#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yuz s SER 2 N 0.00 1.55 -0.21 1.61 0.01 -1.26 -5.03 113.70 110.36 2yuz s SER 2 Ca 0.00 -0.79 -0.01 0.00 1.31 0.00 0.00 55.95 56.46 2yuz s SER 2 Cb 0.00 -0.01 0.14 0.00 0.21 0.00 0.00 66.02 66.36 2yuz s SER 2 CO 0.00 -0.23 2.01 -1.20 0.41 0.00 0.00 173.24 174.23 2yuz n SER 3 N 0.63 6.06 -0.09 2.44 7.64 -1.26 -4.84 113.62 124.20 2yuz n SER 3 Ca -0.16 -2.84 0.00 0.00 1.01 0.00 0.00 58.87 56.88 2yuz n SER 3 Cb 0.57 -1.08 0.00 0.00 -1.01 0.00 0.00 64.21 62.69 2yuz n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2yuz n GLY 4 N 0.74 3.46 3.70 0.23 0.00 -1.26 -5.16 105.19 106.90 2yuz n GLY 4 Ca 0.20 -0.94 -0.30 0.00 0.00 0.00 0.00 46.02 44.97 2yuz n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2yuz s SER 5 N 1.52 3.31 -1.09 1.61 0.15 -1.26 -4.92 113.70 113.02 2yuz s SER 5 Ca 0.00 1.53 -0.20 0.00 0.70 0.00 0.00 55.95 57.98 2yuz s SER 5 Cb 0.00 -2.21 0.07 0.00 -1.71 0.00 0.00 66.02 62.18 2yuz s SER 5 CO 0.00 -2.75 1.48 -0.44 1.20 0.00 0.00 173.24 172.73 2yuz s SER 6 N -3.32 6.65 0.00 5.45 0.01 -1.26 -4.82 113.70 116.40 2yuz s SER 6 Ca 0.64 -1.90 0.00 0.00 1.31 0.00 0.00 55.95 56.00 2yuz s SER 6 Cb -0.19 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.51 2yuz s SER 6 CO 0.57 -1.31 0.00 0.61 0.41 0.00 0.00 173.24 173.53 2yuz n GLY 7 N 6.11 2.05 3.73 3.44 0.00 -1.26 -4.98 105.19 114.28 2yuz n GLY 7 Ca 0.36 -1.94 -0.42 0.00 0.00 0.00 0.00 46.02 44.03 2yuz n GLY 7 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2yuz s LEU 8 N 0.00 4.38 -0.49 0.99 2.96 -1.26 -4.99 118.68 120.28 2yuz s LEU 8 Ca 0.00 2.48 0.03 0.00 -0.22 0.00 0.00 54.13 56.42 2yuz s LEU 8 Cb 0.00 -3.60 0.13 0.00 0.50 0.00 0.00 46.19 43.22 2yuz s LEU 8 CO 0.00 -0.68 0.24 -0.75 -1.32 0.00 0.00 176.35 173.84 2yuz s LYS 9 N 0.56 1.74 -0.26 1.98 2.20 -1.26 -5.04 119.74 119.66 2yuz s LYS 9 Ca 0.63 -2.39 -0.41 0.00 -0.36 0.00 0.00 55.97 53.43 2yuz s LYS 9 Cb -0.39 -3.02 -0.17 0.00 -1.51 0.00 0.00 37.83 32.74 2yuz s LYS 9 CO 0.35 -1.11 1.58 -0.89 -0.36 0.00 0.00 175.35 174.91 2yuz n ILE 10 N 3.31 0.15 -0.07 5.43 -0.00 -1.26 -4.03 119.36 122.88 2yuz n ILE 10 Ca 0.06 -0.03 -0.06 0.00 -0.00 0.00 0.00 62.75 62.72 2yuz n ILE 10 Cb 0.33 -0.85 -0.02 0.00 -0.00 0.00 0.00 39.64 39.10 2yuz n ILE 10 CO 0.00 0.00 0.00 0.18 -0.00 0.00 0.00 176.55 176.73 2yuz n LEU 11 N 4.20 1.60 -3.90 1.39 4.77 -1.01 -4.84 117.00 119.22 2yuz n LEU 11 Ca 0.26 0.42 -0.29 0.00 -0.03 0.00 0.00 56.01 56.37 2yuz n LEU 11 Cb 0.08 -0.76 -0.13 0.00 -2.33 0.00 0.00 43.42 40.28 2yuz n LEU 11 CO 0.79 -0.38 -0.15 -0.89 -1.33 0.00 0.00 177.39 175.42 2yuz s THR 12 N -2.37 2.49 0.44 -5.08 2.01 -0.39 -4.99 115.64 107.75 2yuz s THR 12 Ca -0.19 -3.50 -0.24 0.00 0.31 0.00 0.00 61.69 58.07 2yuz s THR 12 Cb 0.03 -2.70 -0.08 0.00 0.01 0.00 0.00 72.50 69.76 2yuz s THR 12 CO 0.28 -0.88 1.17 -2.16 -0.69 0.00 0.00 174.62 172.35 2yuz s PRO 13 N -0.55 3.86 0.19 4.92 0.04 -1.26 -0.97 135.00 141.24 2yuz s PRO 13 Ca 0.20 1.82 -0.29 0.00 0.04 0.00 0.00 61.00 62.77 2yuz s PRO 13 Cb -0.19 -2.51 -0.17 0.00 0.04 0.00 0.00 34.50 31.67 2yuz s PRO 13 CO -0.05 -0.48 0.58 1.28 0.04 0.00 0.00 177.00 178.37 2yuz n LEU 14 N -0.28 -1.01 -4.34 -3.56 4.77 -1.26 -4.94 117.00 106.38 2yuz n LEU 14 Ca 0.06 1.13 -0.33 0.00 -0.03 0.00 0.00 56.01 56.85 2yuz n LEU 14 Cb 0.47 -0.97 -0.15 0.00 -2.33 0.00 0.00 43.42 40.45 2yuz n LEU 14 CO 0.49 -2.84 -0.48 0.42 -1.33 0.00 0.00 177.39 173.65 2yuz s THR 15 N -0.95 2.80 0.20 -5.08 -4.23 -1.26 -4.80 115.64 102.32 2yuz s THR 15 Ca 0.65 -0.76 -0.19 0.00 -1.18 0.00 0.00 61.69 60.22 2yuz s THR 15 Cb -0.93 -2.15 -0.12 0.00 1.34 0.00 0.00 72.50 70.64 2yuz s THR 15 CO 0.56 0.54 0.26 0.47 -0.54 0.00 0.00 174.62 175.91 2yuz n ASP 16 N 3.46 -1.34 -3.84 3.99 8.00 -1.26 -4.90 116.55 120.65 2yuz n ASP 16 Ca -0.18 0.74 -0.21 0.00 0.71 0.00 0.00 54.79 55.84 2yuz n ASP 16 Cb 0.53 -0.67 -0.17 0.00 -0.02 0.00 0.00 41.12 40.79 2yuz n ASP 16 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 2yuz s GLN 17 N -0.73 0.73 -0.24 -1.24 -1.52 -0.97 -4.99 119.66 110.70 2yuz s GLN 17 Ca 0.45 -0.02 0.02 0.00 -1.95 0.00 0.00 55.36 53.87 2yuz s GLN 17 Cb -0.60 -0.89 0.05 0.00 -0.22 0.00 0.00 33.01 31.34 2yuz s GLN 17 CO 0.43 -0.18 -0.13 0.99 -0.25 0.00 0.00 175.29 176.15 2yuz s THR 18 N 1.36 2.20 0.35 -0.19 2.01 -1.26 -2.79 115.64 117.31 2yuz s THR 18 Ca -0.04 -1.42 0.04 0.00 0.31 0.00 0.00 61.69 60.58 2yuz s THR 18 Cb -0.13 -2.19 -0.02 0.00 0.01 0.00 0.00 72.50 70.17 2yuz s THR 18 CO -0.02 0.12 0.16 1.33 -0.69 0.00 0.00 174.62 175.52 2yuz n VAL 19 N 4.50 0.00 -2.79 3.82 0.24 -1.13 -5.03 118.33 117.93 2yuz n VAL 19 Ca -0.16 -2.14 -0.20 0.00 -2.04 0.00 0.00 64.34 59.80 2yuz n VAL 19 Cb 0.44 0.84 0.04 0.00 -1.47 0.00 0.00 33.84 33.69 2yuz n VAL 19 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 2yuz s ASN 20 N -3.21 5.30 0.29 -1.34 0.01 -1.26 -2.29 114.94 112.45 2yuz s ASN 20 Ca 0.23 -0.25 -0.29 0.00 -0.71 0.00 0.00 52.86 51.83 2yuz s ASN 20 Cb 0.01 -0.62 -0.10 0.00 0.41 0.00 0.00 41.25 40.95 2yuz s ASN 20 CO 0.16 -1.10 1.17 -0.22 -1.51 0.00 0.00 177.10 175.60 2yuz s LEU 21 N -4.65 4.51 0.00 0.60 2.96 -0.93 -3.05 118.68 118.12 2yuz s LEU 21 Ca 0.58 2.40 0.00 0.00 -0.22 0.00 0.00 54.13 56.89 2yuz s LEU 21 Cb -0.09 -3.63 0.00 0.00 0.50 0.00 0.00 46.19 42.96 2yuz s LEU 21 CO 0.37 -0.27 0.00 0.61 -1.32 0.00 0.00 176.35 175.74 2yuz n GLY 22 N 1.11 2.71 3.33 7.98 0.00 0.17 -4.84 105.19 115.65 2yuz n GLY 22 Ca -0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.16 -2.39 -3.28 1.61 4.76 -1.17 -3.51 118.16 114.01 2yuz n LYS 23 Ca 0.00 -0.68 -0.46 0.00 -2.87 0.00 0.00 58.31 54.29 2yuz n LYS 23 Cb 0.00 -1.89 -0.04 0.00 -1.84 0.00 0.00 35.03 31.27 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 -3.96 3.28 0.81 1.97 2.12 -1.26 -1.64 118.70 120.02 2yuz s GLU 24 Ca 0.61 -1.99 -0.14 0.00 0.36 0.00 0.00 54.97 53.81 2yuz s GLU 24 Cb -0.17 -4.38 0.06 0.00 0.26 0.00 0.00 34.13 29.91 2yuz s GLU 24 CO 0.63 -1.35 1.06 -0.89 -0.54 0.00 0.00 175.26 174.17 2yuz n ILE 25 N 4.75 1.88 -3.71 -3.70 5.41 -1.15 -4.81 119.36 118.04 2yuz n ILE 25 Ca -0.00 -0.23 -0.12 0.00 1.00 0.00 0.00 62.75 63.40 2yuz n ILE 25 Cb 0.44 -1.10 -0.12 0.00 -0.71 0.00 0.00 39.64 38.15 2yuz n ILE 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2yuz s LEU 27 N 1.44 0.15 0.28 0.00 1.43 0.69 -4.96 118.68 117.72 2yuz s LEU 27 Ca -0.08 -0.31 0.11 0.00 -1.03 0.00 0.00 54.13 52.81 2yuz s LEU 27 Cb -0.10 -0.01 -0.05 0.00 0.03 0.00 0.00 46.19 46.07 2yuz s LEU 27 CO -0.10 -0.32 -0.10 -0.75 0.23 0.00 0.00 176.35 175.30 2yuz s LYS 28 N 2.21 1.96 0.14 1.70 2.20 -1.26 -0.50 119.74 126.19 2yuz s LYS 28 Ca 0.04 -1.63 -0.10 0.00 -0.36 0.00 0.00 55.97 53.91 2yuz s LYS 28 Cb -0.15 -1.94 0.00 0.00 -1.51 0.00 0.00 37.83 34.24 2yuz s LYS 28 CO -0.09 0.33 0.29 0.00 -0.36 0.00 0.00 175.35 175.52 2yuz s GLU 30 N -3.91 0.68 0.43 0.00 2.12 -0.14 -1.19 118.70 116.69 2yuz s GLU 30 Ca 0.11 0.07 0.07 0.00 0.36 0.00 0.00 54.97 55.59 2yuz s GLU 30 Cb 0.03 -0.99 -0.04 0.00 0.26 0.00 0.00 34.13 33.39 2yuz s GLU 30 CO -0.05 -0.28 0.24 0.96 -0.54 0.00 0.00 175.26 175.59 2yuz s ILE 31 N 1.87 2.27 -0.51 -3.70 -4.36 0.29 -1.27 121.20 115.80 2yuz s ILE 31 Ca 0.04 -1.62 0.02 0.00 -0.26 0.00 0.00 60.65 58.83 2yuz s ILE 31 Cb -0.12 -2.89 0.59 0.00 1.25 0.00 0.00 42.46 41.28 2yuz s ILE 31 CO -0.05 0.00 1.91 -1.54 0.24 0.00 0.00 174.94 175.50 2yuz n SER 32 N -1.35 4.93 -3.46 4.36 3.41 -1.26 -4.81 113.62 115.44 2yuz n SER 32 Ca -0.01 -3.68 -0.12 0.00 -0.26 0.00 0.00 58.87 54.80 2yuz n SER 32 Cb 0.64 -0.86 -0.03 0.00 -0.26 0.00 0.00 64.21 63.70 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 -3.47 1.14 -0.95 4.33 2.02 -1.26 -4.80 118.70 115.71 2yuz s GLU 33 Ca 0.59 -0.31 -0.03 0.00 0.02 0.00 0.00 54.97 55.24 2yuz s GLU 33 Cb 0.48 0.53 0.24 0.00 0.10 0.00 0.00 34.13 35.48 2yuz s GLU 33 CO 0.06 -0.47 0.91 -1.71 0.02 0.00 0.00 175.26 174.07 2yuz n ASN 34 N -0.12 4.63 -4.01 -0.19 2.85 -1.26 -4.39 115.26 112.77 2yuz n ASN 34 Ca -0.16 -3.15 -0.14 0.00 -0.11 0.00 0.00 54.58 51.03 2yuz n ASN 34 Cb 0.63 -1.12 -0.12 0.00 1.24 0.00 0.00 39.78 40.40 2yuz n ASN 34 CO 0.00 0.00 0.00 0.27 -2.11 0.00 0.00 177.26 175.42 2yuz s ILE 35 N -1.52 0.44 0.33 -1.44 -5.25 -1.26 -5.03 121.20 107.47 2yuz s ILE 35 Ca 0.29 -0.74 -0.28 0.00 -0.99 0.00 0.00 60.65 58.93 2yuz s ILE 35 Cb -0.06 -0.47 -0.10 0.00 2.95 0.00 0.00 42.46 44.78 2yuz s ILE 35 CO -0.10 -0.21 1.22 -2.16 -1.79 0.00 0.00 174.94 171.90 2yuz s PRO 36 N -1.02 4.39 0.18 0.37 0.04 -1.26 -4.93 135.00 132.77 2yuz s PRO 36 Ca -0.06 2.03 -0.00 0.00 0.04 0.00 0.00 61.00 63.01 2yuz s PRO 36 Cb -0.07 -3.04 -0.04 0.00 0.04 0.00 0.00 34.50 31.38 2yuz s PRO 36 CO 0.00 -0.08 0.07 0.20 0.04 0.00 0.00 177.00 177.23 2yuz s GLY 37 N -0.71 1.29 0.02 0.56 0.00 -1.26 -2.22 107.32 105.00 2yuz s GLY 37 Ca 0.49 -1.63 0.05 0.00 0.00 0.00 0.00 44.72 43.63 2yuz s GLY 37 CO 0.47 -1.45 -0.15 0.54 0.00 0.00 0.00 173.10 172.51 2yuz s LYS 38 N -4.05 1.07 0.63 2.90 1.02 -0.64 -4.93 119.74 115.74 2yuz s LYS 38 Ca 0.31 -0.68 -0.06 0.00 0.02 0.00 0.00 55.97 55.55 2yuz s LYS 38 Cb 0.07 -1.07 0.02 0.00 -0.52 0.00 0.00 37.83 36.33 2yuz s LYS 38 CO 0.07 0.28 0.94 -1.58 -0.92 0.00 0.00 175.35 174.14 2yuz s TRP 39 N -0.64 3.17 -0.12 3.18 0.52 -1.26 -1.31 118.94 122.48 2yuz s TRP 39 Ca 0.04 0.61 -0.08 0.00 0.02 0.00 0.00 56.10 56.68 2yuz s TRP 39 Cb -0.07 -2.87 0.04 0.00 -1.15 0.00 0.00 33.47 29.42 2yuz s TRP 39 CO 0.01 -0.99 0.29 0.95 0.02 0.00 0.00 176.95 177.22 2yuz s THR 40 N -3.07 -0.02 -0.04 2.01 -4.23 0.30 -3.39 115.64 107.20 2yuz s THR 40 Ca 0.56 0.08 0.01 0.00 -1.18 0.00 0.00 61.69 61.15 2yuz s THR 40 Cb -0.11 -0.43 -0.03 0.00 1.34 0.00 0.00 72.50 73.27 2yuz s THR 40 CO 0.45 0.03 -0.03 -0.75 -0.54 0.00 0.00 174.62 173.79 2yuz s LYS 41 N 0.81 2.80 -1.63 3.99 2.20 0.13 -1.90 119.74 126.14 2yuz s LYS 41 Ca -0.05 -0.55 -0.21 0.00 -0.36 0.00 0.00 55.97 54.80 2yuz s LYS 41 Cb -0.06 -2.66 0.21 0.00 -1.51 0.00 0.00 37.83 33.80 2yuz s LYS 41 CO -0.05 0.66 0.51 0.09 -0.36 0.00 0.00 175.35 176.20 2yuz n ASN 42 N 1.85 -1.57 -2.40 1.43 5.03 -1.22 0.12 115.26 118.51 2yuz n ASN 42 Ca -0.17 -1.08 -0.12 0.00 0.87 0.00 0.00 54.58 54.09 2yuz n ASN 42 Cb 0.53 -1.38 0.05 0.00 -1.02 0.00 0.00 39.78 37.96 2yuz n ASN 42 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2yuz n GLY 43 N -0.99 0.00 3.33 7.41 0.00 -1.26 -5.04 105.19 108.64 2yuz n GLY 43 Ca 0.10 -0.13 -0.14 0.00 0.00 0.00 0.00 46.02 45.85 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 -4.64 0.35 -0.39 0.99 1.43 0.33 -5.12 118.68 111.63 2yuz s LEU 44 Ca 0.13 0.11 -0.28 0.00 -1.03 0.00 0.00 54.13 53.05 2yuz s LEU 44 Cb -0.06 1.76 -0.01 0.00 0.03 0.00 0.00 46.19 47.91 2yuz s LEU 44 CO 0.43 -0.62 1.73 -2.16 0.23 0.00 0.00 176.35 175.96 2yuz s PRO 45 N -2.10 3.29 -0.01 1.29 0.04 -1.26 0.18 135.00 136.43 2yuz s PRO 45 Ca -0.08 1.21 -0.30 0.00 0.04 0.00 0.00 61.00 61.88 2yuz s PRO 45 Cb -0.02 -4.19 -0.07 0.00 0.04 0.00 0.00 34.50 30.26 2yuz s PRO 45 CO 0.00 -1.92 1.82 0.08 0.04 0.00 0.00 177.00 177.03 2yuz s VAL 46 N 6.88 3.29 -0.77 -0.36 1.01 -1.22 -4.89 120.40 124.35 2yuz s VAL 46 Ca 0.74 0.36 -0.26 0.00 0.00 0.00 0.00 61.98 62.82 2yuz s VAL 46 Cb -0.19 -3.23 0.04 0.00 0.00 0.00 0.00 36.38 32.99 2yuz s VAL 46 CO 0.32 -0.04 1.27 -1.10 0.00 0.00 0.00 175.10 175.55 2yuz s GLN 47 N 4.30 3.23 0.50 2.72 -1.52 -1.26 -4.93 119.66 122.70 2yuz s GLN 47 Ca 0.81 -0.40 -0.19 0.00 -1.95 0.00 0.00 55.36 53.63 2yuz s GLN 47 Cb -0.38 -4.33 -0.12 0.00 -0.22 0.00 0.00 33.01 27.97 2yuz s GLN 47 CO 0.36 -2.13 0.35 0.39 -0.25 0.00 0.00 175.29 174.01 2yuz n GLU 48 N 9.16 0.37 -3.69 2.91 1.02 -1.26 -4.98 120.64 124.17 2yuz n GLU 48 Ca 0.06 0.14 -0.12 0.00 -0.02 0.00 0.00 57.16 57.22 2yuz n GLU 48 Cb 0.49 -1.44 -0.06 0.00 -0.02 0.00 0.00 31.44 30.41 2yuz n GLU 48 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2yuz s SER 49 N -1.06 -0.22 0.49 1.62 1.04 -0.98 -4.97 113.70 109.62 2yuz s SER 49 Ca 0.64 -0.11 0.44 0.00 0.48 0.00 0.00 55.95 57.40 2yuz s SER 49 Cb -0.51 0.41 1.52 0.00 0.10 0.00 0.00 66.02 67.54 2yuz s SER 49 CO 0.59 -0.67 1.37 -0.90 0.98 0.00 0.00 173.24 174.60 2yuz n ASP 50 N 0.43 0.00 -0.07 7.02 5.75 -1.26 0.63 116.55 129.07 2yuz n ASP 50 Ca -0.18 0.88 -0.09 0.00 -0.01 0.00 0.00 54.79 55.39 2yuz n ASP 50 Cb 0.60 -0.44 -0.07 0.00 -1.03 0.00 0.00 41.12 40.18 2yuz n ASP 50 CO 0.00 0.00 0.00 0.03 -0.11 0.00 0.00 177.20 177.12 2yuz h ARG 51 N 0.00 0.00 -5.64 0.11 3.08 -1.98 -3.44 114.38 106.50 2yuz h ARG 51 Ca 0.83 0.00 -0.60 0.00 0.07 0.00 0.00 59.98 60.28 2yuz h ARG 51 Cb 3.32 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 33.27 2yuz h ARG 51 CO -0.01 0.58 0.26 -1.17 -1.07 0.00 0.00 179.97 178.55 2yuz s LEU 52 N -8.32 4.09 -0.00 3.04 0.20 0.21 -3.54 118.68 114.35 2yuz s LEU 52 Ca -0.12 0.85 0.07 0.00 0.69 0.00 0.00 54.13 55.62 2yuz s LEU 52 Cb -0.01 -2.98 -0.02 0.00 -0.43 0.00 0.00 46.19 42.75 2yuz s LEU 52 CO 0.40 -0.40 -0.22 -1.59 -0.29 0.00 0.00 176.35 174.25 2yuz s LYS 53 N 2.50 1.74 -0.53 1.98 0.00 -1.26 -2.32 119.74 121.85 2yuz s LYS 53 Ca 0.30 -0.85 -0.07 0.00 0.00 0.00 0.00 55.97 55.35 2yuz s LYS 53 Cb -0.16 -1.73 0.14 0.00 0.00 0.00 0.00 37.83 36.08 2yuz s LYS 53 CO 0.09 0.47 0.38 0.08 0.00 0.00 0.00 175.35 176.36 2yuz s VAL 54 N -0.59 4.04 0.00 1.79 1.01 -1.26 -4.14 120.40 121.24 2yuz s VAL 54 Ca 0.09 -2.16 -0.17 0.00 0.00 0.00 0.00 61.98 59.73 2yuz s VAL 54 Cb -0.09 -3.66 -0.06 0.00 0.00 0.00 0.00 36.38 32.58 2yuz s VAL 54 CO -0.00 -0.81 0.47 -0.69 0.00 0.00 0.00 175.10 174.08 2yuz s VAL 55 N 0.89 4.96 -0.04 2.92 1.01 -0.65 -4.99 120.40 124.50 2yuz s VAL 55 Ca 0.10 0.99 0.04 0.00 0.00 0.00 0.00 61.98 63.10 2yuz s VAL 55 Cb -0.23 -3.79 -0.00 0.00 0.00 0.00 0.00 36.38 32.36 2yuz s VAL 55 CO -0.03 0.52 -0.16 -1.58 0.00 0.00 0.00 175.10 173.86 2yuz s GLN 56 N -0.78 1.70 -0.38 2.72 0.74 -1.26 -0.98 119.66 121.42 2yuz s GLN 56 Ca 0.26 -0.55 0.01 0.00 0.05 0.00 0.00 55.36 55.12 2yuz s GLN 56 Cb -0.17 -1.47 0.12 0.00 1.10 0.00 0.00 33.01 32.59 2yuz s GLN 56 CO 0.15 0.20 0.17 0.15 -0.55 0.00 0.00 175.29 175.41 2yuz s LYS 57 N 0.13 1.04 3.01 1.67 -0.14 -0.13 -5.01 119.74 120.32 2yuz s LYS 57 Ca -0.05 -1.61 0.00 0.00 -1.36 0.00 0.00 55.97 52.95 2yuz s LYS 57 Cb -0.12 -2.19 0.00 0.00 -1.68 0.00 0.00 37.83 33.84 2yuz s LYS 57 CO 0.02 -1.09 0.00 0.41 -0.76 0.00 0.00 175.35 173.94 2yuz n GLY 58 N 4.10 0.30 0.49 -3.33 0.00 -1.26 -0.78 105.19 104.71 2yuz n GLY 58 Ca 0.05 0.66 0.07 0.00 0.00 0.00 0.00 46.02 46.79 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 0.00 1.29 -3.91 1.61 1.74 -1.26 -4.35 116.66 111.77 2yuz n ARG 59 Ca 0.00 -2.86 -0.25 0.00 -0.77 0.00 0.00 57.85 53.96 2yuz n ARG 59 Cb 0.00 -1.40 -0.17 0.00 -1.02 0.00 0.00 32.46 29.87 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 -2.71 0.85 0.26 0.55 1.01 0.04 -0.55 121.20 120.65 2yuz s ILE 60 Ca 0.34 -0.19 -0.10 0.00 0.00 0.00 0.00 60.65 60.70 2yuz s ILE 60 Cb 0.33 -0.90 -0.07 0.00 0.01 0.00 0.00 42.46 41.82 2yuz s ILE 60 CO -0.04 0.34 0.60 -1.00 0.00 0.00 0.00 174.94 174.83 2yuz s HIS 61 N 1.70 3.42 -0.06 3.97 3.76 -0.33 -0.95 115.29 126.80 2yuz s HIS 61 Ca 0.04 0.93 -0.07 0.00 -0.15 0.00 0.00 55.06 55.80 2yuz s HIS 61 Cb -0.13 -2.31 0.02 0.00 1.11 0.00 0.00 32.58 31.27 2yuz s HIS 61 CO -0.07 0.20 0.20 0.21 -0.85 0.00 0.00 174.74 174.44 2yuz s LYS 62 N -2.98 0.29 -0.25 1.40 2.20 -0.15 -0.47 119.74 119.78 2yuz s LYS 62 Ca 0.49 0.17 -0.05 0.00 -0.36 0.00 0.00 55.97 56.21 2yuz s LYS 62 Cb -0.11 0.14 0.13 0.00 -1.51 0.00 0.00 37.83 36.48 2yuz s LYS 62 CO 0.22 -0.05 0.47 -1.17 -0.36 0.00 0.00 175.35 174.46 2yuz s LEU 63 N -0.16 -0.85 -0.14 5.43 0.20 0.34 -1.64 118.68 121.86 2yuz s LEU 63 Ca -0.03 0.78 -0.00 0.00 0.69 0.00 0.00 54.13 55.57 2yuz s LEU 63 Cb -0.02 1.55 0.03 0.00 -0.43 0.00 0.00 46.19 47.31 2yuz s LEU 63 CO 0.01 -0.26 -0.10 0.68 -0.29 0.00 0.00 176.35 176.38 2yuz s VAL 64 N 2.67 1.30 0.32 1.68 -7.23 -1.26 -0.22 120.40 117.66 2yuz s VAL 64 Ca 0.07 -0.50 -0.27 0.00 -1.81 0.00 0.00 61.98 59.47 2yuz s VAL 64 Cb -0.14 -1.29 -0.09 0.00 0.56 0.00 0.00 36.38 35.42 2yuz s VAL 64 CO -0.16 0.37 1.02 -0.63 -0.31 0.00 0.00 175.10 175.39 2yuz s ILE 65 N 1.59 3.83 0.02 -0.62 1.01 -0.98 -4.43 121.20 121.62 2yuz s ILE 65 Ca 0.04 1.63 -0.23 0.00 0.00 0.00 0.00 60.65 62.10 2yuz s ILE 65 Cb -0.13 -3.96 -0.16 0.00 0.01 0.00 0.00 42.46 38.22 2yuz s ILE 65 CO -0.09 0.23 1.36 0.00 0.00 0.00 0.00 174.94 176.43 2yuz h ALA 66 N 3.34 0.12 -3.18 9.38 0.00 -1.87 -3.04 119.26 124.01 2yuz h ALA 66 Ca -0.47 -0.26 -0.52 0.00 0.00 0.00 0.00 54.91 53.66 2yuz h ALA 66 Cb 1.21 -0.03 -0.37 0.00 0.00 0.00 0.00 17.79 18.60 2yuz h ALA 66 CO 0.65 -0.10 -0.80 -0.80 0.00 0.00 0.00 179.25 178.20 2yuz s ASN 67 N -5.86 2.16 -0.05 0.00 -0.87 -1.26 -4.42 114.94 104.64 2yuz s ASN 67 Ca -0.15 -0.30 -0.30 0.00 -1.57 0.00 0.00 52.86 50.55 2yuz s ASN 67 Cb 0.04 -0.83 -0.05 0.00 -0.02 0.00 0.00 41.25 40.40 2yuz s ASN 67 CO 0.71 -0.12 1.50 0.00 -2.57 0.00 0.00 177.10 176.62 2yuz s ALA 68 N 1.72 3.62 0.27 0.60 0.00 -0.65 -4.78 121.76 122.54 2yuz s ALA 68 Ca 0.05 0.84 0.07 0.00 0.00 0.00 0.00 51.96 52.92 2yuz s ALA 68 Cb -0.13 -3.67 -0.06 0.00 0.00 0.00 0.00 23.12 19.27 2yuz s ALA 68 CO -0.08 -1.19 -0.07 -0.51 0.00 0.00 0.00 175.76 173.90 2yuz s LEU 69 N 3.36 2.49 0.54 0.00 1.43 -1.26 -0.65 118.68 124.58 2yuz s LEU 69 Ca 0.67 -1.16 0.21 0.00 -1.03 0.00 0.00 54.13 52.82 2yuz s LEU 69 Cb -0.31 -0.65 1.41 0.00 0.03 0.00 0.00 46.19 46.67 2yuz s LEU 69 CO 0.26 -0.31 2.13 0.71 0.23 0.00 0.00 176.35 179.37 2yuz h THR 70 N 2.32 0.83 0.00 5.49 1.35 -1.95 0.12 112.91 121.07 2yuz h THR 70 Ca -0.40 0.00 -0.02 0.00 -0.55 0.00 0.00 66.41 65.45 2yuz h THR 70 Cb 1.23 0.93 -0.00 0.00 -1.73 0.00 0.00 68.15 68.58 2yuz h THR 70 CO 0.66 0.00 -0.08 -0.33 -0.25 0.00 0.00 175.52 175.52 2yuz h GLU 71 N 0.00 0.00 0.00 4.72 5.08 -1.99 -1.07 114.58 121.32 2yuz h GLU 71 Ca 0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 2yuz h GLU 71 Cb 0.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.50 2yuz h GLU 71 CO -0.00 0.08 0.00 -0.44 -1.00 0.00 0.00 179.01 177.65 2yuz h ASP 72 N 0.00 0.00 -3.41 1.42 3.32 -1.37 -3.42 116.42 112.96 2yuz h ASP 72 Ca -0.00 0.00 -0.57 0.00 0.02 0.00 0.00 57.03 56.48 2yuz h ASP 72 Cb 0.26 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 39.75 2yuz h ASP 72 CO 0.01 0.00 0.86 -0.70 -1.72 0.00 0.00 179.24 177.69 2yuz s GLU 73 N -3.43 3.98 0.00 3.56 2.12 -0.41 -4.71 118.70 119.82 2yuz s GLU 73 Ca 0.04 0.95 0.00 0.00 0.36 0.00 0.00 54.97 56.32 2yuz s GLU 73 Cb 0.09 -3.78 0.00 0.00 0.26 0.00 0.00 34.13 30.70 2yuz s GLU 73 CO 0.54 -1.02 0.00 0.41 -0.54 0.00 0.00 175.26 174.65 2yuz n GLY 74 N 4.11 -1.12 3.26 -1.50 0.00 -1.26 -5.06 105.19 103.62 2yuz n GLY 74 Ca 0.12 0.67 -0.09 0.00 0.00 0.00 0.00 46.02 46.72 2yuz n GLY 74 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2yuz s ASP 75 N -4.00 -0.33 -0.15 1.61 1.01 -1.26 -4.20 116.67 109.34 2yuz s ASP 75 Ca 0.00 0.94 -0.14 0.00 0.71 0.00 0.00 52.55 54.05 2yuz s ASP 75 Cb 0.00 1.09 -0.05 0.00 1.01 0.00 0.00 42.92 44.97 2yuz s ASP 75 CO 0.00 -0.22 0.32 -0.31 0.21 0.00 0.00 175.17 175.18 2yuz s TYR 76 N 2.12 3.48 -0.02 4.23 1.51 -0.47 -3.40 117.35 124.79 2yuz s TYR 76 Ca -0.05 0.65 0.00 0.00 -1.01 0.00 0.00 57.07 56.67 2yuz s TYR 76 Cb -0.11 -2.37 0.03 0.00 -0.11 0.00 0.00 41.96 39.40 2yuz s TYR 76 CO -0.13 0.24 0.01 0.08 -1.11 0.00 0.00 175.55 174.64 2yuz s VAL 77 N 0.44 0.11 -0.10 0.71 1.01 -0.80 -1.09 120.40 120.68 2yuz s VAL 77 Ca 0.18 0.11 0.01 0.00 0.00 0.00 0.00 61.98 62.28 2yuz s VAL 77 Cb -0.13 -0.21 -0.02 0.00 0.00 0.00 0.00 36.38 36.02 2yuz s VAL 77 CO 0.05 0.12 -0.14 0.12 0.00 0.00 0.00 175.10 175.25 2yuz s PHE 78 N 0.94 2.77 -0.07 5.22 5.36 -1.22 0.11 117.98 131.09 2yuz s PHE 78 Ca -0.09 -0.49 -0.00 0.00 -0.96 0.00 0.00 56.93 55.38 2yuz s PHE 78 Cb -0.12 -1.77 0.02 0.00 -0.34 0.00 0.00 43.02 40.81 2yuz s PHE 78 CO -0.02 -0.08 -0.03 0.00 -1.46 0.00 0.00 175.22 173.63 2yuz s ALA 79 N -0.01 0.79 0.64 11.12 0.00 -0.43 -2.64 121.76 131.24 2yuz s ALA 79 Ca -0.04 -0.16 -0.16 0.00 0.00 0.00 0.00 51.96 51.60 2yuz s ALA 79 Cb -0.14 -0.64 -0.01 0.00 0.00 0.00 0.00 23.12 22.32 2yuz s ALA 79 CO 0.04 -0.28 1.11 -1.25 0.00 0.00 0.00 175.76 175.39 2yuz s PRO 80 N 1.52 2.88 -0.02 0.00 0.04 -1.26 -1.62 135.00 136.55 2yuz s PRO 80 Ca -0.01 1.42 0.04 0.00 0.04 0.00 0.00 61.00 62.49 2yuz s PRO 80 Cb -0.13 -1.96 0.16 0.00 0.04 0.00 0.00 34.50 32.61 2yuz s PRO 80 CO -0.03 -1.19 1.01 -3.47 0.04 0.00 0.00 177.00 173.36 2yuz n ASP 81 N -2.26 1.26 0.00 6.66 2.03 -0.94 -3.54 116.55 119.75 2yuz n ASP 81 Ca 0.11 -2.07 0.00 0.00 0.52 0.00 0.00 54.79 53.35 2yuz n ASP 81 Cb 0.52 -0.25 0.00 0.00 -0.72 0.00 0.00 41.12 40.67 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 0.03 1.92 -2.57 -1.67 0.00 -1.26 -5.08 120.51 111.88 2yuz n ALA 82 Ca 0.06 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.23 2yuz n ALA 82 Cb 0.24 0.26 -0.09 0.00 0.00 0.00 0.00 19.45 19.86 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 -1.91 1.93 -0.32 0.00 1.51 -1.23 -5.05 117.35 112.27 2yuz s TYR 83 Ca 0.00 -1.05 0.08 0.00 -1.01 0.00 0.00 57.07 55.09 2yuz s TYR 83 Cb 0.00 -1.37 0.57 0.00 -0.11 0.00 0.00 41.96 41.05 2yuz s TYR 83 CO 0.00 -0.01 1.61 0.09 -1.11 0.00 0.00 175.55 176.13 2yuz n ASN 84 N -1.10 3.14 -4.82 2.29 4.13 -1.26 -4.18 115.26 113.46 2yuz n ASN 84 Ca -0.08 -3.62 -0.33 0.00 1.68 0.00 0.00 54.58 52.23 2yuz n ASN 84 Cb 0.66 -0.69 -0.07 0.00 -1.54 0.00 0.00 39.78 38.15 2yuz n ASN 84 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 2yuz s VAL 85 N -3.20 4.30 -0.00 2.41 0.11 -1.26 -5.03 120.40 117.73 2yuz s VAL 85 Ca 0.48 1.45 0.02 0.00 -2.93 0.00 0.00 61.98 61.01 2yuz s VAL 85 Cb 0.42 -3.60 -0.01 0.00 -1.53 0.00 0.00 36.38 31.67 2yuz s VAL 85 CO 0.05 -0.29 -0.07 0.42 -3.33 0.00 0.00 175.10 171.88 2yuz s THR 86 N -2.13 0.57 -0.34 5.04 -4.23 -1.26 -4.15 115.64 109.15 2yuz s THR 86 Ca 0.62 -0.34 0.01 0.00 -1.18 0.00 0.00 61.69 60.80 2yuz s THR 86 Cb -0.10 -0.49 0.09 0.00 1.34 0.00 0.00 72.50 73.34 2yuz s THR 86 CO 0.14 0.14 0.05 -0.76 -0.54 0.00 0.00 174.62 173.66 2yuz s LEU 87 N -0.22 4.50 0.39 4.79 1.02 -1.08 -4.92 118.68 123.16 2yuz s LEU 87 Ca 0.02 -1.83 -0.26 0.00 0.02 0.00 0.00 54.13 52.09 2yuz s LEU 87 Cb -0.03 -1.68 -0.09 0.00 0.02 0.00 0.00 46.19 44.41 2yuz s LEU 87 CO -0.00 -0.37 1.20 -2.16 0.02 0.00 0.00 176.35 175.04 2yuz s PRO 88 N 1.06 4.09 -0.16 1.29 0.04 -1.26 -3.40 135.00 136.66 2yuz s PRO 88 Ca 0.04 1.91 -0.08 0.00 0.04 0.00 0.00 61.00 62.91 2yuz s PRO 88 Cb -0.20 -2.75 0.06 0.00 0.04 0.00 0.00 34.50 31.65 2yuz s PRO 88 CO -0.05 -0.31 0.37 0.00 0.04 0.00 0.00 177.00 177.05 2yuz s ALA 89 N -1.35 -0.95 0.07 8.56 0.00 -0.25 -4.73 121.76 123.12 2yuz s ALA 89 Ca 0.56 1.40 -0.22 0.00 0.00 0.00 0.00 51.96 53.69 2yuz s ALA 89 Cb -0.33 -0.95 -0.07 0.00 0.00 0.00 0.00 23.12 21.78 2yuz s ALA 89 CO 0.41 -0.36 0.66 0.21 0.00 0.00 0.00 175.76 176.68 2yuz s LYS 90 N 1.64 4.36 0.12 0.00 2.20 -1.26 -1.36 119.74 125.43 2yuz s LYS 90 Ca -0.08 0.89 0.06 0.00 -0.36 0.00 0.00 55.97 56.48 2yuz s LYS 90 Cb -0.10 -3.29 -0.04 0.00 -1.51 0.00 0.00 37.83 32.90 2yuz s LYS 90 CO -0.12 0.51 -0.14 0.14 -0.36 0.00 0.00 175.35 175.38 2yuz s VAL 91 N -0.75 1.30 -0.14 4.02 -7.23 -1.26 -2.29 120.40 114.05 2yuz s VAL 91 Ca 0.32 -1.69 -0.08 0.00 -1.81 0.00 0.00 61.98 58.73 2yuz s VAL 91 Cb -0.20 -1.50 0.05 0.00 0.56 0.00 0.00 36.38 35.29 2yuz s VAL 91 CO 0.21 -0.41 0.35 -2.28 -0.31 0.00 0.00 175.10 172.66 2yuz s HIS 92 N -2.09 -0.49 -0.13 2.82 2.46 -1.12 -4.34 115.29 112.40 2yuz s HIS 92 Ca 0.08 1.08 0.02 0.00 0.47 0.00 0.00 55.06 56.71 2yuz s HIS 92 Cb -0.05 0.18 0.00 0.00 -0.13 0.00 0.00 32.58 32.58 2yuz s HIS 92 CO 0.03 -0.29 -0.21 0.54 -2.47 0.00 0.00 174.74 172.34 2yuz s VAL 93 N 1.22 2.25 -0.12 0.89 0.11 -1.26 -2.83 120.40 120.66 2yuz s VAL 93 Ca -0.08 -0.93 -0.27 0.00 -2.93 0.00 0.00 61.98 57.77 2yuz s VAL 93 Cb -0.08 -1.90 -0.02 0.00 -1.53 0.00 0.00 36.38 32.85 2yuz s VAL 93 CO -0.10 0.54 0.88 -0.63 -3.33 0.00 0.00 175.10 172.47 2yuz s ILE 94 N 0.65 4.87 -0.01 7.04 1.01 -0.97 -4.92 121.20 128.86 2yuz s ILE 94 Ca -0.10 1.77 -0.29 0.00 0.00 0.00 0.00 60.65 62.03 2yuz s ILE 94 Cb -0.16 -4.20 -0.03 0.00 0.01 0.00 0.00 42.46 38.08 2yuz s ILE 94 CO 0.02 0.06 0.93 -0.94 0.00 0.00 0.00 174.94 175.00 2yuz s SER 95 N 1.08 7.30 0.57 3.58 1.04 -1.26 -2.20 113.70 123.81 2yuz s SER 95 Ca 0.42 1.57 0.06 0.00 0.48 0.00 0.00 55.95 58.49 2yuz s SER 95 Cb -0.18 -2.54 0.06 0.00 0.10 0.00 0.00 66.02 63.47 2yuz s SER 95 CO 0.16 -0.23 0.54 0.61 0.98 0.00 0.00 173.24 175.30 2yuz n GLY 96 N 2.93 2.51 0.21 7.32 0.00 -1.26 -5.01 105.19 111.90 2yuz n GLY 96 Ca 0.05 -2.28 0.08 0.00 0.00 0.00 0.00 46.02 43.86 2yuz n GLY 96 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yuz h PRO 97 N 0.00 0.00 -6.01 1.61 0.13 -2.02 -3.44 132.00 122.27 2yuz h PRO 97 Ca -0.33 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 64.11 2yuz h PRO 97 Cb 1.29 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.41 2yuz h PRO 97 CO 0.51 0.28 1.36 0.45 -0.23 0.00 0.00 178.00 180.38 2yuz n SER 98 N -3.60 2.07 -0.02 1.44 2.88 -1.26 -4.83 113.62 110.29 2yuz n SER 98 Ca -0.01 0.50 -0.17 0.00 -1.33 0.00 0.00 58.87 57.87 2yuz n SER 98 Cb 0.42 -1.22 -0.14 0.00 -0.75 0.00 0.00 64.21 62.52 2yuz n SER 98 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 2yuz h SER 99 N 11.62 0.19 0.00 -3.46 0.02 -2.06 -3.54 113.55 116.32 2yuz h SER 99 Ca -0.28 -0.96 0.00 0.00 -0.84 0.00 0.00 61.79 59.71 2yuz h SER 99 Cb 1.33 -0.06 0.00 0.00 0.14 0.00 0.00 62.40 63.81 2yuz h SER 99 CO 1.02 1.18 0.00 0.61 -1.14 0.00 0.00 176.83 178.50