#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yuz n SER 2 N 0.00 1.15 -3.65 1.61 2.88 -1.26 -5.09 113.62 109.26 2yuz n SER 2 Ca 0.00 0.18 -0.13 0.00 -1.33 0.00 0.00 58.87 57.59 2yuz n SER 2 Cb 0.00 -0.48 -0.07 0.00 -0.75 0.00 0.00 64.21 62.90 2yuz n SER 2 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2yuz s SER 3 N -5.55 -0.74 0.00 -3.46 1.04 -1.26 -5.05 113.70 98.69 2yuz s SER 3 Ca -0.12 1.37 0.00 0.00 0.48 0.00 0.00 55.95 57.68 2yuz s SER 3 Cb 0.02 1.36 0.00 0.00 0.10 0.00 0.00 66.02 67.49 2yuz s SER 3 CO 0.17 -0.23 0.00 0.61 0.98 0.00 0.00 173.24 174.77 2yuz n GLY 4 N 3.05 0.43 1.76 7.32 0.00 -1.26 -4.88 105.19 111.61 2yuz n GLY 4 Ca -0.15 -0.42 -0.12 0.00 0.00 0.00 0.00 46.02 45.33 2yuz n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2yuz n SER 5 N 0.00 5.92 -4.42 1.61 2.88 -1.26 -4.48 113.62 113.87 2yuz n SER 5 Ca 0.00 -2.87 -0.25 0.00 -1.33 0.00 0.00 58.87 54.41 2yuz n SER 5 Cb 0.00 -1.03 -0.09 0.00 -0.75 0.00 0.00 64.21 62.33 2yuz n SER 5 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2yuz s SER 6 N 0.58 2.94 0.00 -3.46 0.01 -1.26 -4.95 113.70 107.56 2yuz s SER 6 Ca 0.23 -1.51 0.00 0.00 1.31 0.00 0.00 55.95 55.98 2yuz s SER 6 Cb 0.18 0.16 0.00 0.00 0.21 0.00 0.00 66.02 66.57 2yuz s SER 6 CO 0.00 -0.73 0.00 0.61 0.41 0.00 0.00 173.24 173.53 2yuz n GLY 7 N -0.88 0.51 3.66 3.44 0.00 -1.26 -4.78 105.19 105.87 2yuz n GLY 7 Ca -0.06 0.63 -0.45 0.00 0.00 0.00 0.00 46.02 46.14 2yuz n GLY 7 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2yuz n LEU 8 N 0.00 2.91 -4.00 0.99 7.94 -1.26 -4.96 117.00 118.62 2yuz n LEU 8 Ca 0.00 1.14 -0.31 0.00 -1.11 0.00 0.00 56.01 55.73 2yuz n LEU 8 Cb 0.00 -1.40 -0.14 0.00 0.53 0.00 0.00 43.42 42.41 2yuz n LEU 8 CO 0.00 -0.58 -0.24 -0.54 -1.11 0.00 0.00 177.39 174.92 2yuz s LYS 9 N -0.35 1.78 -0.11 1.96 1.02 -1.26 -5.02 119.74 117.76 2yuz s LYS 9 Ca 0.69 -2.22 -0.34 0.00 0.02 0.00 0.00 55.97 54.12 2yuz s LYS 9 Cb -0.68 -3.31 -0.12 0.00 -0.52 0.00 0.00 37.83 33.21 2yuz s LYS 9 CO 0.49 -1.03 1.91 -0.89 -0.92 0.00 0.00 175.35 174.91 2yuz n ILE 10 N 3.76 0.55 -0.02 2.17 5.41 -1.26 -3.57 119.36 126.39 2yuz n ILE 10 Ca 0.04 -0.12 -0.01 0.00 1.00 0.00 0.00 62.75 63.66 2yuz n ILE 10 Cb 0.38 -1.88 -0.00 0.00 -0.71 0.00 0.00 39.64 37.43 2yuz n ILE 10 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 2yuz h LEU 11 N 9.54 0.00 -7.31 1.39 3.38 -1.88 -3.45 115.31 116.98 2yuz h LEU 11 Ca -0.47 0.00 -0.64 0.00 0.09 0.00 0.00 57.88 56.86 2yuz h LEU 11 Cb 1.27 0.00 -0.41 0.00 0.09 0.00 0.00 40.66 41.62 2yuz h LEU 11 CO 0.95 0.23 -0.58 -0.89 0.09 0.00 0.00 178.44 178.24 2yuz s THR 12 N -1.37 2.80 0.82 0.22 2.01 -1.14 -4.99 115.64 114.00 2yuz s THR 12 Ca -0.04 -3.59 -0.11 0.00 0.31 0.00 0.00 61.69 58.26 2yuz s THR 12 Cb 0.01 -2.90 0.09 0.00 0.01 0.00 0.00 72.50 69.71 2yuz s THR 12 CO 0.06 -0.87 1.09 -2.16 -0.69 0.00 0.00 174.62 172.05 2yuz s PRO 13 N -0.64 1.84 0.48 4.92 0.04 -1.26 -0.87 135.00 139.50 2yuz s PRO 13 Ca 0.19 1.03 -0.24 0.00 0.04 0.00 0.00 61.00 62.02 2yuz s PRO 13 Cb -0.19 -1.86 -0.08 0.00 0.04 0.00 0.00 34.50 32.41 2yuz s PRO 13 CO -0.05 -1.89 1.36 1.28 0.04 0.00 0.00 177.00 177.73 2yuz n LEU 14 N -3.67 4.96 -4.35 -3.56 4.77 -1.26 -4.88 117.00 109.00 2yuz n LEU 14 Ca 0.08 1.07 -0.31 0.00 -0.03 0.00 0.00 56.01 56.82 2yuz n LEU 14 Cb 0.54 -1.57 -0.15 0.00 -2.33 0.00 0.00 43.42 39.91 2yuz n LEU 14 CO 0.54 -0.45 -0.55 0.42 -1.33 0.00 0.00 177.39 176.03 2yuz s THR 15 N -1.23 2.24 0.12 -5.08 -4.23 -1.26 -4.80 115.64 101.40 2yuz s THR 15 Ca 0.65 -1.17 -0.35 0.00 -1.18 0.00 0.00 61.69 59.63 2yuz s THR 15 Cb -0.45 -1.83 -0.16 0.00 1.34 0.00 0.00 72.50 71.40 2yuz s THR 15 CO 0.55 0.49 1.42 -0.90 -0.54 0.00 0.00 174.62 175.64 2yuz n ASP 16 N 2.13 2.18 -3.75 3.99 5.75 -1.26 -4.84 116.55 120.75 2yuz n ASP 16 Ca -0.16 1.11 -0.22 0.00 -0.01 0.00 0.00 54.79 55.51 2yuz n ASP 16 Cb 0.52 -1.28 -0.18 0.00 -1.03 0.00 0.00 41.12 39.15 2yuz n ASP 16 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 2yuz s GLN 17 N 0.59 0.38 -0.22 0.11 -0.21 -1.17 -5.00 119.66 114.15 2yuz s GLN 17 Ca 0.82 0.18 -0.08 0.00 0.02 0.00 0.00 55.36 56.30 2yuz s GLN 17 Cb -0.85 -0.80 -0.04 0.00 1.00 0.00 0.00 33.01 32.33 2yuz s GLN 17 CO 0.44 -0.30 0.08 0.99 -2.12 0.00 0.00 175.29 174.38 2yuz s THR 18 N 1.95 4.68 0.05 -0.19 2.01 -1.26 -4.01 115.64 118.86 2yuz s THR 18 Ca 0.04 -0.06 0.03 0.00 0.31 0.00 0.00 61.69 62.00 2yuz s THR 18 Cb -0.12 -3.15 -0.02 0.00 0.01 0.00 0.00 72.50 69.21 2yuz s THR 18 CO -0.04 0.39 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.51 2yuz s VAL 19 N 0.95 0.61 0.81 3.82 1.01 -1.13 -5.02 120.40 121.46 2yuz s VAL 19 Ca 0.04 -1.10 -0.12 0.00 0.00 0.00 0.00 61.98 60.81 2yuz s VAL 19 Cb -0.14 -0.67 0.09 0.00 0.00 0.00 0.00 36.38 35.66 2yuz s VAL 19 CO 0.03 -0.35 1.14 0.21 0.00 0.00 0.00 175.10 176.13 2yuz s ASN 20 N -1.58 3.83 0.30 3.32 3.84 -1.26 -3.28 114.94 120.11 2yuz s ASN 20 Ca -0.09 2.10 -0.30 0.00 0.21 0.00 0.00 52.86 54.79 2yuz s ASN 20 Cb -0.10 -2.56 -0.11 0.00 -0.55 0.00 0.00 41.25 37.94 2yuz s ASN 20 CO 0.01 -2.49 1.50 -0.22 -2.79 0.00 0.00 177.10 173.10 2yuz s LEU 21 N -5.96 4.36 0.00 3.21 0.20 -1.21 -2.16 118.68 117.12 2yuz s LEU 21 Ca 0.67 2.85 0.00 0.00 0.69 0.00 0.00 54.13 58.33 2yuz s LEU 21 Cb -0.22 -3.64 0.00 0.00 -0.43 0.00 0.00 46.19 41.90 2yuz s LEU 21 CO 0.53 -0.80 0.00 0.61 -0.29 0.00 0.00 176.35 176.40 2yuz n GLY 22 N 1.76 2.90 3.17 7.98 0.00 0.78 -4.87 105.19 116.91 2yuz n GLY 22 Ca 0.06 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.81 2yuz n GLY 22 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2yuz n LYS 23 N -0.56 -3.83 -3.50 1.61 4.76 -0.92 -3.44 118.16 112.28 2yuz n LYS 23 Ca 0.00 -1.13 -0.42 0.00 -2.87 0.00 0.00 58.31 53.89 2yuz n LYS 23 Cb 0.00 -1.80 -0.06 0.00 -1.84 0.00 0.00 35.03 31.33 2yuz n LYS 23 CO 0.00 0.00 0.00 -2.00 -1.37 0.00 0.00 177.40 174.03 2yuz s GLU 24 N -4.48 2.87 0.32 1.97 2.12 -1.26 -1.22 118.70 119.02 2yuz s GLU 24 Ca 0.57 -2.12 -0.29 0.00 0.36 0.00 0.00 54.97 53.49 2yuz s GLU 24 Cb -0.11 -4.07 -0.10 0.00 0.26 0.00 0.00 34.13 30.10 2yuz s GLU 24 CO 0.50 -1.23 1.35 0.42 -0.54 0.00 0.00 175.26 175.76 2yuz s ILE 25 N 0.75 2.63 0.00 -3.70 1.01 -1.20 -4.86 121.20 115.84 2yuz s ILE 25 Ca 0.11 0.61 0.03 0.00 0.00 0.00 0.00 60.65 61.40 2yuz s ILE 25 Cb -0.21 -3.39 -0.01 0.00 0.01 0.00 0.00 42.46 38.86 2yuz s ILE 25 CO -0.03 0.14 -0.09 0.00 0.00 0.00 0.00 174.94 174.95 2yuz s LEU 27 N -0.43 -0.19 0.04 0.00 1.43 0.46 -4.98 118.68 115.01 2yuz s LEU 27 Ca 0.02 0.62 0.08 0.00 -1.03 0.00 0.00 54.13 53.82 2yuz s LEU 27 Cb -0.04 0.77 -0.03 0.00 0.03 0.00 0.00 46.19 46.92 2yuz s LEU 27 CO -0.00 -0.22 -0.23 -0.75 0.23 0.00 0.00 176.35 175.38 2yuz s LYS 28 N 2.19 1.58 0.05 1.70 2.36 -1.26 -0.54 119.74 125.81 2yuz s LYS 28 Ca -0.01 -0.99 -0.07 0.00 -2.55 0.00 0.00 55.97 52.35 2yuz s LYS 28 Cb -0.12 -1.70 -0.01 0.00 -1.05 0.00 0.00 37.83 34.96 2yuz s LYS 28 CO -0.09 0.44 0.14 0.00 1.55 0.00 0.00 175.35 177.39 2yuz s GLU 30 N -2.95 1.01 0.19 0.00 2.12 -0.05 -2.43 118.70 116.59 2yuz s GLU 30 Ca -0.02 -1.22 -0.03 0.00 0.36 0.00 0.00 54.97 54.06 2yuz s GLU 30 Cb 0.01 -0.91 -0.03 0.00 0.26 0.00 0.00 34.13 33.45 2yuz s GLU 30 CO -0.06 0.18 0.16 0.96 -0.54 0.00 0.00 175.26 175.96 2yuz s ILE 31 N -2.06 0.03 -0.28 -3.70 -4.36 -0.93 -2.88 121.20 107.02 2yuz s ILE 31 Ca 0.08 -1.87 0.12 0.00 -0.26 0.00 0.00 60.65 58.72 2yuz s ILE 31 Cb -0.05 -2.31 0.78 0.00 1.25 0.00 0.00 42.46 42.12 2yuz s ILE 31 CO 0.03 -0.13 1.77 -1.54 0.24 0.00 0.00 174.94 175.31 2yuz n SER 32 N -0.24 5.22 -3.80 4.36 3.41 -1.23 -4.83 113.62 116.51 2yuz n SER 32 Ca -0.01 -3.10 -0.13 0.00 -0.26 0.00 0.00 58.87 55.38 2yuz n SER 32 Cb 0.65 -0.71 -0.12 0.00 -0.26 0.00 0.00 64.21 63.77 2yuz n SER 32 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2yuz s GLU 33 N -2.90 0.30 -0.64 4.33 0.41 -1.26 -4.85 118.70 114.09 2yuz s GLU 33 Ca 0.55 0.24 -0.18 0.00 -0.41 0.00 0.00 54.97 55.16 2yuz s GLU 33 Cb 0.43 0.14 0.12 0.00 -1.78 0.00 0.00 34.13 33.04 2yuz s GLU 33 CO 0.14 -0.04 0.74 -0.80 -0.49 0.00 0.00 175.26 174.81 2yuz s ASN 34 N -0.06 6.27 -0.02 -0.19 0.01 -1.26 -4.65 114.94 115.04 2yuz s ASN 34 Ca -0.02 -1.61 -0.27 0.00 -0.71 0.00 0.00 52.86 50.26 2yuz s ASN 34 Cb -0.02 -2.30 0.06 0.00 0.41 0.00 0.00 41.25 39.40 2yuz s ASN 34 CO 0.01 -1.06 0.60 0.27 -1.51 0.00 0.00 177.10 175.40 2yuz s ILE 35 N 2.44 0.01 0.62 0.60 -4.36 -1.26 -5.06 121.20 114.20 2yuz s ILE 35 Ca 0.14 -0.11 -0.16 0.00 -0.26 0.00 0.00 60.65 60.26 2yuz s ILE 35 Cb -0.21 -0.94 -0.02 0.00 1.25 0.00 0.00 42.46 42.54 2yuz s ILE 35 CO 0.03 -0.06 1.12 -2.16 0.24 0.00 0.00 174.94 174.11 2yuz s PRO 36 N -1.55 2.97 0.08 0.37 0.04 -1.26 -4.92 135.00 130.72 2yuz s PRO 36 Ca -0.10 1.46 -0.15 0.00 0.04 0.00 0.00 61.00 62.24 2yuz s PRO 36 Cb -0.01 -1.97 0.03 0.00 0.04 0.00 0.00 34.50 32.59 2yuz s PRO 36 CO 0.06 -1.13 0.36 0.20 0.04 0.00 0.00 177.00 176.53 2yuz s GLY 37 N -2.34 -0.20 0.10 0.56 0.00 -1.26 -1.43 107.32 102.75 2yuz s GLY 37 Ca 0.69 0.02 0.09 0.00 0.00 0.00 0.00 44.72 45.52 2yuz s GLY 37 CO 0.37 -0.22 -0.24 0.54 0.00 0.00 0.00 173.10 173.55 2yuz s LYS 38 N -3.09 1.36 0.39 2.90 3.01 -0.49 -4.93 119.74 118.88 2yuz s LYS 38 Ca -0.01 -1.21 0.03 0.00 -1.01 0.00 0.00 55.97 53.76 2yuz s LYS 38 Cb 0.01 -1.70 -0.01 0.00 -1.01 0.00 0.00 37.83 35.12 2yuz s LYS 38 CO -0.07 0.41 0.57 -1.58 0.51 0.00 0.00 175.35 175.19 2yuz s TRP 39 N -1.03 3.21 -0.20 3.18 0.52 -1.26 -1.05 118.94 122.31 2yuz s TRP 39 Ca 0.11 0.04 -0.12 0.00 0.02 0.00 0.00 56.10 56.14 2yuz s TRP 39 Cb -0.10 -2.12 0.06 0.00 -1.15 0.00 0.00 33.47 30.16 2yuz s TRP 39 CO 0.04 -0.15 0.49 0.95 0.02 0.00 0.00 176.95 178.30 2yuz s THR 40 N -2.36 -0.01 -0.01 2.01 -4.23 0.41 -3.42 115.64 108.03 2yuz s THR 40 Ca 0.46 0.05 0.06 0.00 -1.18 0.00 0.00 61.69 61.08 2yuz s THR 40 Cb -0.10 -0.71 -0.03 0.00 1.34 0.00 0.00 72.50 73.01 2yuz s THR 40 CO 0.35 0.02 -0.18 -0.75 -0.54 0.00 0.00 174.62 173.52 2yuz s LYS 41 N 1.17 2.25 -1.82 3.99 2.36 0.03 -0.09 119.74 127.64 2yuz s LYS 41 Ca -0.07 -0.86 -0.21 0.00 -2.55 0.00 0.00 55.97 52.28 2yuz s LYS 41 Cb -0.07 -2.24 0.21 0.00 -1.05 0.00 0.00 37.83 34.68 2yuz s LYS 41 CO -0.11 0.58 0.64 0.09 1.55 0.00 0.00 175.35 178.10 2yuz n ASN 42 N 2.02 -2.22 -2.69 1.43 3.02 -0.94 0.13 115.26 116.01 2yuz n ASN 42 Ca -0.17 -1.17 -0.19 0.00 -0.03 0.00 0.00 54.58 53.03 2yuz n ASN 42 Cb 0.52 -1.99 0.04 0.00 -0.61 0.00 0.00 39.78 37.75 2yuz n ASN 42 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2yuz n GLY 43 N -1.22 -0.28 2.99 7.41 0.00 -1.26 -5.01 105.19 107.81 2yuz n GLY 43 Ca 0.09 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.00 2yuz n GLY 43 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2yuz s LEU 44 N -5.74 2.18 -0.52 0.99 1.43 0.34 -5.10 118.68 112.24 2yuz s LEU 44 Ca 0.33 -0.38 -0.27 0.00 -1.03 0.00 0.00 54.13 52.78 2yuz s LEU 44 Cb -0.15 -0.05 -0.02 0.00 0.03 0.00 0.00 46.19 46.01 2yuz s LEU 44 CO 0.41 -0.18 1.81 -2.16 0.23 0.00 0.00 176.35 176.47 2yuz s PRO 45 N -1.10 2.89 0.24 1.29 0.04 -1.26 -0.79 135.00 136.32 2yuz s PRO 45 Ca -0.09 0.85 -0.29 0.00 0.04 0.00 0.00 61.00 61.50 2yuz s PRO 45 Cb -0.07 -4.31 -0.15 0.00 0.04 0.00 0.00 34.50 30.01 2yuz s PRO 45 CO -0.00 -2.41 1.01 0.28 0.04 0.00 0.00 177.00 175.91 2yuz n VAL 46 N 7.25 1.65 -3.35 -0.36 0.31 -1.22 -4.93 118.33 117.69 2yuz n VAL 46 Ca 0.21 -0.41 -0.39 0.00 -0.01 0.00 0.00 64.34 63.73 2yuz n VAL 46 Cb 0.50 -0.85 -0.09 0.00 -0.91 0.00 0.00 33.84 32.50 2yuz n VAL 46 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 2yuz s GLN 47 N -1.13 4.00 0.22 5.55 -0.21 -1.26 -4.97 119.66 121.85 2yuz s GLN 47 Ca 0.64 0.08 -0.23 0.00 0.02 0.00 0.00 55.36 55.87 2yuz s GLN 47 Cb -0.77 -3.66 -0.08 0.00 1.00 0.00 0.00 33.01 29.49 2yuz s GLN 47 CO 0.57 -0.31 0.79 -1.21 -2.12 0.00 0.00 175.29 173.00 2yuz s GLU 48 N 2.14 4.44 0.10 2.91 2.02 -1.26 -4.78 118.70 124.26 2yuz s GLU 48 Ca 0.16 1.07 -0.26 0.00 0.02 0.00 0.00 54.97 55.96 2yuz s GLU 48 Cb -0.16 -3.00 0.08 0.00 0.10 0.00 0.00 34.13 31.15 2yuz s GLU 48 CO 0.10 0.44 0.98 0.45 0.02 0.00 0.00 175.26 177.24 2yuz s SER 49 N -1.46 -0.20 0.34 -0.19 0.15 0.23 -4.93 113.70 107.63 2yuz s SER 49 Ca 0.42 -0.29 0.24 0.00 0.70 0.00 0.00 55.95 57.01 2yuz s SER 49 Cb -0.19 0.43 1.16 0.00 -1.71 0.00 0.00 66.02 65.71 2yuz s SER 49 CO 0.23 -0.78 1.24 -0.67 1.20 0.00 0.00 173.24 174.46 2yuz n ASP 50 N -0.42 0.19 -0.03 5.45 2.03 -1.26 0.10 116.55 122.61 2yuz n ASP 50 Ca -0.07 1.15 -0.12 0.00 0.52 0.00 0.00 54.79 56.27 2yuz n ASP 50 Cb 0.61 -0.56 -0.10 0.00 -0.72 0.00 0.00 41.12 40.35 2yuz n ASP 50 CO 0.00 0.00 0.00 0.03 -1.92 0.00 0.00 177.20 175.31 2yuz h ARG 51 N 0.00 -0.04 -4.84 -0.67 -0.00 -1.94 -3.43 114.38 103.45 2yuz h ARG 51 Ca 0.69 0.00 -0.68 0.00 -0.50 0.00 0.00 59.98 59.50 2yuz h ARG 51 Cb 2.14 0.01 -0.18 0.00 0.00 0.00 0.00 29.97 31.94 2yuz h ARG 51 CO -0.42 0.64 -0.32 -1.17 0.00 0.00 0.00 179.97 178.69 2yuz s LEU 52 N -8.61 4.61 0.08 3.04 0.20 0.28 -3.04 118.68 115.24 2yuz s LEU 52 Ca -0.15 -0.43 0.09 0.00 0.69 0.00 0.00 54.13 54.32 2yuz s LEU 52 Cb -0.01 -2.29 -0.03 0.00 -0.43 0.00 0.00 46.19 43.43 2yuz s LEU 52 CO 0.58 -0.38 -0.23 -1.59 -0.29 0.00 0.00 176.35 174.44 2yuz s LYS 53 N 1.95 1.38 -0.44 1.98 0.00 -1.25 -0.60 119.74 122.76 2yuz s LYS 53 Ca 0.10 -1.10 -0.00 0.00 0.00 0.00 0.00 55.97 54.97 2yuz s LYS 53 Cb -0.17 -1.61 0.12 0.00 0.00 0.00 0.00 37.83 36.16 2yuz s LYS 53 CO 0.12 0.40 0.21 0.08 0.00 0.00 0.00 175.35 176.15 2yuz s VAL 54 N -0.95 2.99 0.14 1.79 1.01 -1.26 -3.84 120.40 120.28 2yuz s VAL 54 Ca 0.09 -2.46 -0.09 0.00 0.00 0.00 0.00 61.98 59.53 2yuz s VAL 54 Cb -0.10 -3.07 -0.06 0.00 0.00 0.00 0.00 36.38 33.15 2yuz s VAL 54 CO 0.03 -0.71 0.45 -0.69 0.00 0.00 0.00 175.10 174.18 2yuz s VAL 55 N 0.68 5.05 -0.07 2.92 1.01 -0.82 -4.96 120.40 124.21 2yuz s VAL 55 Ca 0.12 0.37 0.04 0.00 0.00 0.00 0.00 61.98 62.51 2yuz s VAL 55 Cb -0.22 -3.64 0.00 0.00 0.00 0.00 0.00 36.38 32.52 2yuz s VAL 55 CO -0.05 0.12 -0.19 -1.58 0.00 0.00 0.00 175.10 173.40 2yuz s GLN 56 N -2.36 2.22 -0.38 2.72 0.74 -1.26 -1.33 119.66 120.01 2yuz s GLN 56 Ca 0.39 -0.68 0.01 0.00 0.05 0.00 0.00 55.36 55.13 2yuz s GLN 56 Cb -0.13 -1.81 0.12 0.00 1.10 0.00 0.00 33.01 32.29 2yuz s GLN 56 CO 0.21 0.19 0.17 0.15 -0.55 0.00 0.00 175.29 175.46 2yuz s LYS 57 N 0.24 1.03 -0.19 1.67 1.02 0.17 -4.94 119.74 118.74 2yuz s LYS 57 Ca -0.10 -1.59 -0.17 0.00 0.02 0.00 0.00 55.97 54.13 2yuz s LYS 57 Cb -0.15 -2.19 0.03 0.00 -0.52 0.00 0.00 37.83 35.00 2yuz s LYS 57 CO 0.05 -1.08 0.28 0.41 -0.92 0.00 0.00 175.35 174.09 2yuz n GLY 58 N 4.14 0.08 3.43 -3.33 0.00 -1.26 -2.42 105.19 105.83 2yuz n GLY 58 Ca 0.04 0.49 -0.17 0.00 0.00 0.00 0.00 46.02 46.38 2yuz n GLY 58 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2yuz n ARG 59 N 0.39 -6.67 -3.24 1.61 1.74 -1.26 -4.93 116.66 104.29 2yuz n ARG 59 Ca -0.04 0.85 -0.02 0.00 -0.77 0.00 0.00 57.85 57.86 2yuz n ARG 59 Cb 0.45 -5.86 -0.04 0.00 -1.02 0.00 0.00 32.46 25.98 2yuz n ARG 59 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2yuz s ILE 60 N -3.36 -0.81 -0.55 0.55 1.01 -1.02 -2.18 121.20 114.85 2yuz s ILE 60 Ca 0.03 -0.07 -0.18 0.00 0.00 0.00 0.00 60.65 60.43 2yuz s ILE 60 Cb -0.01 -0.93 0.10 0.00 0.01 0.00 0.00 42.46 41.62 2yuz s ILE 60 CO 0.73 -0.09 0.61 -1.00 0.00 0.00 0.00 174.94 175.19 2yuz s HIS 61 N 2.70 3.09 -0.12 3.97 3.76 -1.02 -0.65 115.29 127.01 2yuz s HIS 61 Ca 0.15 -0.97 -0.06 0.00 -0.15 0.00 0.00 55.06 54.03 2yuz s HIS 61 Cb -0.14 -3.80 -0.04 0.00 1.11 0.00 0.00 32.58 29.71 2yuz s HIS 61 CO -0.21 -1.14 0.09 0.21 -0.85 0.00 0.00 174.74 172.84 2yuz s LYS 62 N 2.31 3.44 0.01 1.40 2.20 -0.44 -3.23 119.74 125.43 2yuz s LYS 62 Ca 0.09 -0.24 0.01 0.00 -0.36 0.00 0.00 55.97 55.47 2yuz s LYS 62 Cb -0.25 -3.10 -0.01 0.00 -1.51 0.00 0.00 37.83 32.96 2yuz s LYS 62 CO 0.06 0.66 -0.03 -1.17 -0.36 0.00 0.00 175.35 174.51 2yuz s LEU 63 N -0.71 2.08 -0.15 5.43 0.20 0.29 -1.95 118.68 123.87 2yuz s LEU 63 Ca 0.12 -0.19 -0.10 0.00 0.69 0.00 0.00 54.13 54.65 2yuz s LEU 63 Cb -0.12 -0.10 0.05 0.00 -0.43 0.00 0.00 46.19 45.60 2yuz s LEU 63 CO 0.03 -0.06 0.38 0.54 -0.29 0.00 0.00 176.35 176.95 2yuz s VAL 64 N -0.48 -0.02 -0.04 1.68 0.11 -1.25 -0.41 120.40 119.99 2yuz s VAL 64 Ca -0.03 0.07 -0.11 0.00 -2.93 0.00 0.00 61.98 58.98 2yuz s VAL 64 Cb -0.04 -0.56 -0.05 0.00 -1.53 0.00 0.00 36.38 34.20 2yuz s VAL 64 CO -0.00 0.03 0.29 -0.63 -3.33 0.00 0.00 175.10 171.46 2yuz s ILE 65 N 1.00 5.24 0.08 7.04 1.01 -0.64 -3.88 121.20 131.06 2yuz s ILE 65 Ca -0.07 0.50 -0.20 0.00 0.00 0.00 0.00 60.65 60.89 2yuz s ILE 65 Cb -0.07 -3.58 -0.09 0.00 0.01 0.00 0.00 42.46 38.73 2yuz s ILE 65 CO -0.08 0.55 1.53 0.00 0.00 0.00 0.00 174.94 176.94 2yuz h ALA 66 N 4.65 0.28 -3.24 9.38 0.00 -1.86 -3.17 119.26 125.32 2yuz h ALA 66 Ca -0.53 -0.19 -0.59 0.00 0.00 0.00 0.00 54.91 53.61 2yuz h ALA 66 Cb 1.22 -0.08 -0.35 0.00 0.00 0.00 0.00 17.79 18.58 2yuz h ALA 66 CO 0.61 -0.02 -0.83 -0.80 0.00 0.00 0.00 179.25 178.20 2yuz s ASN 67 N -5.83 2.49 -0.92 0.00 -0.87 -1.26 -4.35 114.94 104.20 2yuz s ASN 67 Ca -0.14 -0.44 -0.24 0.00 -1.57 0.00 0.00 52.86 50.48 2yuz s ASN 67 Cb 0.07 -1.11 0.05 0.00 -0.02 0.00 0.00 41.25 40.25 2yuz s ASN 67 CO 0.73 0.00 1.34 0.00 -2.57 0.00 0.00 177.10 176.61 2yuz s ALA 68 N 1.08 2.81 0.16 0.60 0.00 -0.36 -4.83 121.76 121.22 2yuz s ALA 68 Ca -0.04 -2.05 -0.12 0.00 0.00 0.00 0.00 51.96 49.74 2yuz s ALA 68 Cb -0.14 -4.37 -0.07 0.00 0.00 0.00 0.00 23.12 18.53 2yuz s ALA 68 CO -0.03 -3.42 0.53 -0.51 0.00 0.00 0.00 175.76 172.33 2yuz s LEU 69 N 4.91 4.29 0.65 0.00 1.43 -1.26 -0.16 118.68 128.54 2yuz s LEU 69 Ca 0.40 1.00 0.34 0.00 -1.03 0.00 0.00 54.13 54.85 2yuz s LEU 69 Cb -0.04 -3.35 1.88 0.00 0.03 0.00 0.00 46.19 44.72 2yuz s LEU 69 CO -0.02 0.06 2.09 0.74 0.23 0.00 0.00 176.35 179.45 2yuz h THR 70 N 2.59 0.10 0.00 5.49 2.02 -1.96 0.32 112.91 121.47 2yuz h THR 70 Ca -0.48 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 66.68 2yuz h THR 70 Cb 1.19 0.80 -0.00 0.00 -1.74 0.00 0.00 68.15 68.39 2yuz h THR 70 CO 0.67 0.00 -0.11 1.05 0.37 0.00 0.00 175.52 177.50 2yuz h GLU 71 N 0.00 0.00 0.00 6.66 4.11 -1.99 -2.88 114.58 120.48 2yuz h GLU 71 Ca 0.02 0.00 -0.04 0.00 0.07 0.00 0.00 59.36 59.42 2yuz h GLU 71 Cb 0.45 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.70 2yuz h GLU 71 CO -0.00 0.11 -0.32 -0.44 0.07 0.00 0.00 179.01 178.43 2yuz h ASP 72 N 0.00 0.00 -3.98 3.06 3.32 -0.74 -3.46 116.42 114.63 2yuz h ASP 72 Ca -0.00 0.00 -0.51 0.00 0.02 0.00 0.00 57.03 56.54 2yuz h ASP 72 Cb 0.78 0.00 0.07 0.00 0.22 0.00 0.00 39.33 40.40 2yuz h ASP 72 CO 0.01 0.17 0.52 -0.70 -1.72 0.00 0.00 179.24 177.52 2yuz s GLU 73 N -3.15 3.83 0.00 3.56 2.12 -1.09 -4.65 118.70 119.32 2yuz s GLU 73 Ca 0.05 1.90 0.00 0.00 0.36 0.00 0.00 54.97 57.27 2yuz s GLU 73 Cb 0.06 -2.53 0.00 0.00 0.26 0.00 0.00 34.13 31.92 2yuz s GLU 73 CO 0.71 -0.53 0.00 0.41 -0.54 0.00 0.00 175.26 175.31 2yuz n GLY 74 N 0.56 -0.20 3.52 -1.50 0.00 -1.26 -4.99 105.19 101.32 2yuz n GLY 74 Ca 0.06 0.10 -0.07 0.00 0.00 0.00 0.00 46.02 46.11 2yuz n GLY 74 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2yuz s ASP 75 N -4.00 -0.81 -0.11 1.61 1.47 -1.26 -3.88 116.67 109.68 2yuz s ASP 75 Ca 0.00 1.33 -0.05 0.00 1.18 0.00 0.00 52.55 55.01 2yuz s ASP 75 Cb 0.00 1.41 -0.04 0.00 -0.34 0.00 0.00 42.92 43.95 2yuz s ASP 75 CO 0.00 -0.22 0.09 -0.31 0.68 0.00 0.00 175.17 175.41 2yuz s TYR 76 N 1.91 3.44 -0.05 2.11 1.51 -0.78 -2.21 117.35 123.27 2yuz s TYR 76 Ca -0.08 0.40 -0.02 0.00 -1.01 0.00 0.00 57.07 56.35 2yuz s TYR 76 Cb -0.08 -1.89 0.03 0.00 -0.11 0.00 0.00 41.96 39.91 2yuz s TYR 76 CO -0.17 0.63 0.12 0.08 -1.11 0.00 0.00 175.55 175.09 2yuz s VAL 77 N -0.93 -0.05 -0.12 0.71 1.01 0.87 -1.72 120.40 120.17 2yuz s VAL 77 Ca 0.14 0.17 0.02 0.00 0.00 0.00 0.00 61.98 62.32 2yuz s VAL 77 Cb -0.12 -0.20 -0.00 0.00 0.00 0.00 0.00 36.38 36.06 2yuz s VAL 77 CO 0.03 0.07 -0.20 0.12 0.00 0.00 0.00 175.10 175.13 2yuz s PHE 78 N 1.04 2.67 -0.04 5.22 2.19 -1.22 0.15 117.98 127.99 2yuz s PHE 78 Ca -0.08 -0.93 0.02 0.00 0.33 0.00 0.00 56.93 56.27 2yuz s PHE 78 Cb -0.11 -1.77 0.01 0.00 -1.31 0.00 0.00 43.02 39.84 2yuz s PHE 78 CO -0.05 -0.37 -0.10 0.00 1.83 0.00 0.00 175.22 176.53 2yuz s ALA 79 N 0.41 1.05 0.67 11.12 0.00 -0.22 -2.25 121.76 132.54 2yuz s ALA 79 Ca -0.15 -0.36 -0.14 0.00 0.00 0.00 0.00 51.96 51.31 2yuz s ALA 79 Cb -0.17 -0.44 0.01 0.00 0.00 0.00 0.00 23.12 22.51 2yuz s ALA 79 CO 0.07 0.13 1.11 -1.25 0.00 0.00 0.00 175.76 175.81 2yuz s PRO 80 N 0.45 2.74 0.00 0.00 0.04 -1.25 -1.40 135.00 135.59 2yuz s PRO 80 Ca -0.09 1.37 0.05 0.00 0.04 0.00 0.00 61.00 62.37 2yuz s PRO 80 Cb -0.12 -1.94 0.15 0.00 0.04 0.00 0.00 34.50 32.63 2yuz s PRO 80 CO 0.02 -1.29 1.12 -3.47 0.04 0.00 0.00 177.00 173.42 2yuz n ASP 81 N -2.54 0.78 0.00 6.66 2.03 -0.51 -3.48 116.55 119.49 2yuz n ASP 81 Ca 0.10 -1.99 0.00 0.00 0.52 0.00 0.00 54.79 53.43 2yuz n ASP 81 Cb 0.52 -0.10 0.00 0.00 -0.72 0.00 0.00 41.12 40.82 2yuz n ASP 81 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2yuz n ALA 82 N -0.08 1.65 -2.32 -1.67 0.00 -1.26 -5.06 120.51 111.76 2yuz n ALA 82 Ca 0.05 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.32 2yuz n ALA 82 Cb 0.12 0.09 -0.10 0.00 0.00 0.00 0.00 19.45 19.57 2yuz n ALA 82 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2yuz s TYR 83 N -1.65 1.56 -1.48 0.00 1.51 -1.23 -5.03 117.35 111.03 2yuz s TYR 83 Ca 0.00 -0.79 0.13 0.00 -1.01 0.00 0.00 57.07 55.40 2yuz s TYR 83 Cb 0.00 -0.85 0.47 0.00 -0.11 0.00 0.00 41.96 41.47 2yuz s TYR 83 CO 0.00 0.10 1.34 -1.71 -1.11 0.00 0.00 175.55 174.18 2yuz n ASN 84 N -0.38 3.13 -4.77 2.29 5.15 -1.26 -3.78 115.26 115.63 2yuz n ASN 84 Ca -0.07 -2.21 -0.41 0.00 -0.60 0.00 0.00 54.58 51.29 2yuz n ASN 84 Cb 0.62 -0.43 -0.00 0.00 -0.53 0.00 0.00 39.78 39.44 2yuz n ASN 84 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2yuz s VAL 85 N -1.63 2.07 -0.08 3.44 1.01 -1.26 -4.96 120.40 118.98 2yuz s VAL 85 Ca 0.34 0.06 -0.01 0.00 0.00 0.00 0.00 61.98 62.37 2yuz s VAL 85 Cb 0.21 -3.04 0.03 0.00 0.00 0.00 0.00 36.38 33.57 2yuz s VAL 85 CO 0.18 0.01 -0.02 0.42 0.00 0.00 0.00 175.10 175.70 2yuz s THR 86 N -0.94 0.55 -0.51 3.92 -4.23 -1.26 -3.91 115.64 109.26 2yuz s THR 86 Ca 0.54 0.01 -0.17 0.00 -1.18 0.00 0.00 61.69 60.89 2yuz s THR 86 Cb -0.47 -0.67 0.08 0.00 1.34 0.00 0.00 72.50 72.78 2yuz s THR 86 CO 0.60 0.28 0.50 -0.76 -0.54 0.00 0.00 174.62 174.71 2yuz s LEU 87 N 1.90 5.56 0.55 4.79 1.02 -0.95 -4.92 118.68 126.63 2yuz s LEU 87 Ca 0.05 -1.33 -0.19 0.00 0.02 0.00 0.00 54.13 52.67 2yuz s LEU 87 Cb -0.12 -2.26 -0.05 0.00 0.02 0.00 0.00 46.19 43.77 2yuz s LEU 87 CO -0.06 -0.79 1.13 -2.16 0.02 0.00 0.00 176.35 174.48 2yuz s PRO 88 N 1.97 3.32 -0.23 1.29 0.04 -1.26 -3.37 135.00 136.77 2yuz s PRO 88 Ca 0.07 1.60 -0.13 0.00 0.04 0.00 0.00 61.00 62.58 2yuz s PRO 88 Cb -0.24 -2.00 0.07 0.00 0.04 0.00 0.00 34.50 32.37 2yuz s PRO 88 CO 0.07 -0.87 0.56 0.00 0.04 0.00 0.00 177.00 176.80 2yuz s ALA 89 N -1.81 -1.48 0.12 8.56 0.00 -0.70 -4.68 121.76 121.76 2yuz s ALA 89 Ca 0.72 1.99 -0.21 0.00 0.00 0.00 0.00 51.96 54.46 2yuz s ALA 89 Cb -0.24 -1.18 -0.07 0.00 0.00 0.00 0.00 23.12 21.63 2yuz s ALA 89 CO 0.28 -0.32 0.65 0.15 0.00 0.00 0.00 175.76 176.51 2yuz s LYS 90 N 1.50 4.32 0.07 0.00 1.02 -1.26 -1.86 119.74 123.53 2yuz s LYS 90 Ca -0.10 0.88 0.04 0.00 0.02 0.00 0.00 55.97 56.82 2yuz s LYS 90 Cb -0.07 -3.21 -0.03 0.00 -0.52 0.00 0.00 37.83 34.00 2yuz s LYS 90 CO -0.16 0.60 -0.11 0.14 -0.92 0.00 0.00 175.35 174.89 2yuz s VAL 91 N -1.16 0.93 -0.11 3.17 -7.23 -1.25 -3.01 120.40 111.74 2yuz s VAL 91 Ca 0.32 -1.37 -0.10 0.00 -1.81 0.00 0.00 61.98 59.03 2yuz s VAL 91 Cb -0.20 -1.07 0.03 0.00 0.56 0.00 0.00 36.38 35.70 2yuz s VAL 91 CO 0.22 -0.37 0.28 -2.28 -0.31 0.00 0.00 175.10 172.64 2yuz s HIS 92 N -1.69 -0.32 -0.04 2.82 2.46 -1.26 -4.15 115.29 113.12 2yuz s HIS 92 Ca -0.01 0.77 0.07 0.00 0.47 0.00 0.00 55.06 56.35 2yuz s HIS 92 Cb -0.08 0.11 -0.02 0.00 -0.13 0.00 0.00 32.58 32.46 2yuz s HIS 92 CO 0.01 -0.15 -0.25 0.54 -2.47 0.00 0.00 174.74 172.42 2yuz s VAL 93 N 0.19 2.14 0.16 0.89 0.11 -1.26 -2.85 120.40 119.78 2yuz s VAL 93 Ca -0.00 -1.06 -0.27 0.00 -2.93 0.00 0.00 61.98 57.72 2yuz s VAL 93 Cb -0.02 -1.76 -0.08 0.00 -1.53 0.00 0.00 36.38 32.99 2yuz s VAL 93 CO 0.00 0.58 0.84 -0.63 -3.33 0.00 0.00 175.10 172.55 2yuz s ILE 94 N -0.41 4.36 0.35 7.04 -1.09 -1.21 -4.91 121.20 125.34 2yuz s ILE 94 Ca 0.04 1.84 0.09 0.00 -2.23 0.00 0.00 60.65 60.38 2yuz s ILE 94 Cb -0.12 -4.21 -0.05 0.00 -1.58 0.00 0.00 42.46 36.50 2yuz s ILE 94 CO 0.01 0.47 0.05 -0.94 -1.23 0.00 0.00 174.94 173.30 2yuz s SER 95 N -0.85 4.26 0.00 3.58 1.04 -1.26 -3.30 113.70 117.17 2yuz s SER 95 Ca 0.39 -0.99 0.00 0.00 0.48 0.00 0.00 55.95 55.83 2yuz s SER 95 Cb -0.23 -0.55 0.00 0.00 0.10 0.00 0.00 66.02 65.34 2yuz s SER 95 CO 0.28 -0.29 0.00 0.61 0.98 0.00 0.00 173.24 174.82 2yuz n GLY 96 N -1.01 0.82 3.58 7.32 0.00 -1.26 -5.05 105.19 109.59 2yuz n GLY 96 Ca -0.04 -1.77 -0.41 0.00 0.00 0.00 0.00 46.02 43.80 2yuz n GLY 96 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2yuz s PRO 97 N -2.00 3.14 0.34 1.61 0.04 -1.26 -4.99 135.00 131.88 2yuz s PRO 97 Ca 0.00 1.07 0.08 0.00 0.04 0.00 0.00 61.00 62.19 2yuz s PRO 97 Cb 0.00 -4.23 -0.04 0.00 0.04 0.00 0.00 34.50 30.27 2yuz s PRO 97 CO 0.00 -2.10 0.13 -1.12 0.04 0.00 0.00 177.00 173.95 2yuz s SER 98 N 6.39 4.64 -0.28 6.66 0.01 -1.26 -5.14 113.70 124.72 2yuz s SER 98 Ca 0.72 -0.78 -0.18 0.00 1.31 0.00 0.00 55.95 57.02 2yuz s SER 98 Cb -0.18 -0.72 0.10 0.00 0.21 0.00 0.00 66.02 65.43 2yuz s SER 98 CO 0.29 -0.28 0.80 -0.94 0.41 0.00 0.00 173.24 173.52 2yuz s SER 99 N -3.83 -0.76 0.00 2.44 1.04 -1.26 -5.29 113.70 106.04 2yuz s SER 99 Ca 0.37 1.27 0.00 0.00 0.48 0.00 0.00 55.95 58.07 2yuz s SER 99 Cb -0.02 1.31 0.00 0.00 0.10 0.00 0.00 66.02 67.40 2yuz s SER 99 CO 0.22 -0.20 0.00 0.61 0.98 0.00 0.00 173.24 174.85