#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dro n SER 2 N 0.00 -6.45 0.00 1.61 3.41 -1.26 -4.65 113.62 106.28 1dro n SER 2 Ca 0.00 -0.23 0.00 0.00 -0.26 0.00 0.00 58.87 58.38 1dro n SER 2 Cb 0.00 -3.45 0.00 0.00 -0.26 0.00 0.00 64.21 60.50 1dro n SER 2 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1dro n GLY 3 N -1.08 0.81 3.20 5.00 0.00 -1.26 -5.10 105.19 106.77 1dro n GLY 3 Ca -0.09 -0.74 -0.35 0.00 0.00 0.00 0.00 46.02 44.84 1dro n GLY 3 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1dro s THR 4 N -1.91 2.98 -1.04 2.61 2.01 -1.26 -5.05 115.64 113.98 1dro s THR 4 Ca 0.00 -1.11 -0.17 0.00 0.31 0.00 0.00 61.69 60.73 1dro s THR 4 Cb 0.00 -2.58 0.15 0.00 0.01 0.00 0.00 72.50 70.08 1dro s THR 4 CO 0.00 0.10 1.24 -0.83 -0.69 0.00 0.00 174.62 174.44 1dro s GLY 5 N 1.32 2.14 -0.19 4.40 0.00 -1.26 -4.73 107.32 108.99 1dro s GLY 5 Ca -0.01 -3.02 -0.23 0.00 0.00 0.00 0.00 44.72 41.46 1dro s GLY 5 CO -0.03 2.01 0.35 0.00 0.00 0.00 0.00 173.10 175.42 1dro h ALA 6 N 8.15 0.18 -0.15 3.20 0.00 -1.97 -3.49 119.26 125.19 1dro h ALA 6 Ca 0.22 -0.97 0.00 0.00 0.00 0.00 0.00 54.91 54.16 1dro h ALA 6 Cb 0.97 0.52 0.00 0.00 0.00 0.00 0.00 17.79 19.27 1dro h ALA 6 CO 1.15 0.49 0.00 0.41 0.00 0.00 0.00 179.25 181.30 1dro n GLY 7 N 1.49 1.87 0.00 0.00 0.00 -1.26 -4.74 105.19 102.56 1dro n GLY 7 Ca -0.25 0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.80 1dro n GLY 7 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1dro n GLU 8 N 0.00 2.20 0.00 1.61 4.71 -1.26 -5.12 120.64 122.78 1dro n GLU 8 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.15 1dro n GLU 8 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 30.43 1dro n GLU 8 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 1dro n GLY 9 N 5.00 -2.57 3.73 0.62 0.00 -1.26 -5.02 105.19 105.69 1dro n GLY 9 Ca 0.00 -0.86 -0.26 0.00 0.00 0.00 0.00 46.02 44.90 1dro n GLY 9 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1dro s HIS 10 N -0.45 2.99 -0.02 1.61 2.46 -1.09 -4.70 115.29 116.10 1dro s HIS 10 Ca 0.00 -0.08 0.01 0.00 0.47 0.00 0.00 55.06 55.47 1dro s HIS 10 Cb 0.00 -1.44 0.01 0.00 -0.13 0.00 0.00 32.58 31.01 1dro s HIS 10 CO 0.00 0.52 -0.04 -1.83 -2.47 0.00 0.00 174.74 170.92 1dro s GLU 11 N -3.01 0.52 0.03 2.88 -1.05 -1.26 -0.84 118.70 115.97 1dro s GLU 11 Ca 0.29 -0.12 -0.28 0.00 -0.15 0.00 0.00 54.97 54.71 1dro s GLU 11 Cb -0.10 -0.54 0.07 0.00 -0.44 0.00 0.00 34.13 33.12 1dro s GLU 11 CO 0.21 0.02 0.66 0.20 0.95 0.00 0.00 175.26 177.30 1dro s GLY 12 N 0.35 -0.58 -0.53 -3.83 0.00 -1.07 -4.99 107.32 96.67 1dro s GLY 12 Ca -0.04 0.99 -0.18 0.00 0.00 0.00 0.00 44.72 45.49 1dro s GLY 12 CO -0.00 0.62 0.58 -0.47 0.00 0.00 0.00 173.10 173.83 1dro s TYR 13 N -2.29 3.10 0.00 1.90 5.04 -1.26 -2.61 117.35 121.23 1dro s TYR 13 Ca -0.05 -0.84 0.00 0.00 -2.44 0.00 0.00 57.07 53.73 1dro s TYR 13 Cb -0.00 -3.64 0.00 0.00 0.35 0.00 0.00 41.96 38.67 1dro s TYR 13 CO -0.00 -1.06 0.00 1.33 -1.34 0.00 0.00 175.55 174.48 1dro n VAL 14 N 5.46 0.00 -3.50 3.14 0.24 -1.10 -4.91 118.33 117.66 1dro n VAL 14 Ca -0.10 0.00 -0.42 0.00 -2.04 0.00 0.00 64.34 61.78 1dro n VAL 14 Cb 0.43 0.00 -0.08 0.00 -1.47 0.00 0.00 33.84 32.72 1dro n VAL 14 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 1dro s THR 15 N -2.63 4.59 0.25 3.34 2.01 -1.09 -2.15 115.64 119.96 1dro s THR 15 Ca 0.00 -1.43 0.11 0.00 0.31 0.00 0.00 61.69 60.68 1dro s THR 15 Cb 0.00 -3.86 -0.05 0.00 0.01 0.00 0.00 72.50 68.60 1dro s THR 15 CO 0.00 -0.64 -0.17 -0.13 -0.69 0.00 0.00 174.62 172.99 1dro s ARG 16 N 1.48 1.76 -0.75 4.92 0.52 -0.87 -0.37 118.95 125.65 1dro s ARG 16 Ca 0.04 -1.61 0.04 0.00 -0.52 0.00 0.00 55.73 53.67 1dro s ARG 16 Cb -0.25 -1.88 0.21 0.00 0.52 0.00 0.00 34.95 33.55 1dro s ARG 16 CO 0.03 0.36 0.67 0.36 0.02 0.00 0.00 175.30 176.74 1dro n LYS 17 N -0.36 2.33 -0.97 3.54 -0.00 -1.14 -2.03 118.16 119.53 1dro n LYS 17 Ca -0.08 -4.55 -0.33 0.00 -0.00 0.00 0.00 58.31 53.36 1dro n LYS 17 Cb 0.58 -2.32 0.14 0.00 -0.00 0.00 0.00 35.03 33.44 1dro n LYS 17 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.40 175.01 1dro n HIS 18 N 1.67 1.12 0.00 5.58 1.44 -1.26 -3.90 115.22 119.87 1dro n HIS 18 Ca 0.23 0.40 0.00 0.00 -2.01 0.00 0.00 57.72 56.35 1dro n HIS 18 Cb 0.37 -2.07 0.00 0.00 0.12 0.00 0.00 29.99 28.41 1dro n HIS 18 CO 0.00 0.00 0.00 -0.85 -2.81 0.00 0.00 176.34 172.68 1dro n GLU 19 N -3.55 0.00 -2.68 -1.40 -0.00 -1.01 -4.77 120.64 107.24 1dro n GLU 19 Ca 0.13 0.00 -0.42 0.00 -0.00 0.00 0.00 57.16 56.87 1dro n GLU 19 Cb 0.51 0.00 -0.02 0.00 -0.00 0.00 0.00 31.44 31.93 1dro n GLU 19 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.13 175.55 1dro s TRP 20 N 0.00 2.84 -0.08 -1.84 0.23 -1.26 -4.88 118.94 113.94 1dro s TRP 20 Ca 0.00 -1.35 -0.31 0.00 -2.03 0.00 0.00 56.10 52.41 1dro s TRP 20 Cb 0.00 -4.60 0.12 0.00 0.03 0.00 0.00 33.47 29.02 1dro s TRP 20 CO 0.00 -1.75 1.00 0.34 0.96 0.00 0.00 176.95 177.49 1dro s ASP 21 N 4.24 -0.30 0.32 2.95 2.15 -1.26 -4.54 116.67 120.22 1dro s ASP 21 Ca 0.46 0.06 0.00 0.00 0.43 0.00 0.00 52.55 53.50 1dro s ASP 21 Cb 0.00 0.30 0.00 0.00 -0.30 0.00 0.00 42.92 42.92 1dro s ASP 21 CO -0.03 -0.47 0.00 -1.20 -0.17 0.00 0.00 175.17 173.30 1dro n SER 22 N -0.04 -4.89 -3.77 -0.34 7.64 -1.26 -4.85 113.62 106.11 1dro n SER 22 Ca -0.06 0.91 -0.30 0.00 1.01 0.00 0.00 58.87 60.43 1dro n SER 22 Cb 0.60 -2.33 0.03 0.00 -1.01 0.00 0.00 64.21 61.50 1dro n SER 22 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 1dro n THR 23 N -1.69 -4.94 -3.62 0.44 -1.04 -1.26 -4.99 114.28 97.19 1dro n THR 23 Ca 0.00 -0.81 -0.04 0.00 -2.04 0.00 0.00 64.05 61.17 1dro n THR 23 Cb 0.17 -3.79 -0.06 0.00 -1.82 0.00 0.00 70.33 64.82 1dro n THR 23 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 1dro s THR 24 N -3.61 -0.24 -0.14 12.58 -4.23 -1.26 -5.04 115.64 113.71 1dro s THR 24 Ca 0.33 0.00 0.21 0.00 -1.18 0.00 0.00 61.69 61.04 1dro s THR 24 Cb -0.12 -1.00 0.45 0.00 1.34 0.00 0.00 72.50 73.17 1dro s THR 24 CO 0.87 0.00 1.17 0.29 -0.54 0.00 0.00 174.62 176.41 1dro n LYS 25 N 4.44 1.11 -3.50 3.99 4.76 -1.26 -5.01 118.16 122.68 1dro n LYS 25 Ca -0.17 -2.85 -0.24 0.00 -2.87 0.00 0.00 58.31 52.18 1dro n LYS 25 Cb 0.56 -0.95 0.05 0.00 -1.84 0.00 0.00 35.03 32.86 1dro n LYS 25 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1dro n LYS 26 N -0.20 -1.99 0.00 1.97 4.76 -1.26 -4.96 118.16 116.47 1dro n LYS 26 Ca 0.13 0.64 0.00 0.00 -2.87 0.00 0.00 58.31 56.21 1dro n LYS 26 Cb 0.96 -4.93 0.00 0.00 -1.84 0.00 0.00 35.03 29.22 1dro n LYS 26 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1dro n ALA 27 N -3.80 0.00 -3.97 7.82 0.00 -1.26 -4.95 120.51 114.35 1dro n ALA 27 Ca -0.10 -0.22 -0.33 0.00 0.00 0.00 0.00 53.44 52.79 1dro n ALA 27 Cb 0.61 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.91 1dro n ALA 27 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1dro s SER 28 N -3.75 4.05 -0.57 0.00 0.01 -1.26 -5.06 113.70 107.12 1dro s SER 28 Ca 0.00 -1.03 -0.26 0.00 1.31 0.00 0.00 55.95 55.97 1dro s SER 28 Cb 0.00 -1.57 -0.09 0.00 0.21 0.00 0.00 66.02 64.58 1dro s SER 28 CO 0.00 -0.12 2.40 0.54 0.41 0.00 0.00 173.24 176.47 1dro s ASN 29 N 1.22 4.30 -0.11 2.44 4.22 -1.26 -4.73 114.94 121.03 1dro s ASN 29 Ca -0.02 0.79 -0.03 0.00 -2.14 0.00 0.00 52.86 51.46 1dro s ASN 29 Cb -0.17 -2.51 -0.26 0.00 1.28 0.00 0.00 41.25 39.59 1dro s ASN 29 CO -0.07 -3.14 0.42 0.54 -2.04 0.00 0.00 177.10 172.81 1dro n ARG 30 N 8.97 0.74 0.00 3.55 1.74 -1.26 -5.07 116.66 125.32 1dro n ARG 30 Ca 0.39 0.27 0.00 0.00 -0.77 0.00 0.00 57.85 57.74 1dro n ARG 30 Cb 0.52 -1.72 0.00 0.00 -1.02 0.00 0.00 32.46 30.24 1dro n ARG 30 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1dro n SER 31 N -3.39 -0.06 -4.71 0.55 7.64 -1.26 -4.87 113.62 107.52 1dro n SER 31 Ca -0.29 0.00 -0.34 0.00 1.01 0.00 0.00 58.87 59.25 1dro n SER 31 Cb 1.05 0.00 0.11 0.00 -1.01 0.00 0.00 64.21 64.35 1dro n SER 31 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 1dro s TRP 32 N 0.00 1.97 0.23 1.43 0.52 -1.26 -5.02 118.94 116.81 1dro s TRP 32 Ca 0.00 1.63 0.10 0.00 0.02 0.00 0.00 56.10 57.85 1dro s TRP 32 Cb 0.00 -3.47 -0.04 0.00 -1.15 0.00 0.00 33.47 28.81 1dro s TRP 32 CO 0.00 -2.68 -0.13 -0.51 0.02 0.00 0.00 176.95 173.65 1dro s ASP 33 N -2.12 4.00 -0.36 2.95 1.01 -0.86 -4.99 116.67 116.31 1dro s ASP 33 Ca 0.73 -0.77 -0.12 0.00 0.71 0.00 0.00 52.55 53.11 1dro s ASP 33 Cb -0.29 -0.56 0.00 0.00 1.01 0.00 0.00 42.92 43.09 1dro s ASP 33 CO 0.48 0.06 0.23 -0.54 0.21 0.00 0.00 175.17 175.61 1dro s LYS 34 N -3.19 3.23 0.17 8.23 1.02 -1.26 -2.04 119.74 125.90 1dro s LYS 34 Ca 0.27 -0.82 0.00 0.00 0.02 0.00 0.00 55.97 55.45 1dro s LYS 34 Cb -0.07 -3.78 -0.04 0.00 -0.52 0.00 0.00 37.83 33.41 1dro s LYS 34 CO 0.15 -0.55 0.04 0.14 -0.92 0.00 0.00 175.35 174.21 1dro s VAL 35 N 1.66 0.40 -0.89 3.17 -7.23 -0.91 -4.91 120.40 111.69 1dro s VAL 35 Ca 0.05 -1.96 -0.11 0.00 -1.81 0.00 0.00 61.98 58.15 1dro s VAL 35 Cb -0.18 -2.18 0.23 0.00 0.56 0.00 0.00 36.38 34.81 1dro s VAL 35 CO 0.09 -0.38 0.83 -0.47 -0.31 0.00 0.00 175.10 174.85 1dro s TYR 36 N -3.85 3.87 0.56 2.82 6.14 0.30 -2.70 117.35 124.48 1dro s TYR 36 Ca 0.27 -2.29 0.07 0.00 0.64 0.00 0.00 57.07 55.75 1dro s TYR 36 Cb 0.07 -3.74 0.07 0.00 0.42 0.00 0.00 41.96 38.77 1dro s TYR 36 CO 0.05 -0.95 0.76 -1.64 0.64 0.00 0.00 175.55 174.41 1dro s MET 37 N -0.30 2.36 -0.47 4.97 -1.94 -1.07 -2.50 119.30 120.34 1dro s MET 37 Ca 0.22 -1.36 0.06 0.00 -1.71 0.00 0.00 55.69 52.89 1dro s MET 37 Cb -0.11 -2.61 0.28 0.00 2.01 0.00 0.00 34.83 34.41 1dro s MET 37 CO -0.08 -0.79 1.00 0.00 -0.01 0.00 0.00 175.02 175.14 1dro n ALA 38 N -2.25 -0.98 -3.60 3.03 0.00 0.04 -2.61 120.51 114.14 1dro n ALA 38 Ca 0.13 -1.50 -0.09 0.00 0.00 0.00 0.00 53.44 51.99 1dro n ALA 38 Cb 0.61 -1.23 -0.02 0.00 0.00 0.00 0.00 19.45 18.80 1dro n ALA 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1dro s ALA 39 N 0.40 -0.70 0.00 0.00 0.00 -0.02 -1.98 121.76 119.46 1dro s ALA 39 Ca 0.27 -0.66 0.00 0.00 0.00 0.00 0.00 51.96 51.57 1dro s ALA 39 Cb 0.26 0.88 0.00 0.00 0.00 0.00 0.00 23.12 24.27 1dro s ALA 39 CO -0.14 -0.96 0.00 0.36 0.00 0.00 0.00 175.76 175.01 1dro n LYS 40 N -0.47 0.00 -2.54 0.00 2.85 -1.26 -2.67 118.16 114.08 1dro n LYS 40 Ca -0.04 0.00 -0.02 0.00 -1.05 0.00 0.00 58.31 57.20 1dro n LYS 40 Cb 0.60 0.00 0.11 0.00 -0.65 0.00 0.00 35.03 35.09 1dro n LYS 40 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1dro n ALA 41 N -1.98 2.96 0.00 0.58 0.00 -1.26 -4.84 120.51 115.96 1dro n ALA 41 Ca 0.00 -1.08 0.00 0.00 0.00 0.00 0.00 53.44 52.36 1dro n ALA 41 Cb 0.00 -0.79 0.00 0.00 0.00 0.00 0.00 19.45 18.66 1dro n ALA 41 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1dro n GLY 42 N -1.37 -0.01 3.57 0.00 0.00 -0.64 -0.48 105.19 106.26 1dro n GLY 42 Ca -0.17 -0.06 -0.13 0.00 0.00 0.00 0.00 46.02 45.66 1dro n GLY 42 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1dro s ARG 43 N -1.31 0.75 0.14 1.61 0.52 -1.26 0.45 118.95 119.85 1dro s ARG 43 Ca 0.00 0.97 0.04 0.00 -0.52 0.00 0.00 55.73 56.22 1dro s ARG 43 Cb 0.00 0.32 -0.04 0.00 0.52 0.00 0.00 34.95 35.75 1dro s ARG 43 CO 0.00 -0.10 0.12 0.42 0.02 0.00 0.00 175.30 175.76 1dro s ILE 44 N 0.62 4.53 -0.14 1.52 1.09 -0.81 -3.98 121.20 124.03 1dro s ILE 44 Ca -0.02 -0.97 -0.04 0.00 -1.10 0.00 0.00 60.65 58.52 1dro s ILE 44 Cb -0.05 -3.27 0.07 0.00 -1.06 0.00 0.00 42.46 38.15 1dro s ILE 44 CO -0.03 -0.03 0.23 -0.55 -0.10 0.00 0.00 174.94 174.45 1dro s SER 45 N -2.88 0.74 -0.04 3.58 0.15 -0.84 -2.53 113.70 111.88 1dro s SER 45 Ca 0.31 0.29 0.02 0.00 0.70 0.00 0.00 55.95 57.26 1dro s SER 45 Cb -0.11 0.52 -0.03 0.00 -1.71 0.00 0.00 66.02 64.69 1dro s SER 45 CO 0.23 -0.27 -0.07 -0.36 1.20 0.00 0.00 173.24 173.97 1dro s PHE 46 N 2.37 2.91 -0.30 3.44 0.08 -1.12 -0.78 117.98 124.57 1dro s PHE 46 Ca 0.04 -0.01 -0.08 0.00 0.12 0.00 0.00 56.93 57.00 1dro s PHE 46 Cb -0.13 -1.67 0.15 0.00 -0.57 0.00 0.00 43.02 40.79 1dro s PHE 46 CO -0.09 0.34 0.64 1.52 -0.10 0.00 0.00 175.22 177.53 1dro s TYR 47 N -0.87 -1.41 0.26 0.36 1.13 -1.04 -4.57 117.35 111.21 1dro s TYR 47 Ca 0.14 2.18 -0.03 0.00 -1.41 0.00 0.00 57.07 57.95 1dro s TYR 47 Cb -0.11 0.75 0.42 0.00 -1.10 0.00 0.00 41.96 41.92 1dro s TYR 47 CO 0.03 -0.72 1.84 0.87 -2.51 0.00 0.00 175.55 175.06 1dro h LYS 48 N 8.00 0.93 0.00 -3.49 1.57 -1.86 0.86 116.57 122.58 1dro h LYS 48 Ca -0.19 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.53 1dro h LYS 48 Cb 1.12 -0.21 0.00 0.00 0.08 0.00 0.00 32.23 33.22 1dro h LYS 48 CO 0.14 0.62 0.00 -0.25 -0.57 0.00 0.00 179.45 179.39 1dro n ASP 49 N -4.64 0.00 0.15 0.86 8.00 -1.26 -2.44 116.55 117.21 1dro n ASP 49 Ca 0.15 0.00 0.13 0.00 0.71 0.00 0.00 54.79 55.78 1dro n ASP 49 Cb 0.25 0.00 0.49 0.00 -0.02 0.00 0.00 41.12 41.85 1dro n ASP 49 CO 0.00 0.00 0.00 1.56 -0.39 0.00 0.00 177.20 178.37 1dro h GLN 50 N 0.00 0.00 -0.39 -1.24 1.08 -1.97 -3.40 115.11 109.19 1dro h GLN 50 Ca 0.00 0.00 0.04 0.00 -1.45 0.00 0.00 58.65 57.24 1dro h GLN 50 Cb 0.00 0.00 -0.05 0.00 -0.05 0.00 0.00 27.48 27.38 1dro h GLN 50 CO 0.00 0.00 -0.23 0.36 -0.95 0.00 0.00 178.83 178.01 1dro n LYS 51 N -2.36 -0.17 0.26 1.46 2.85 -1.26 0.18 118.16 119.12 1dro n LYS 51 Ca 0.03 1.19 -0.16 0.00 -1.05 0.00 0.00 58.31 58.32 1dro n LYS 51 Cb 0.28 -1.77 -0.08 0.00 -0.65 0.00 0.00 35.03 32.80 1dro n LYS 51 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 177.40 178.13 1dro h GLY 52 N 0.00 -0.66 -1.32 2.58 0.00 -1.77 -1.15 103.07 100.75 1dro h GLY 52 Ca 0.06 0.25 0.47 0.00 0.00 0.00 0.00 47.33 48.11 1dro h GLY 52 CO -0.37 -0.24 1.05 -0.97 0.00 0.00 0.00 176.54 176.01 1dro h TYR 53 N -0.74 0.28 0.28 5.60 -1.99 -1.32 0.38 116.97 119.46 1dro h TYR 53 Ca -0.07 0.01 -0.01 0.00 2.00 0.00 0.00 58.73 60.66 1dro h TYR 53 Cb 0.54 -0.07 0.00 0.00 2.00 0.00 0.00 36.73 39.20 1dro h TYR 53 CO -0.02 -0.11 -0.13 -0.22 -0.00 0.00 0.00 178.16 177.68 1dro h LYS 54 N 0.05 -0.36 0.23 4.88 3.64 0.31 -3.34 116.57 121.99 1dro h LYS 54 Ca 0.83 0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 60.23 1dro h LYS 54 Cb 2.95 0.08 0.00 0.00 -0.41 0.00 0.00 32.23 34.85 1dro h LYS 54 CO -0.23 -0.09 -0.11 0.77 -2.27 0.00 0.00 179.45 177.51 1dro h SER 55 N -0.60 -0.26 -4.32 4.20 0.02 -0.80 -3.47 113.55 108.33 1dro h SER 55 Ca -0.04 0.01 -0.47 0.00 -0.84 0.00 0.00 61.79 60.46 1dro h SER 55 Cb 0.43 0.07 -0.24 0.00 0.14 0.00 0.00 62.40 62.79 1dro h SER 55 CO 0.06 -0.10 -0.80 0.20 -1.14 0.00 0.00 176.83 175.05 1dro s ASN 56 N -3.30 1.81 0.35 3.07 0.01 -0.07 -5.05 114.94 111.76 1dro s ASN 56 Ca -0.05 -0.49 0.16 0.00 -0.71 0.00 0.00 52.86 51.78 1dro s ASN 56 Cb 0.00 -0.12 0.58 0.00 0.41 0.00 0.00 41.25 42.13 1dro s ASN 56 CO 0.14 0.04 1.70 1.55 -1.51 0.00 0.00 177.10 179.02 1dro h PRO 57 N 4.84 0.00 0.00 -0.60 0.13 -1.78 -3.06 132.00 131.52 1dro h PRO 57 Ca -0.39 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 1dro h PRO 57 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1dro h PRO 57 CO 0.43 0.44 -1.09 -0.85 -0.23 0.00 0.00 178.00 176.70 1dro n GLU 58 N -3.61 0.51 -3.87 0.86 0.28 -1.26 -4.69 120.64 108.85 1dro n GLU 58 Ca -0.00 0.05 -0.33 0.00 -0.16 0.00 0.00 57.16 56.71 1dro n GLU 58 Cb 0.54 -1.73 -0.13 0.00 1.43 0.00 0.00 31.44 31.56 1dro n GLU 58 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 1dro s LEU 59 N -4.84 4.88 0.00 -1.84 1.43 -1.19 -4.89 118.68 112.24 1dro s LEU 59 Ca 0.00 -2.51 0.00 0.00 -1.03 0.00 0.00 54.13 50.59 1dro s LEU 59 Cb 0.12 -1.74 0.00 0.00 0.03 0.00 0.00 46.19 44.60 1dro s LEU 59 CO 0.80 -0.38 0.00 0.35 0.23 0.00 0.00 176.35 177.35 1dro n THR 60 N 3.86 0.00 -1.56 5.49 -2.24 -1.26 -3.54 114.28 115.03 1dro n THR 60 Ca 0.04 0.00 -0.38 0.00 -2.27 0.00 0.00 64.05 61.44 1dro n THR 60 Cb 0.38 -1.72 0.05 0.00 -2.10 0.00 0.00 70.33 66.93 1dro n THR 60 CO 0.00 0.00 0.00 2.22 -0.57 0.00 0.00 175.07 176.72 1dro n PHE 61 N 0.00 0.26 0.10 4.78 -1.74 -1.26 -4.40 117.46 115.19 1dro n PHE 61 Ca 0.00 0.44 0.04 0.00 -0.56 0.00 0.00 57.45 57.38 1dro n PHE 61 Cb 0.00 -2.07 0.23 0.00 1.52 0.00 0.00 39.48 39.16 1dro n PHE 61 CO 0.00 0.00 0.00 0.54 -0.56 0.00 0.00 176.76 176.74 1dro n ARG 62 N -0.60 0.06 -1.90 3.97 1.74 -1.26 0.57 116.66 119.24 1dro n ARG 62 Ca 0.13 0.47 -0.36 0.00 -0.77 0.00 0.00 57.85 57.32 1dro n ARG 62 Cb 0.47 -1.92 -0.02 0.00 -1.02 0.00 0.00 32.46 29.97 1dro n ARG 62 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1dro n GLY 63 N -1.29 5.07 0.14 -0.13 0.00 -1.26 -4.72 105.19 102.99 1dro n GLY 63 Ca -0.01 -2.11 -0.22 0.00 0.00 0.00 0.00 46.02 43.68 1dro n GLY 63 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1dro h GLU 64 N 3.81 0.36 -2.34 1.61 4.11 -0.11 -3.40 114.58 118.62 1dro h GLU 64 Ca 0.56 -0.62 -0.20 0.00 0.07 0.00 0.00 59.36 59.16 1dro h GLU 64 Cb 0.42 0.23 0.10 0.00 0.50 0.00 0.00 28.75 30.00 1dro h GLU 64 CO 1.22 1.28 -0.90 -2.30 0.07 0.00 0.00 179.01 178.37 1dro n PRO 65 N -3.56 0.00 -4.13 1.06 -0.02 -1.26 -3.13 135.00 123.96 1dro n PRO 65 Ca -0.24 0.00 -0.16 0.00 -2.02 0.00 0.00 63.50 61.08 1dro n PRO 65 Cb 1.07 -0.39 -0.15 0.00 -0.02 0.00 0.00 33.50 34.01 1dro n PRO 65 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 1dro s SER 66 N -0.39 0.59 0.47 2.55 0.01 -1.26 -2.81 113.70 112.86 1dro s SER 66 Ca 0.15 -0.09 0.05 0.00 1.31 0.00 0.00 55.95 57.37 1dro s SER 66 Cb -0.01 -0.10 -0.03 0.00 0.21 0.00 0.00 66.02 66.09 1dro s SER 66 CO 0.29 0.04 0.14 -0.31 0.41 0.00 0.00 173.24 173.81 1dro s TYR 67 N 0.03 2.19 -0.53 2.43 2.02 -1.05 -4.84 117.35 117.61 1dro s TYR 67 Ca 0.00 -0.76 0.07 0.00 -0.37 0.00 0.00 57.07 56.01 1dro s TYR 67 Cb -0.04 -1.82 0.27 0.00 -0.40 0.00 0.00 41.96 39.97 1dro s TYR 67 CO -0.00 0.12 0.69 -3.47 -1.57 0.00 0.00 175.55 171.31 1dro n ASP 68 N -1.30 2.38 -3.71 2.29 -0.08 -1.26 -1.92 116.55 112.95 1dro n ASP 68 Ca -0.07 -3.18 -0.41 0.00 -1.51 0.00 0.00 54.79 49.62 1dro n ASP 68 Cb 0.66 -0.64 0.00 0.00 2.34 0.00 0.00 41.12 43.47 1dro n ASP 68 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1dro n LEU 69 N 0.87 7.24 -1.49 -2.67 4.77 0.17 -4.60 117.00 121.30 1dro n LEU 69 Ca 0.27 -4.81 -0.03 0.00 -0.03 0.00 0.00 56.01 51.41 1dro n LEU 69 Cb 0.47 -1.41 0.19 0.00 -2.33 0.00 0.00 43.42 40.34 1dro n LEU 69 CO 0.31 1.70 0.76 0.00 -1.33 0.00 0.00 177.39 178.83 1dro n GLN 70 N 2.70 2.70 -0.04 3.23 10.64 -1.23 -1.62 117.38 133.75 1dro n GLN 70 Ca 0.48 -1.83 -0.04 0.00 -1.83 0.00 0.00 57.00 53.77 1dro n GLN 70 Cb 0.31 -1.85 -0.04 0.00 -0.86 0.00 0.00 30.24 27.79 1dro n GLN 70 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 1dro n ASN 71 N 0.04 3.43 -4.70 2.61 5.03 -1.26 -3.88 115.26 116.52 1dro n ASN 71 Ca 0.24 -0.03 -0.30 0.00 0.87 0.00 0.00 54.58 55.36 1dro n ASN 71 Cb 0.97 0.18 0.14 0.00 -1.02 0.00 0.00 39.78 40.04 1dro n ASN 71 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1dro s ALA 72 N -2.15 1.60 0.09 5.41 0.00 -1.26 -4.65 121.76 120.79 1dro s ALA 72 Ca -0.08 0.23 0.00 0.00 0.00 0.00 0.00 51.96 52.12 1dro s ALA 72 Cb 0.02 -3.30 0.00 0.00 0.00 0.00 0.00 23.12 19.84 1dro s ALA 72 CO 0.21 -2.39 0.00 0.00 0.00 0.00 0.00 175.76 173.57 1dro n ALA 73 N -3.95 0.00 -3.03 0.00 0.00 0.21 -2.72 120.51 111.02 1dro n ALA 73 Ca 0.09 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.42 1dro n ALA 73 Cb 0.53 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.87 1dro n ALA 73 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1dro s ILE 74 N 1.55 0.05 0.13 0.00 1.01 -1.26 -2.46 121.20 120.22 1dro s ILE 74 Ca 0.00 -0.44 -0.25 0.00 0.00 0.00 0.00 60.65 59.96 1dro s ILE 74 Cb 0.00 -0.29 0.08 0.00 0.01 0.00 0.00 42.46 42.26 1dro s ILE 74 CO 0.00 -0.24 1.06 -0.70 0.00 0.00 0.00 174.94 175.05 1dro s GLU 75 N -0.78 1.07 -0.45 2.79 2.12 0.27 -4.92 118.70 118.80 1dro s GLU 75 Ca -0.09 -0.64 0.04 0.00 0.36 0.00 0.00 54.97 54.64 1dro s GLU 75 Cb -0.05 0.34 0.12 0.00 0.26 0.00 0.00 34.13 34.79 1dro s GLU 75 CO 0.00 -0.50 0.18 0.42 -0.54 0.00 0.00 175.26 174.83 1dro s ILE 76 N -2.71 2.34 0.00 -3.70 1.01 -1.26 0.28 121.20 117.16 1dro s ILE 76 Ca 0.17 -2.88 0.00 0.00 0.00 0.00 0.00 60.65 57.94 1dro s ILE 76 Cb -0.01 -2.66 0.00 0.00 0.01 0.00 0.00 42.46 39.80 1dro s ILE 76 CO 0.02 -0.74 0.00 0.00 0.00 0.00 0.00 174.94 174.23 1dro n ALA 77 N 3.58 0.00 0.00 9.38 0.00 -1.24 -4.96 120.51 127.27 1dro n ALA 77 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.49 1dro n ALA 77 Cb 0.36 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.81 1dro n ALA 77 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1dro n SER 78 N -3.50 0.00 -3.31 0.00 2.88 -1.26 -5.01 113.62 103.42 1dro n SER 78 Ca 0.00 0.00 -0.25 0.00 -1.33 0.00 0.00 58.87 57.29 1dro n SER 78 Cb 0.00 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.38 1dro n SER 78 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 1dro n ASP 79 N 0.00 1.27 -4.96 -3.46 2.03 -1.26 -5.12 116.55 105.04 1dro n ASP 79 Ca 0.00 -2.90 -0.22 0.00 0.52 0.00 0.00 54.79 52.19 1dro n ASP 79 Cb 0.00 -0.65 0.01 0.00 -0.72 0.00 0.00 41.12 39.76 1dro n ASP 79 CO 0.00 0.00 0.00 -0.72 -1.92 0.00 0.00 177.20 174.56 1dro s TYR 80 N -1.44 3.17 -0.44 -0.67 -0.85 -1.26 -5.05 117.35 110.81 1dro s TYR 80 Ca 0.36 0.10 0.05 0.00 -0.52 0.00 0.00 57.07 57.06 1dro s TYR 80 Cb 0.14 -2.27 0.18 0.00 0.38 0.00 0.00 41.96 40.39 1dro s TYR 80 CO -0.09 -0.31 0.46 -0.08 -1.52 0.00 0.00 175.55 174.01 1dro s THR 81 N -2.47 -0.10 -0.63 -3.49 -1.32 -1.26 -4.78 115.64 101.58 1dro s THR 81 Ca 0.48 -2.09 0.00 0.00 -1.21 0.00 0.00 61.69 58.87 1dro s THR 81 Cb -0.10 -0.84 0.00 0.00 -1.51 0.00 0.00 72.50 70.05 1dro s THR 81 CO 0.36 -0.83 0.00 0.29 -2.21 0.00 0.00 174.62 172.23 1dro n LYS 82 N 2.90 -0.52 -0.01 7.08 5.02 -1.26 -4.90 118.16 126.48 1dro n LYS 82 Ca 0.26 0.47 0.01 0.00 -2.02 0.00 0.00 58.31 57.03 1dro n LYS 82 Cb 0.50 -4.32 0.01 0.00 -0.02 0.00 0.00 35.03 31.20 1dro n LYS 82 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1dro n LYS 83 N -2.06 0.67 0.00 1.97 5.02 -1.26 -4.68 118.16 117.82 1dro n LYS 83 Ca -0.08 -0.95 0.00 0.00 -2.02 0.00 0.00 58.31 55.26 1dro n LYS 83 Cb 0.44 -1.02 0.00 0.00 -0.02 0.00 0.00 35.03 34.43 1dro n LYS 83 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 1dro n LYS 84 N -0.12 0.46 -1.36 1.97 0.00 -1.26 -2.24 118.16 115.59 1dro n LYS 84 Ca 0.01 0.00 -0.19 0.00 0.00 0.00 0.00 58.31 58.13 1dro n LYS 84 Cb 0.12 -1.02 0.11 0.00 0.00 0.00 0.00 35.03 34.24 1dro n LYS 84 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.40 178.12 1dro n HIS 85 N -0.43 2.23 -4.45 5.64 8.25 -1.26 -5.02 115.22 120.18 1dro n HIS 85 Ca 0.00 -2.17 -0.26 0.00 -0.26 0.00 0.00 57.72 55.04 1dro n HIS 85 Cb 0.01 -0.69 -0.13 0.00 1.12 0.00 0.00 29.99 30.30 1dro n HIS 85 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 1dro s VAL 86 N -4.08 1.84 0.22 1.59 0.11 -0.95 -4.54 120.40 114.58 1dro s VAL 86 Ca 0.52 -1.49 0.08 0.00 -2.93 0.00 0.00 61.98 58.16 1dro s VAL 86 Cb 0.44 -1.64 -0.04 0.00 -1.53 0.00 0.00 36.38 33.61 1dro s VAL 86 CO 0.01 0.07 0.04 -1.48 -3.33 0.00 0.00 175.10 170.41 1dro s LEU 87 N -1.70 3.38 -0.27 2.54 0.05 -0.67 -3.68 118.68 118.33 1dro s LEU 87 Ca 0.09 -0.44 -0.09 0.00 0.05 0.00 0.00 54.13 53.73 1dro s LEU 87 Cb -0.10 -1.97 0.12 0.00 -2.05 0.00 0.00 46.19 42.19 1dro s LEU 87 CO 0.04 0.04 0.58 -0.60 -0.55 0.00 0.00 176.35 175.85 1dro s ARG 88 N -3.34 0.50 -0.23 1.48 3.52 0.14 0.71 118.95 121.73 1dro s ARG 88 Ca 0.30 1.32 -0.08 0.00 -0.13 0.00 0.00 55.73 57.14 1dro s ARG 88 Cb -0.08 0.69 -0.04 0.00 -1.56 0.00 0.00 34.95 33.96 1dro s ARG 88 CO 0.20 -0.21 0.08 0.54 -0.81 0.00 0.00 175.30 175.10 1dro s VAL 89 N 2.77 4.61 -0.08 7.11 0.11 -1.09 0.94 120.40 134.77 1dro s VAL 89 Ca -0.05 -0.08 -0.04 0.00 -2.93 0.00 0.00 61.98 58.88 1dro s VAL 89 Cb -0.12 -3.13 -0.04 0.00 -1.53 0.00 0.00 36.38 31.56 1dro s VAL 89 CO -0.17 0.37 0.11 -0.75 -3.33 0.00 0.00 175.10 171.32 1dro s LYS 90 N 1.21 3.28 0.46 1.54 2.20 -1.03 -2.63 119.74 124.77 1dro s LYS 90 Ca 0.05 -0.28 0.05 0.00 -0.36 0.00 0.00 55.97 55.43 1dro s LYS 90 Cb -0.14 -3.03 0.08 0.00 -1.51 0.00 0.00 37.83 33.22 1dro s LYS 90 CO 0.04 0.73 0.63 1.28 -0.36 0.00 0.00 175.35 177.67 1dro n LEU 91 N 1.72 0.00 -0.00 5.43 4.77 -1.22 -0.62 117.00 127.09 1dro n LEU 91 Ca -0.17 -1.74 0.06 0.00 -0.03 0.00 0.00 56.01 54.13 1dro n LEU 91 Cb 0.54 -0.36 -0.07 0.00 -2.33 0.00 0.00 43.42 41.20 1dro n LEU 91 CO 0.34 -0.72 -0.06 0.00 -1.33 0.00 0.00 177.39 175.62 1dro n ALA 92 N -2.65 3.54 0.19 -1.18 0.00 -1.26 -4.42 120.51 114.73 1dro n ALA 92 Ca -0.11 -0.34 0.06 0.00 0.00 0.00 0.00 53.44 53.06 1dro n ALA 92 Cb 0.44 -0.44 0.30 0.00 0.00 0.00 0.00 19.45 19.75 1dro n ALA 92 CO 0.00 0.00 0.00 -2.95 0.00 0.00 0.00 177.50 174.55 1dro h ASN 93 N 0.00 0.00 0.00 0.00 7.08 -2.03 -3.47 115.58 117.16 1dro h ASN 93 Ca 0.00 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.22 1dro h ASN 93 Cb 0.30 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.54 1dro h ASN 93 CO 0.00 0.35 0.00 0.61 -2.08 0.00 0.00 177.43 176.31 1dro n GLY 94 N 0.44 4.30 3.78 9.14 0.00 -1.26 -5.11 105.19 116.49 1dro n GLY 94 Ca 0.00 -0.79 -0.36 0.00 0.00 0.00 0.00 46.02 44.87 1dro n GLY 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1dro s ALA 95 N 0.00 3.08 0.30 4.61 0.00 -1.26 -4.83 121.76 123.65 1dro s ALA 95 Ca 0.00 0.68 0.03 0.00 0.00 0.00 0.00 51.96 52.67 1dro s ALA 95 Cb 0.00 -3.26 -0.06 0.00 0.00 0.00 0.00 23.12 19.80 1dro s ALA 95 CO 0.00 -0.20 0.06 -0.48 0.00 0.00 0.00 175.76 175.15 1dro s LEU 96 N -2.69 2.04 -0.45 0.00 0.05 -1.26 -3.41 118.68 112.96 1dro s LEU 96 Ca 0.58 -1.37 0.02 0.00 0.05 0.00 0.00 54.13 53.42 1dro s LEU 96 Cb -0.21 -0.27 0.14 0.00 -2.05 0.00 0.00 46.19 43.80 1dro s LEU 96 CO 0.27 -0.63 0.26 -0.36 -0.55 0.00 0.00 176.35 175.33 1dro s PHE 97 N -3.42 1.97 0.52 3.48 0.08 -1.08 -2.39 117.98 117.13 1dro s PHE 97 Ca 0.36 -2.44 -0.17 0.00 0.12 0.00 0.00 56.93 54.81 1dro s PHE 97 Cb 0.08 -1.84 -0.08 0.00 -0.57 0.00 0.00 43.02 40.62 1dro s PHE 97 CO 0.15 -0.77 1.00 -0.51 -0.10 0.00 0.00 175.22 174.98 1dro s LEU 98 N 0.27 3.64 -0.15 -0.37 2.01 -1.25 -2.67 118.68 120.15 1dro s LEU 98 Ca 0.19 1.64 -0.04 0.00 0.01 0.00 0.00 54.13 55.92 1dro s LEU 98 Cb -0.22 -4.52 0.06 0.00 0.01 0.00 0.00 46.19 41.52 1dro s LEU 98 CO -0.02 -0.67 0.08 -0.76 1.01 0.00 0.00 176.35 176.00 1dro s LEU 99 N -4.03 0.36 -0.75 1.79 1.43 0.22 -2.86 118.68 114.84 1dro s LEU 99 Ca 0.60 -0.52 -0.08 0.00 -1.03 0.00 0.00 54.13 53.10 1dro s LEU 99 Cb -0.11 -0.25 0.20 0.00 0.03 0.00 0.00 46.19 46.06 1dro s LEU 99 CO 0.30 -0.33 0.63 -1.58 0.23 0.00 0.00 176.35 175.60 1dro s GLN 100 N 2.13 3.15 0.00 1.70 0.74 0.50 -1.67 119.66 126.21 1dro s GLN 100 Ca 0.02 -2.57 0.00 0.00 0.05 0.00 0.00 55.36 52.86 1dro s GLN 100 Cb -0.15 -4.10 0.00 0.00 1.10 0.00 0.00 33.01 29.86 1dro s GLN 100 CO -0.08 -1.24 0.00 0.00 -0.55 0.00 0.00 175.29 173.42 1dro n ALA 101 N 3.61 0.00 -1.16 1.58 0.00 -1.26 -2.67 120.51 120.62 1dro n ALA 101 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.56 1dro n ALA 101 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.87 1dro n ALA 101 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1dro n HIS 102 N -1.05 0.00 -0.53 0.00 8.25 -1.26 -4.89 115.22 115.74 1dro n HIS 102 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1dro n HIS 102 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 1dro n HIS 102 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 1dro n ASP 103 N -0.05 0.00 -0.01 0.41 8.00 -1.26 -4.91 116.55 118.72 1dro n ASP 103 Ca 0.00 0.00 0.04 0.00 0.71 0.00 0.00 54.79 55.54 1dro n ASP 103 Cb 0.00 0.00 -0.13 0.00 -0.02 0.00 0.00 41.12 40.97 1dro n ASP 103 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1dro n ASP 104 N 0.00 0.24 0.12 -2.24 8.00 -1.26 -3.41 116.55 118.00 1dro n ASP 104 Ca 0.00 0.10 -0.05 0.00 0.71 0.00 0.00 54.79 55.55 1dro n ASP 104 Cb 0.00 1.25 -0.02 0.00 -0.02 0.00 0.00 41.12 42.33 1dro n ASP 104 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 1dro h THR 105 N 0.00 0.00 -1.06 -3.53 2.02 -1.99 -3.00 112.91 105.35 1dro h THR 105 Ca -0.17 -0.17 0.33 0.00 0.77 0.00 0.00 66.41 67.17 1dro h THR 105 Cb 1.44 0.00 -0.14 0.00 -1.74 0.00 0.00 68.15 67.71 1dro h THR 105 CO 0.02 0.00 0.63 -0.33 0.37 0.00 0.00 175.52 176.21 1dro h GLU 106 N -0.50 0.29 -0.62 6.66 3.07 -1.96 0.17 114.58 121.69 1dro h GLU 106 Ca -0.03 -0.02 0.04 0.00 -0.50 0.00 0.00 59.36 58.85 1dro h GLU 106 Cb 0.25 -0.07 -0.04 0.00 -0.84 0.00 0.00 28.75 28.05 1dro h GLU 106 CO 0.06 0.19 0.37 1.98 -1.40 0.00 0.00 179.01 180.20 1dro h MET 107 N 0.30 0.69 0.00 2.33 4.05 -1.55 0.10 114.93 120.84 1dro h MET 107 Ca 0.73 -0.04 0.00 0.00 -0.28 0.00 0.00 59.70 60.11 1dro h MET 107 Cb 1.79 -0.15 0.00 0.00 -0.80 0.00 0.00 31.60 32.44 1dro h MET 107 CO -0.53 0.45 -1.07 0.43 0.23 0.00 0.00 176.91 176.43 1dro n SER 108 N -4.76 0.66 0.13 1.39 7.64 -0.82 -2.64 113.62 115.22 1dro n SER 108 Ca 0.06 0.11 -0.02 0.00 1.01 0.00 0.00 58.87 60.04 1dro n SER 108 Cb 0.11 0.67 0.15 0.00 -1.01 0.00 0.00 64.21 64.13 1dro n SER 108 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 1dro h GLN 109 N 0.00 0.00 0.05 1.43 1.08 0.14 0.19 115.11 117.99 1dro h GLN 109 Ca 0.00 0.00 -0.23 0.00 -1.45 0.00 0.00 58.65 56.97 1dro h GLN 109 Cb 0.89 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.31 1dro h GLN 109 CO 0.00 0.65 -1.03 -1.49 -0.95 0.00 0.00 178.83 176.01 1dro h TRP 110 N 0.00 0.44 -0.27 2.96 4.06 -0.92 0.39 115.95 122.62 1dro h TRP 110 Ca -0.01 -0.27 -0.19 0.00 2.06 0.00 0.00 58.89 60.48 1dro h TRP 110 Cb 1.16 -0.04 0.00 0.00 -1.00 0.00 0.00 29.16 29.28 1dro h TRP 110 CO 0.00 1.14 -0.58 -0.24 -3.56 0.00 0.00 178.44 175.20 1dro h VAL 111 N 0.13 1.28 -0.14 1.49 3.04 -1.36 0.26 116.25 120.94 1dro h VAL 111 Ca -0.08 -1.76 -0.06 0.00 -1.01 0.00 0.00 66.70 63.78 1dro h VAL 111 Cb 1.70 1.67 -0.00 0.00 -2.01 0.00 0.00 31.29 32.66 1dro h VAL 111 CO 0.17 0.57 -0.17 0.71 -1.01 0.00 0.00 177.57 177.84 1dro h THR 112 N 0.65 1.36 0.19 3.17 1.35 -0.70 0.37 112.91 119.29 1dro h THR 112 Ca 0.01 -1.36 0.01 0.00 -0.55 0.00 0.00 66.41 64.52 1dro h THR 112 Cb 1.18 1.94 -0.04 0.00 -1.73 0.00 0.00 68.15 69.50 1dro h THR 112 CO 0.13 0.40 -0.44 0.28 -0.25 0.00 0.00 175.52 175.63 1dro h SER 113 N -0.04 -1.28 0.07 5.36 0.02 -0.23 -1.73 113.55 115.73 1dro h SER 113 Ca 0.02 0.13 -0.03 0.00 -0.84 0.00 0.00 61.79 61.07 1dro h SER 113 Cb 0.71 0.47 -0.01 0.00 0.14 0.00 0.00 62.40 63.71 1dro h SER 113 CO 0.04 -0.52 -0.12 -0.07 -1.14 0.00 0.00 176.83 175.02 1dro h LEU 114 N -0.72 0.10 -0.52 5.07 -0.00 -0.48 -1.64 115.31 117.13 1dro h LEU 114 Ca 0.00 -0.02 -0.10 0.00 -0.00 0.00 0.00 57.88 57.77 1dro h LEU 114 Cb 0.72 -0.03 -0.02 0.00 -0.00 0.00 0.00 40.66 41.33 1dro h LEU 114 CO -0.21 0.23 -0.07 0.50 -0.00 0.00 0.00 178.44 178.89 1dro h LYS 115 N 0.11 0.96 -0.03 1.13 1.63 0.06 -2.50 116.57 117.93 1dro h LYS 115 Ca 0.02 -0.34 -0.01 0.00 -0.85 0.00 0.00 60.65 59.47 1dro h LYS 115 Cb 0.28 -0.07 -0.00 0.00 -0.60 0.00 0.00 32.23 31.84 1dro h LYS 115 CO 0.02 1.01 -0.03 0.00 -3.45 0.00 0.00 179.45 176.99 1dro h ALA 116 N 0.92 0.04 0.94 5.00 0.00 -0.39 -3.32 119.26 122.44 1dro h ALA 116 Ca 0.14 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 1dro h ALA 116 Cb 0.62 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.41 1dro h ALA 116 CO 0.04 -0.17 -0.48 1.96 0.00 0.00 0.00 179.25 180.60 1dro h GLN 117 N -0.40 -1.25 -6.59 0.00 1.08 -1.48 -3.45 115.11 103.03 1dro h GLN 117 Ca 0.00 0.08 -0.54 0.00 -1.45 0.00 0.00 58.65 56.75 1dro h GLN 117 Cb 0.55 0.28 0.21 0.00 -0.05 0.00 0.00 27.48 28.47 1dro h GLN 117 CO 0.01 -0.83 -0.79 0.45 -0.95 0.00 0.00 178.83 176.71 1dro n SER 118 N -5.56 -2.68 -0.00 1.46 2.88 0.37 -4.50 113.62 105.59 1dro n SER 118 Ca -0.16 0.37 -0.13 0.00 -1.33 0.00 0.00 58.87 57.62 1dro n SER 118 Cb 0.52 -1.12 -0.10 0.00 -0.75 0.00 0.00 64.21 62.76 1dro n SER 118 CO 0.00 0.00 0.00 -0.78 -1.23 0.00 0.00 175.04 173.03 1dro h ASP 119 N -1.16 -0.06 -4.22 -3.46 1.82 -1.62 -3.48 116.42 104.24 1dro h ASP 119 Ca -0.44 -0.55 0.00 0.00 -0.39 0.00 0.00 57.03 55.65 1dro h ASP 119 Cb 1.30 0.01 0.00 0.00 0.68 0.00 0.00 39.33 41.33 1dro h ASP 119 CO 0.34 0.55 -0.76 -0.24 -1.61 0.00 0.00 179.24 177.52 1dro n SER 120 N -4.83 -7.96 -2.31 2.28 2.88 -1.25 -4.94 113.62 97.49 1dro n SER 120 Ca -0.09 1.08 -0.17 0.00 -1.33 0.00 0.00 58.87 58.36 1dro n SER 120 Cb 0.30 -3.83 0.03 0.00 -0.75 0.00 0.00 64.21 59.95 1dro n SER 120 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1dro n THR 121 N 0.32 2.11 -0.65 2.46 -2.24 -1.26 -5.12 114.28 109.90 1dro n THR 121 Ca 0.00 -3.89 0.00 0.00 -2.27 0.00 0.00 64.05 57.89 1dro n THR 121 Cb 0.00 -0.42 0.00 0.00 -2.10 0.00 0.00 70.33 67.81 1dro n THR 121 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50