24 CO -0.96 0.62 0.00 0.61 0.09 0.00 0.00 178.44 178.80 1vs6 n GLY 25 N 1.16 -0.24 0.43 0.83 0.00 0.14 -4.60 105.19 102.90 1vs6 n GLY 25 Ca 0.01 0.00 0.23 0.00 0.00 0.00 0.00 46.02 46.26 1vs6 n GLY 25 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1vs6 h LEU 26 N 0.00 0.26 -0.30 0.99 3.38 0.14 -3.46 115.31 116.32 1vs6 h LEU 26 Ca 0.00 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1vs6 h LEU 26 Cb 0.00 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.73 1vs6 h LEU 26 CO 0.00 0.09 0.00 0.61 0.09 0.00 0.00 178.44 179.23 1vs6 n GLY 27 N -1.58 0.70 3.16 0.83 0.00 -0.72 -5.01 105.19 102.57 1vs6 n GLY 27 Ca 0.20 -0.40 -0.28 0.00 0.00 0.00 0.00 46.02 45.54 1vs6 n GLY 27 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1vs6 s LEU 28 N -0.30 1.94 -0.04 0.99 1.02 -1.09 -4.92 118.68 116.28 1vs6 s LEU 28 Ca 0.00 -0.41 0.01 0.00 0.02 0.00 0.00 54.13 53.75 1vs6 s LEU 28 Cb 0.00 -1.10 0.02 0.00 0.02 0.00 0.00 46.19 45.13 1vs6 s LEU 28 CO 0.00 0.16 -0.05 -0.13 0.02 0.00 0.00 176.35 176.35 1vs6 s ARG 29 N 0.12 0.78 0.29 1.70 0.52 -1.26 -4.14 118.95 116.95 1vs6 s ARG 29 Ca -0.07 -0.12 0.00 0.00 -0.52 0.00 0.00 55.73 55.01 1vs6 s ARG 29 Cb -0.13 -0.78 0.00 0.00 0.52 0.00 0.00 34.95 34.56 1vs6 s ARG 29 CO 0.04 -0.04 0.00 0.54 0.02 0.00 0.00 175.30 175.85 1vs6 n ARG 30 N 3.86 -2.12 -0.87 3.54 1.74 -1.26 -4.47 116.66 117.07 1vs6 n ARG 30 Ca -0.24 1.63 -0.29 0.00 -0.77 0.00 0.00 57.85 58.18 1vs6 n ARG 30 Cb 0.52 -1.97 0.19 0.00 -1.02 0.00 0.00 32.46 30.17 1vs6 n ARG 30 CO 0.00 0.00 0.00 0.96 -1.52 0.00 0.00 177.63 177.07 1vs6 s ILE 31 N -4.15 2.24 0.00 0.55 -0.00 -1.26 -3.06 121.20 115.52 1vs6 s ILE 31 Ca 0.00 0.08 0.00 0.00 -0.00 0.00 0.00 60.65 60.73 1vs6 s ILE 31 Cb 0.00 -2.33 0.00 0.00 -0.00 0.00 0.00 42.46 40.13 1vs6 s ILE 31 CO 0.00 -0.10 0.00 0.61 -0.00 0.00 0.00 174.94 175.45 1vs6 n GLY 32 N -0.19 1.56 3.47 6.27 0.00 -1.17 -4.91 105.19 110.23 1vs6 n GLY 32 Ca 0.06 0.00 -0.51 0.00 0.00 0.00 0.00 46.02 45.57 1vs6 n GLY 32 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1vs6 n HIS 33 N -0.15 1.66 -3.45 1.61 -0.00 -1.17 -4.39 115.22 109.33 1vs6 n HIS 33 Ca 0.00 0.28 -0.32 0.00 -0.00 0.00 0.00 57.72 57.68 1vs6 n HIS 33 Cb 0.00 -2.53 -0.05 0.00 -0.00 0.00 0.00 29.99 27.40 1vs6 n HIS 33 CO 0.00 0.00 0.00 -0.08 -0.00 0.00 0.00 176.34 176.26 1vs6 s THR 34 N 6.91 4.96 -0.02 3.57 -1.32 -1.26 -1.02 115.64 127.47 1vs6 s THR 34 Ca 1.08 0.46 0.01 0.00 -1.21 0.00 0.00 61.69 62.03 1vs6 s THR 34 Cb -0.86 -3.63 0.01 0.00 -1.51 0.00 0.00 72.50 66.50 1vs6 s THR 34 CO 0.50 0.00 -0.03 -0.69 -2.21 0.00 0.00 174.62 172.20 1vs6 s VAL 35 N -1.73 0.31 -0.75 5.08 1.01 0.19 -4.91 120.40 119.59 1vs6 s VAL 35 Ca 0.45 -0.09 -0.05 0.00 0.00 0.00 0.00 61.98 62.28 1vs6 s VAL 35 Cb -0.12 -0.31 0.19 0.00 0.00 0.00 0.00 36.38 36.14 1vs6 s VAL 35 CO 0.21 0.12 0.62 -1.83 0.00 0.00 0.00 175.10 174.22 1vs6 s GLU 36 N 0.37 3.02 0.76 2.72 -1.05 -1.26 0.62 118.70 123.88 1vs6 s GLU 36 Ca -0.04 -2.72 -0.05 0.00 -0.15 0.00 0.00 54.97 52.02 1vs6 s GLU 36 Cb -0.07 -3.97 0.13 0.00 -0.44 0.00 0.00 34.13 29.78 1vs6 s GLU 36 CO -0.01 -1.22 1.05 0.50 0.95 0.00 0.00 175.26 176.53 1vs6 s ARG 37 N -0.36 1.59 1.25 -4.83 6.06 -1.26 -4.76 118.95 116.64 1vs6 s ARG 37 Ca 0.20 -0.82 -0.15 0.00 -2.50 0.00 0.00 55.73 52.46 1vs6 s ARG 37 Cb -0.15 -2.22 0.32 0.00 0.06 0.00 0.00 34.95 32.97 1vs6 s ARG 37 CO -0.07 -1.57 0.99 -1.21 -2.50 0.00 0.00 175.30 170.94 1vs6 s GLU 38 N -5.29 -1.60 0.00 5.12 2.02 -1.26 -3.91 118.70 113.77 1vs6 s GLU 38 Ca 0.66 0.70 0.14 0.00 0.02 0.00 0.00 54.97 56.50 1vs6 s GLU 38 Cb -0.06 -1.48 0.10 0.00 0.10 0.00 0.00 34.13 32.78 1vs6 s GLU 38 CO 0.46 -4.14 0.93 -0.40 0.02 0.00 0.00 175.26 172.12 1vs6 n ASP 39 N -5.20 2.09 -4.72 -0.19 5.75 -1.26 -3.20 116.55 109.82 1vs6 n ASP 39 Ca 0.04 -1.55 -0.35 0.00 -0.01 0.00 0.00 54.79 52.92 1vs6 n ASP 39 Cb 0.55 0.06 0.08 0.00 -1.03 0.00 0.00 41.12 40.79 1vs6 n ASP 39 CO 0.00 0.00 0.00 0.28 -0.11 0.00 0.00 177.20 177.37 1vs6 s THR 40 N -1.25 2.24 0.13 2.12 -1.32 -1.26 -4.42 115.64 111.87 1vs6 s THR 40 Ca 0.16 0.13 -0.29 0.00 -1.21 0.00 0.00 61.69 60.48 1vs6 s THR 40 Cb 0.12 -2.81 -0.06 0.00 -1.51 0.00 0.00 72.50 68.24 1vs6 s THR 40 CO 0.20 -0.05 1.60 -0.65 -2.21 0.00 0.00 174.62 173.50 1vs6 h PRO 41 N -0.03 -0.50 -0.34 7.08 0.11 -1.95 -3.24 132.00 133.14 1vs6 h PRO 41 Ca -0.49 0.03 0.12 0.00 0.11 0.00 0.00 66.00 65.78 1vs6 h PRO 41 Cb 1.31 0.11 -0.06 0.00 0.11 0.00 0.00 31.00 32.47 1vs6 h PRO 41 CO 0.51 -0.33 0.10 0.00 -0.21 0.00 0.00 178.00 178.07 1vs6 n ALA 42 N -2.85 0.27 0.17 -0.75 0.00 -1.26 0.48 120.51 116.56 1vs6 n ALA 42 Ca -0.05 0.36 0.01 0.00 0.00 0.00 0.00 53.44 53.76 1vs6 n ALA 42 Cb 0.35 -0.31 0.29 0.00 0.00 0.00 0.00 19.45 19.79 1vs6 n ALA 42 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1vs6 h ILE 43 N 0.00 1.32 -1.13 0.00 1.08 -1.93 -3.23 117.51 113.61 1vs6 h ILE 43 Ca 0.25 -1.58 0.32 0.00 -0.39 0.00 0.00 64.86 63.45 1vs6 h ILE 43 Cb 0.60 1.86 -0.08 0.00 -3.07 0.00 0.00 36.82 36.13 1vs6 h ILE 43 CO -0.29 0.45 0.77 0.08 -0.69 0.00 0.00 178.15 178.47 1vs6 h ARG 44 N 0.00 0.20 -1.01 2.37 -0.00 -0.19 -1.25 114.38 114.50 1vs6 h ARG 44 Ca -0.00 -0.01 0.27 0.00 -0.00 0.00 0.00 59.98 60.23 1vs6 h ARG 44 Cb 0.82 -0.04 -0.07 0.00 -0.00 0.00 0.00 29.97 30.68 1vs6 h ARG 44 CO 0.06 0.13 0.69 0.78 -0.00 0.00 0.00 179.97 181.63 1vs6 h GLY 45 N 0.20 0.70 0.96 0.08 0.00 -1.74 -1.48 103.07 101.79 1vs6 h GLY 45 Ca 0.61 -0.13 -0.18 0.00 0.00 0.00 0.00 47.33 47.63 1vs6 h GLY 45 CO -0.19 -0.06 -0.67 -0.33 0.00 0.00 0.00 176.54 175.28 1vs6 h MET 46 N 0.25 0.57 0.00 4.80 2.86 -1.49 -3.23 114.93 118.69 1vs6 h MET 46 Ca 0.53 -0.53 -0.03 0.00 -2.06 0.00 0.00 59.70 57.62 1vs6 h MET 46 Cb 1.62 0.13 -0.00 0.00 0.06 0.00 0.00 31.60 33.40 1vs6 h MET 46 CO -0.17 1.15 -0.13 0.82 1.06 0.00 0.00 176.91 179.64 1vs6 h ILE 47 N 0.17 0.52 -0.69 -1.22 2.04 -1.42 -2.96 117.51 113.95 1vs6 h ILE 47 Ca -0.07 -0.63 -0.01 0.00 1.00 0.00 0.00 64.86 65.15 1vs6 h ILE 47 Cb 1.34 1.42 -0.03 0.00 -0.74 0.00 0.00 36.82 38.81 1vs6 h ILE 47 CO 0.14 0.13 0.40 -1.13 0.00 0.00 0.00 178.15 177.69 1vs6 h ASN 48 N 0.00 0.85 0.22 1.72 -0.73 -1.43 0.64 115.58 116.85 1vs6 h ASN 48 Ca -0.00 -0.08 0.00 0.00 1.87 0.00 0.00 56.30 58.09 1vs6 h ASN 48 Cb 0.41 -0.21 0.00 0.00 0.27 0.00 0.00 38.32 38.79 1vs6 h ASN 48 CO 0.02 0.68 0.00 0.00 -0.37 0.00 0.00 177.43 177.76 1vs6 n ALA 49 N -2.33 1.78 -2.35 1.57 0.00 -1.12 -1.85 120.51 116.21 1vs6 n ALA 49 Ca 0.06 -0.06 0.04 0.00 0.00 0.00 0.00 53.44 53.47 1vs6 n ALA 49 Cb 0.07 -1.21 0.04 0.00 0.00 0.00 0.00 19.45 18.35 1vs6 n ALA 49 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 1vs6 n VAL 50 N -1.26 0.26 0.00 0.00 0.24 0.02 -4.95 118.33 112.64 1vs6 n VAL 50 Ca 0.06 -1.18 0.00 0.00 -2.04 0.00 0.00 64.34 61.18 1vs6 n VAL 50 Cb 0.10 0.82 0.00 0.00 -1.47 0.00 0.00 33.84 33.28 1vs6 n VAL 50 CO 0.00 0.00 0.00 -0.24 -2.14 0.00 0.00 176.83 174.45 1vs6 n SER 51 N 0.27 0.00 0.19 -1.34 2.88 0.20 0.11 113.62 115.93 1vs6 n SER 51 Ca 0.07 0.00 0.14 0.00 -1.33 0.00 0.00 58.87 57.75 1vs6 n SER 51 Cb 1.06 0.00 0.61 0.00 -0.75 0.00 0.00 64.21 65.13 1vs6 n SER 51 CO 0.00 0.00 0.00 0.15 -1.23 0.00 0.00 175.04 173.96 1vs6 h PHE 52 N 0.00 0.00 0.26 0.66 3.57 -1.88 -3.22 116.94 116.32 1vs6 h PHE 52 Ca 0.00 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.49 1vs6 h PHE 52 Cb 0.00 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.74 1vs6 h PHE 52 CO 0.00 0.00 -0.12 0.52 -2.23 0.00 0.00 178.31 176.48 1vs6 h MET 53 N 0.00 -0.33 0.00 1.11 2.86 -1.76 -3.45 114.93 113.36 1vs6 h MET 53 Ca 0.00 0.02 -0.37 0.00 -2.06 0.00 0.00 59.70 57.30 1vs6 h MET 53 Cb 0.35 0.08 0.16 0.00 0.06 0.00 0.00 31.60 32.24 1vs6 h MET 53 CO 0.00 -0.22 0.32 1.55 1.06 0.00 0.00 176.91 179.61 1vs6 n VAL 54 N -2.97 0.00 -4.70 -2.22 3.14 0.29 -4.65 118.33 107.22 1vs6 n VAL 54 Ca -0.04 -0.77 -0.23 0.00 -2.96 0.00 0.00 64.34 60.34 1vs6 n VAL 54 Cb 0.14 -1.51 -0.15 0.00 -1.06 0.00 0.00 33.84 31.25 1vs6 n VAL 54 CO 0.00 0.00 0.00 -0.54 -6.46 0.00 0.00 176.83 169.83 1vs6 s LYS 55 N -5.44 1.29 0.00 1.45 1.02 -1.23 -4.78 119.74 112.05 1vs6 s LYS 55 Ca 0.64 -0.53 0.00 0.00 0.02 0.00 0.00 55.97 56.10 1vs6 s LYS 55 Cb -0.02 -1.22 0.00 0.00 -0.52 0.00 0.00 37.83 36.07 1vs6 s LYS 55 CO 0.46 0.29 0.00 1.55 -0.92 0.00 0.00 175.35 176.73 1vs6 n VAL 56 N 2.83 0.00 0.00 3.17 3.14 -1.26 -2.67 118.33 123.54 1vs6 n VAL 56 Ca -0.15 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.23 1vs6 n VAL 56 Cb 0.54 -0.33 0.00 0.00 -1.06 0.00 0.00 33.84 33.00 1vs6 n VAL 56 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 1vs6 n GLU 57 N -1.11 0.00 0.00 1.45 -0.58 -1.26 -4.69 120.64 114.45 1vs6 n GLU 57 Ca 0.00 0.00 0.08 0.00 -0.42 0.00 0.00 57.16 56.82 1vs6 n GLU 57 Cb 0.19 0.00 0.06 0.00 -0.57 0.00 0.00 31.44 31.12 1vs6 n GLU 57 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74