#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 -0.56 -0.11 1.61 1.04 -1.26 -5.16 113.70 109.25 2yuz s SER 2 Ca 0.00 0.51 -0.04 0.00 0.48 0.00 0.00 55.95 56.90 2yuz s SER 2 Cb 0.00 0.51 0.06 0.00 0.10 0.00 0.00 66.02 66.69 2yuz s SER 2 CO 0.00 -0.63 0.22 -0.55 0.98 0.00 0.00 173.24 173.26 2yuz s SER 3 N -1.43 0.54 0.00 7.02 0.15 -1.26 -4.99 113.70 113.73 2yuz s SER 3 Ca -0.10 0.47 0.00 0.00 0.70 0.00 0.00 55.95 57.02 2yuz s SER 3 Cb -0.01 0.53 0.00 0.00 -1.71 0.00 0.00 66.02 64.83 2yuz s SER 3 CO 0.06 -0.24 0.00 0.61 1.20 0.00 0.00 173.24 174.87 2yuz n GLY 4 N 5.34 -0.21 2.38 9.45 0.00 -1.26 -5.07 105.19 115.82 2yuz n GLY 4 Ca -0.05 -0.01 -0.17 0.00 0.00 0.00 0.00 46.02 45.78 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 3.71 -3.68 1.61 2.88 -1.26 -5.02 113.62 111.85 2yuz n SER 5 Ca 0.00 -3.22 -0.10 0.00 -1.33 0.00 0.00 58.87 54.22 2yuz n SER 5 Cb 0.00 -0.42 -0.10 0.00 -0.75 0.00 0.00 64.21 62.95 2yuz n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2yuz s SER 6 N -3.58 -0.64 0.00 -3.46 0.15 -1.26 -5.13 113.70 99.78 2yuz s SER 6 Ca 0.42 1.08 0.00 0.00 0.70 0.00 0.00 55.95 58.15 2yuz s SER 6 Cb 0.39 0.97 0.00 0.00 -1.71 0.00 0.00 66.02 65.67 2yuz s SER 6 CO -0.03 -0.20 0.00 0.61 1.20 0.00 0.00 173.24 174.82 2yuz n GLY 7 N 4.10 0.17 3.69 9.45 0.00 -1.26 -5.09 105.19 116.26 2yuz n GLY 7 Ca -0.21 -1.04 -0.42 0.00 0.00 0.00 0.00 46.02 44.34 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 4.31 -0.25 0.99 2.96 -1.26 -5.01 118.68 120.41 2yuz s LEU 8 Ca 0.00 1.96 -0.02 0.00 -0.22 0.00 0.00 54.13 55.84 2yuz s LEU 8 Cb 0.00 -3.56 0.02 0.00 0.50 0.00 0.00 46.19 43.15 2yuz s LEU 8 CO 0.00 -0.60 -0.04 -0.54 -1.32 0.00 0.00 176.35 173.85 2yuz s LYS 9 N 1.97 2.89 -0.03 1.98 1.02 -1.26 -5.00 119.74 121.31 2yuz s LYS 9 Ca 0.59 -0.95 -0.30 0.00 0.02 0.00 0.00 55.97 55.33 2yuz s LYS 9 Cb -0.28 -3.04 -0.04 0.00 -0.52 0.00 0.00 37.83 33.95 2yuz s LYS 9 CO 0.25 -0.40 1.26 0.42 -0.92 0.00 0.00 175.35 175.96 2yuz s ILE 10 N 1.35 4.06 -0.22 2.17 1.09 -1.26 -0.91 121.20 127.49 2yuz s ILE 10 Ca 0.01 1.41 -0.16 0.00 -1.10 0.00 0.00 60.65 60.81 2yuz s ILE 10 Cb -0.17 -3.91 -0.08 0.00 -1.06 0.00 0.00 42.46 37.24 2yuz s ILE 10 CO -0.03 0.01 -0.35 0.18 -0.10 0.00 0.00 174.94 174.64 2yuz n LEU 11 N 5.12 1.94 -3.86 2.97 4.77 -1.17 -4.86 117.00 121.90 2yuz n LEU 11 Ca 0.11 0.33 -0.30 0.00 -0.03 0.00 0.00 56.01 56.13 2yuz n LEU 11 Cb 0.45 -0.77 -0.13 0.00 -2.33 0.00 0.00 43.42 40.64 2yuz n LEU 11 CO 0.56 0.04 -0.18 -0.89 -1.33 0.00 0.00 177.39 175.59 2yuz s THR 12 N -2.76 2.24 0.45 -5.08 2.01 -1.11 -4.99 115.64 106.40 2yuz s THR 12 Ca -0.33 -3.21 -0.23 0.00 0.31 0.00 0.00 61.69 58.23 2yuz s THR 12 Cb 0.08 -2.55 -0.08 0.00 0.01 0.00 0.00 72.50 69.97 2yuz s THR 12 CO 0.45 -0.86 1.17 -2.16 -0.69 0.00 0.00 174.62 172.53 2yuz s PRO 13 N -0.25 3.81 0.32 4.92 0.04 -1.26 -1.08 135.00 141.50 2yuz s PRO 13 Ca 0.18 1.80 -0.25 0.00 0.04 0.00 0.00 61.00 62.77 2yuz s PRO 13 Cb -0.22 -2.46 -0.15 0.00 0.04 0.00 0.00 34.50 31.70 2yuz s PRO 13 CO -0.02 -0.51 0.48 1.28 0.04 0.00 0.00 177.00 178.26 2yuz n LEU 14 N -0.37 -0.97 -4.33 -3.56 4.77 -1.26 -4.94 117.00 106.32 2yuz n LEU 14 Ca 0.07 1.00 -0.32 0.00 -0.03 0.00 0.00 56.01 56.73 2yuz n LEU 14 Cb 0.48 -1.02 -0.15 0.00 -2.33 0.00 0.00 43.42 40.40 2yuz n LEU 14 CO 0.48 -3.07 -0.52 0.42 -1.33 0.00 0.00 177.39 173.37 2yuz s THR 15 N -1.30 2.41 0.04 -5.08 -4.23 -1.26 -4.91 115.64 101.31 2yuz s THR 15 Ca 0.62 -0.94 -0.38 0.00 -1.18 0.00 0.00 61.69 59.81 2yuz s THR 15 Cb -0.75 -1.91 -0.19 0.00 1.34 0.00 0.00 72.50 70.99 2yuz s THR 15 CO 0.59 0.57 1.05 -0.90 -0.54 0.00 0.00 174.62 175.39 2yuz n ASP 16 N 2.83 0.12 -4.22 3.99 5.68 -1.26 -4.92 116.55 118.77 2yuz n ASP 16 Ca -0.17 1.15 -0.26 0.00 -0.50 0.00 0.00 54.79 55.00 2yuz n ASP 16 Cb 0.52 -0.97 -0.15 0.00 -1.14 0.00 0.00 41.12 39.38 2yuz n ASP 16 CO 0.00 0.00 0.00 -1.10 -1.33 0.00 0.00 177.20 174.77 2yuz s GLN 17 N -0.06 1.57 -0.04 0.11 -1.52 -1.17 -5.04 119.66 113.52 2yuz s GLN 17 Ca 0.87 -0.77 0.01 0.00 -1.95 0.00 0.00 55.36 53.52 2yuz s GLN 17 Cb -1.18 -1.55 0.02 0.00 -0.22 0.00 0.00 33.01 30.07 2yuz s GLN 17 CO 0.55 0.42 -0.06 0.99 -0.25 0.00 0.00 175.29 176.95 2yuz s THR 18 N -0.55 0.61 -0.08 -0.19 2.01 -1.26 -3.19 115.64 112.98 2yuz s THR 18 Ca 0.08 -0.20 -0.18 0.00 0.31 0.00 0.00 61.69 61.70 2yuz s THR 18 Cb -0.08 -0.60 0.04 0.00 0.01 0.00 0.00 72.50 71.87 2yuz s THR 18 CO -0.00 0.23 0.43 0.68 -0.69 0.00 0.00 174.62 175.27 2yuz s VAL 19 N 0.67 0.02 0.35 3.82 -7.23 -1.20 -5.05 120.40 111.78 2yuz s VAL 19 Ca -0.09 -0.20 -0.28 0.00 -1.81 0.00 0.00 61.98 59.60 2yuz s VAL 19 Cb -0.13 -0.69 -0.10 0.00 0.56 0.00 0.00 36.38 36.03 2yuz s VAL 19 CO 0.01 -0.11 1.28 0.20 -0.31 0.00 0.00 175.10 176.17 2yuz s ASN 20 N -0.67 6.70 0.22 4.85 -0.87 -1.26 -3.55 114.94 120.36 2yuz s ASN 20 Ca -0.08 2.63 -0.20 0.00 -1.57 0.00 0.00 52.86 53.64 2yuz s ASN 20 Cb -0.03 -2.64 -0.13 0.00 -0.02 0.00 0.00 41.25 38.42 2yuz s ASN 20 CO 0.04 -0.58 0.27 -0.11 -2.57 0.00 0.00 177.10 174.15 2yuz n LEU 21 N 0.65 -1.52 0.00 0.60 0.00 -1.15 -0.63 117.00 114.95 2yuz n LEU 21 Ca 0.01 0.78 0.00 0.00 0.00 0.00 0.00 56.01 56.80 2yuz n LEU 21 Cb 0.43 -0.73 0.00 0.00 0.00 0.00 0.00 43.42 43.12 2yuz n LEU 21 CO 0.58 -2.75 0.00 0.61 0.00 0.00 0.00 177.39 175.83 2yuz n GLY 22 N 1.68 2.13 3.16 -3.96 0.00 -0.17 -4.89 105.19 103.14 2yuz n GLY 22 Ca 0.12 -0.25 -0.35 0.00 0.00 0.00 0.00 46.02 45.53 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 0.00 -0.40 -3.02 1.61 4.76 0.20 -3.25 118.16 118.06 2yuz n LYS 23 Ca 0.00 -0.10 -0.44 0.00 -2.87 0.00 0.00 58.31 54.90 2yuz n LYS 23 Cb 0.00 -1.35 -0.04 0.00 -1.84 0.00 0.00 35.03 31.80 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 -2.69 3.09 0.54 1.97 2.12 -1.26 -0.70 118.70 121.77 2yuz s GLU 24 Ca 0.46 -1.04 -0.20 0.00 0.36 0.00 0.00 54.97 54.55 2yuz s GLU 24 Cb -0.10 -4.22 -0.08 0.00 0.26 0.00 0.00 34.13 29.99 2yuz s GLU 24 CO 0.72 -1.59 0.86 -0.89 -0.54 0.00 0.00 175.26 173.82 2yuz n ILE 25 N 5.72 2.95 -3.71 -3.70 2.08 -1.04 -4.74 119.36 116.93 2yuz n ILE 25 Ca -0.07 -0.50 -0.11 0.00 0.56 0.00 0.00 62.75 62.63 2yuz n ILE 25 Cb 0.44 -1.02 -0.11 0.00 -0.75 0.00 0.00 39.64 38.19 2yuz n ILE 25 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2yuz s LEU 27 N 1.19 -0.33 0.15 0.00 1.43 0.63 -4.92 118.68 116.83 2yuz s LEU 27 Ca -0.08 0.11 0.09 0.00 -1.03 0.00 0.00 54.13 53.22 2yuz s LEU 27 Cb -0.08 0.71 -0.04 0.00 0.03 0.00 0.00 46.19 46.81 2yuz s LEU 27 CO -0.10 -0.30 -0.14 -0.75 0.23 0.00 0.00 176.35 175.30 2yuz s LYS 28 N 2.42 1.93 0.04 1.70 2.36 -1.26 -0.25 119.74 126.69 2yuz s LYS 28 Ca 0.07 -1.22 -0.13 0.00 -2.55 0.00 0.00 55.97 52.14 2yuz s LYS 28 Cb -0.15 -2.14 0.02 0.00 -1.05 0.00 0.00 37.83 34.51 2yuz s LYS 28 CO -0.13 0.46 0.28 0.00 1.55 0.00 0.00 175.35 177.51 2yuz s GLU 30 N -2.56 1.06 0.17 0.00 2.12 -0.25 -1.10 118.70 118.15 2yuz s GLU 30 Ca -0.05 -1.03 -0.01 0.00 0.36 0.00 0.00 54.97 54.24 2yuz s GLU 30 Cb -0.01 -1.21 -0.04 0.00 0.26 0.00 0.00 34.13 33.13 2yuz s GLU 30 CO -0.03 0.29 0.10 0.96 -0.54 0.00 0.00 175.26 176.03 2yuz s ILE 31 N -1.11 0.06 -0.53 -3.70 -4.36 -1.17 -2.75 121.20 107.64 2yuz s ILE 31 Ca 0.04 -1.96 0.08 0.00 -0.26 0.00 0.00 60.65 58.55 2yuz s ILE 31 Cb -0.10 -2.31 0.50 0.00 1.25 0.00 0.00 42.46 41.81 2yuz s ILE 31 CO 0.03 -0.20 1.28 -0.24 0.24 0.00 0.00 174.94 176.05 2yuz n SER 32 N -0.20 3.91 -3.98 4.36 2.88 -0.09 -4.80 113.62 115.70 2yuz n SER 32 Ca -0.01 -2.59 -0.09 0.00 -1.33 0.00 0.00 58.87 54.85 2yuz n SER 32 Cb 0.65 -0.62 -0.10 0.00 -0.75 0.00 0.00 64.21 63.39 2yuz n SER 32 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 2yuz s GLU 33 N -2.08 0.56 -0.90 -1.46 0.41 -1.26 -4.78 118.70 109.18 2yuz s GLU 33 Ca 0.34 -0.86 -0.01 0.00 -0.41 0.00 0.00 54.97 54.02 2yuz s GLU 33 Cb 0.26 0.21 0.25 0.00 -1.78 0.00 0.00 34.13 33.07 2yuz s GLU 33 CO 0.10 -0.13 0.95 -1.71 -0.49 0.00 0.00 175.26 173.98 2yuz n ASN 34 N 0.70 4.66 -3.96 -0.19 2.85 -1.26 -4.70 115.26 113.35 2yuz n ASN 34 Ca -0.18 -3.25 -0.09 0.00 -0.11 0.00 0.00 54.58 50.94 2yuz n ASN 34 Cb 0.59 -1.04 -0.11 0.00 1.24 0.00 0.00 39.78 40.46 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 -1.91 0.10 0.65 -1.44 -5.25 -1.26 -5.06 121.20 107.03 2yuz s ILE 35 Ca 0.31 -0.83 -0.15 0.00 -0.99 0.00 0.00 60.65 58.98 2yuz s ILE 35 Cb -0.00 -0.27 -0.01 0.00 2.95 0.00 0.00 42.46 45.13 2yuz s ILE 35 CO -0.05 -0.46 1.11 -2.16 -1.79 0.00 0.00 174.94 171.59 2yuz s PRO 36 N -1.37 2.86 0.24 0.37 0.04 -1.26 -4.92 135.00 130.96 2yuz s PRO 36 Ca -0.15 1.41 0.06 0.00 0.04 0.00 0.00 61.00 62.35 2yuz s PRO 36 Cb -0.09 -1.96 -0.02 0.00 0.04 0.00 0.00 34.50 32.47 2yuz s PRO 36 CO -0.01 -1.21 0.21 0.41 0.04 0.00 0.00 177.00 176.45 2yuz n GLY 37 N -0.47 3.21 2.86 0.56 0.00 -1.26 -2.21 105.19 107.87 2yuz n GLY 37 Ca 0.10 -1.82 -0.15 0.00 0.00 0.00 0.00 46.02 44.15 2yuz n GLY 37 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2yuz s LYS 38 N -2.97 0.22 0.17 1.61 2.36 -0.38 -4.85 119.74 115.90 2yuz s LYS 38 Ca 0.29 0.01 -0.13 0.00 -2.55 0.00 0.00 55.97 53.59 2yuz s LYS 38 Cb 0.01 -0.32 -0.07 0.00 -1.05 0.00 0.00 37.83 36.40 2yuz s LYS 38 CO 0.20 -0.05 0.55 -1.58 1.55 0.00 0.00 175.35 176.03 2yuz s TRP 39 N 0.51 3.55 -0.03 4.03 0.52 -1.26 -2.56 118.94 123.69 2yuz s TRP 39 Ca -0.05 1.01 -0.01 0.00 0.02 0.00 0.00 56.10 57.07 2yuz s TRP 39 Cb -0.08 -2.34 0.03 0.00 -1.15 0.00 0.00 33.47 29.93 2yuz s TRP 39 CO -0.01 0.37 0.06 0.95 0.02 0.00 0.00 176.95 178.35 2yuz s THR 40 N -1.58 -0.05 -0.05 2.01 -4.23 0.97 -2.95 115.64 109.76 2yuz s THR 40 Ca 0.41 0.18 -0.02 0.00 -1.18 0.00 0.00 61.69 61.08 2yuz s THR 40 Cb -0.14 -0.12 -0.04 0.00 1.34 0.00 0.00 72.50 73.54 2yuz s THR 40 CO 0.20 0.07 0.06 -0.75 -0.54 0.00 0.00 174.62 173.66 2yuz s LYS 41 N 0.96 3.07 -1.65 3.99 2.20 0.11 -0.79 119.74 127.64 2yuz s LYS 41 Ca -0.08 -0.41 -0.21 0.00 -0.36 0.00 0.00 55.97 54.91 2yuz s LYS 41 Cb -0.11 -2.87 0.20 0.00 -1.51 0.00 0.00 37.83 33.54 2yuz s LYS 41 CO -0.03 0.69 0.54 0.09 -0.36 0.00 0.00 175.35 176.27 2yuz n ASN 42 N 1.65 -1.86 -2.38 1.43 3.02 -0.48 0.12 115.26 116.76 2yuz n ASN 42 Ca -0.16 -1.02 -0.14 0.00 -0.03 0.00 0.00 54.58 53.23 2yuz n ASN 42 Cb 0.53 -1.63 0.05 0.00 -0.61 0.00 0.00 39.78 38.13 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 -1.02 0.04 3.17 7.41 0.00 -1.26 -5.03 105.19 108.49 2yuz n GLY 43 Ca 0.10 -0.11 -0.11 0.00 0.00 0.00 0.00 46.02 45.90 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 -4.80 1.35 -0.42 0.99 1.43 0.33 -5.11 118.68 112.45 2yuz s LEU 44 Ca 0.33 -0.25 -0.28 0.00 -1.03 0.00 0.00 54.13 52.89 2yuz s LEU 44 Cb -0.14 0.92 -0.01 0.00 0.03 0.00 0.00 46.19 46.98 2yuz s LEU 44 CO 0.44 -0.48 1.74 -2.16 0.23 0.00 0.00 176.35 176.12 2yuz s PRO 45 N -2.02 3.21 0.07 1.29 0.04 -1.26 0.06 135.00 136.39 2yuz s PRO 45 Ca -0.09 1.13 -0.33 0.00 0.04 0.00 0.00 61.00 61.74 2yuz s PRO 45 Cb -0.04 -4.21 -0.12 0.00 0.04 0.00 0.00 34.50 30.17 2yuz s PRO 45 CO -0.01 -2.02 1.75 0.28 0.04 0.00 0.00 177.00 177.04 2yuz n VAL 46 N 7.30 0.30 -2.44 -0.36 0.31 -1.15 -4.89 118.33 117.39 2yuz n VAL 46 Ca 0.21 -0.05 -0.41 0.00 -0.01 0.00 0.00 64.34 64.08 2yuz n VAL 46 Cb 0.48 -1.81 -0.03 0.00 -0.91 0.00 0.00 33.84 31.57 2yuz n VAL 46 CO 0.00 0.00 0.00 -1.58 -1.32 0.00 0.00 176.83 173.93 2yuz s GLN 47 N 2.48 3.15 0.03 5.55 0.74 -1.26 -4.98 119.66 125.36 2yuz s GLN 47 Ca 0.84 0.06 -0.30 0.00 0.05 0.00 0.00 55.36 56.01 2yuz s GLN 47 Cb -0.63 -4.19 -0.05 0.00 1.10 0.00 0.00 33.01 29.24 2yuz s GLN 47 CO 0.42 -2.17 1.15 -1.21 -0.55 0.00 0.00 175.29 172.94 2yuz s GLU 48 N 5.84 4.45 0.16 1.67 8.01 -1.26 -4.87 118.70 132.70 2yuz s GLU 48 Ca 0.44 1.68 -0.02 0.00 0.01 0.00 0.00 54.97 57.08 2yuz s GLU 48 Cb -0.09 -3.40 -0.04 0.00 -4.31 0.00 0.00 34.13 26.29 2yuz s GLU 48 CO 0.19 -0.24 0.11 -1.12 0.01 0.00 0.00 175.26 174.21 2yuz s SER 49 N 1.10 0.23 0.38 -0.19 0.01 -0.65 -4.95 113.70 109.64 2yuz s SER 49 Ca 0.57 -1.22 0.31 0.00 1.31 0.00 0.00 55.95 56.91 2yuz s SER 49 Cb -0.27 0.34 1.24 0.00 0.21 0.00 0.00 66.02 67.54 2yuz s SER 49 CO 0.28 -0.78 1.22 0.47 0.41 0.00 0.00 173.24 174.84 2yuz n ASP 50 N -0.16 0.11 -0.03 2.44 9.92 -1.26 0.11 116.55 127.67 2yuz n ASP 50 Ca -0.03 0.98 -0.11 0.00 -0.53 0.00 0.00 54.79 55.10 2yuz n ASP 50 Cb 0.64 -0.48 -0.09 0.00 -0.64 0.00 0.00 41.12 40.55 2yuz n ASP 50 CO 0.00 0.00 0.00 0.03 0.13 0.00 0.00 177.20 177.36 2yuz h ARG 51 N 0.00 -0.05 -4.93 -1.24 3.08 -1.97 -3.42 114.38 105.85 2yuz h ARG 51 Ca 0.71 0.00 -0.69 0.00 0.07 0.00 0.00 59.98 60.07 2yuz h ARG 51 Cb 2.50 0.01 -0.18 0.00 0.08 0.00 0.00 29.97 32.37 2yuz h ARG 51 CO -0.24 0.59 -0.03 -1.17 -1.07 0.00 0.00 179.97 178.05 2yuz s LEU 52 N -8.54 4.96 -0.09 3.04 0.20 0.30 -3.32 118.68 115.24 2yuz s LEU 52 Ca -0.14 -0.84 0.04 0.00 0.69 0.00 0.00 54.13 53.89 2yuz s LEU 52 Cb -0.01 -2.44 -0.00 0.00 -0.43 0.00 0.00 46.19 43.30 2yuz s LEU 52 CO 0.51 -0.80 -0.24 -0.75 -0.29 0.00 0.00 176.35 174.78 2yuz s LYS 53 N 2.46 2.93 -0.54 1.98 2.47 -1.24 -1.63 119.74 126.16 2yuz s LYS 53 Ca 0.14 -0.88 -0.18 0.00 -1.56 0.00 0.00 55.97 53.49 2yuz s LYS 53 Cb -0.19 -2.27 0.09 0.00 -1.46 0.00 0.00 37.83 34.00 2yuz s LYS 53 CO 0.13 0.23 0.62 0.08 0.16 0.00 0.00 175.35 176.57 2yuz s VAL 54 N 0.21 4.92 -0.05 4.02 1.01 -1.26 -3.81 120.40 125.44 2yuz s VAL 54 Ca -0.15 -0.89 -0.13 0.00 0.00 0.00 0.00 61.98 60.81 2yuz s VAL 54 Cb -0.17 -4.37 -0.05 0.00 0.00 0.00 0.00 36.38 31.79 2yuz s VAL 54 CO 0.08 -0.93 0.35 -0.69 0.00 0.00 0.00 175.10 173.90 2yuz s VAL 55 N 2.44 5.16 -0.02 2.92 1.01 0.30 -4.97 120.40 127.24 2yuz s VAL 55 Ca 0.11 0.69 0.05 0.00 0.00 0.00 0.00 61.98 62.83 2yuz s VAL 55 Cb -0.23 -3.65 -0.01 0.00 0.00 0.00 0.00 36.38 32.49 2yuz s VAL 55 CO 0.08 0.55 -0.17 -1.58 0.00 0.00 0.00 175.10 173.98 2yuz s GLN 56 N -0.79 1.50 -0.40 2.72 0.74 -1.26 0.38 119.66 122.54 2yuz s GLN 56 Ca 0.21 -0.61 0.02 0.00 0.05 0.00 0.00 55.36 55.03 2yuz s GLN 56 Cb -0.15 -1.40 0.12 0.00 1.10 0.00 0.00 33.01 32.67 2yuz s GLN 56 CO 0.10 0.33 0.17 0.15 -0.55 0.00 0.00 175.29 175.50 2yuz s LYS 57 N -0.27 1.31 2.68 1.67 1.02 0.57 -4.98 119.74 121.74 2yuz s LYS 57 Ca 0.04 -1.87 0.00 0.00 0.02 0.00 0.00 55.97 54.15 2yuz s LYS 57 Cb -0.08 -2.58 0.00 0.00 -0.52 0.00 0.00 37.83 34.65 2yuz s LYS 57 CO 0.00 -1.07 0.00 0.41 -0.92 0.00 0.00 175.35 173.77 2yuz n GLY 58 N 3.90 0.29 1.91 -3.33 0.00 -1.26 -1.64 105.19 105.07 2yuz n GLY 58 Ca 0.05 0.66 -0.22 0.00 0.00 0.00 0.00 46.02 46.51 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 3.36 -3.68 1.61 1.74 -1.26 -4.57 116.66 113.86 2yuz n ARG 59 Ca 0.00 -4.03 -0.16 0.00 -0.77 0.00 0.00 57.85 52.89 2yuz n ARG 59 Cb 0.00 -2.22 -0.15 0.00 -1.02 0.00 0.00 32.46 29.07 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 -4.48 -0.24 -0.42 0.55 1.01 -0.65 -3.06 121.20 113.91 2yuz s ILE 60 Ca 0.51 0.33 -0.16 0.00 0.00 0.00 0.00 60.65 61.33 2yuz s ILE 60 Cb 0.41 -0.29 0.02 0.00 0.01 0.00 0.00 42.46 42.61 2yuz s ILE 60 CO 0.03 0.14 0.35 -1.00 0.00 0.00 0.00 174.94 174.46 2yuz s HIS 61 N 2.13 3.21 -0.13 3.97 3.76 -0.26 -0.31 115.29 127.67 2yuz s HIS 61 Ca 0.01 -0.54 -0.04 0.00 -0.15 0.00 0.00 55.06 54.34 2yuz s HIS 61 Cb -0.12 -2.74 -0.03 0.00 1.11 0.00 0.00 32.58 30.80 2yuz s HIS 61 CO -0.06 -0.65 0.01 0.21 -0.85 0.00 0.00 174.74 173.40 2yuz s LYS 62 N 1.84 3.44 -0.10 1.40 2.20 0.16 -1.55 119.74 127.13 2yuz s LYS 62 Ca 0.07 -0.42 -0.03 0.00 -0.36 0.00 0.00 55.97 55.23 2yuz s LYS 62 Cb -0.19 -2.94 0.04 0.00 -1.51 0.00 0.00 37.83 33.24 2yuz s LYS 62 CO 0.11 0.46 0.05 -1.17 -0.36 0.00 0.00 175.35 174.44 2yuz s LEU 63 N -0.20 0.43 0.06 5.43 0.20 0.65 -0.54 118.68 124.72 2yuz s LEU 63 Ca 0.05 -0.27 0.08 0.00 0.69 0.00 0.00 54.13 54.68 2yuz s LEU 63 Cb -0.12 -0.29 -0.03 0.00 -0.43 0.00 0.00 46.19 45.31 2yuz s LEU 63 CO 0.02 -0.27 -0.21 0.68 -0.29 0.00 0.00 176.35 176.27 2yuz s VAL 64 N 2.08 1.72 0.00 1.68 -7.23 -1.25 -0.27 120.40 117.13 2yuz s VAL 64 Ca 0.03 -1.33 0.03 0.00 -1.81 0.00 0.00 61.98 58.90 2yuz s VAL 64 Cb -0.14 -1.52 -0.03 0.00 0.56 0.00 0.00 36.38 35.25 2yuz s VAL 64 CO -0.06 0.13 -0.05 -0.63 -0.31 0.00 0.00 175.10 174.17 2yuz s ILE 65 N -0.92 3.74 0.07 -0.62 1.01 -0.55 -3.73 121.20 120.20 2yuz s ILE 65 Ca 0.08 -0.74 -0.33 0.00 0.00 0.00 0.00 60.65 59.65 2yuz s ILE 65 Cb -0.09 -2.63 -0.19 0.00 0.01 0.00 0.00 42.46 39.55 2yuz s ILE 65 CO 0.03 0.39 1.62 0.00 0.00 0.00 0.00 174.94 176.98 2yuz h ALA 66 N 4.50 -0.94 -3.17 9.38 0.00 -1.88 -2.75 119.26 124.40 2yuz h ALA 66 Ca -0.48 -0.20 -0.54 0.00 0.00 0.00 0.00 54.91 53.68 2yuz h ALA 66 Cb 1.17 0.36 -0.37 0.00 0.00 0.00 0.00 17.79 18.95 2yuz h ALA 66 CO 0.54 -1.03 -0.81 -0.80 0.00 0.00 0.00 179.25 177.16 2yuz s ASN 67 N -4.37 2.32 -0.57 0.00 -0.87 -1.26 -4.36 114.94 105.83 2yuz s ASN 67 Ca -0.18 -0.36 -0.27 0.00 -1.57 0.00 0.00 52.86 50.48 2yuz s ASN 67 Cb 0.03 -0.92 -0.01 0.00 -0.02 0.00 0.00 41.25 40.33 2yuz s ASN 67 CO 0.62 -0.11 1.74 0.00 -2.57 0.00 0.00 177.10 176.78 2yuz s ALA 68 N 1.66 2.40 0.35 0.60 0.00 0.12 -4.81 121.76 122.08 2yuz s ALA 68 Ca 0.05 -0.58 0.02 0.00 0.00 0.00 0.00 51.96 51.45 2yuz s ALA 68 Cb -0.13 -4.23 -0.02 0.00 0.00 0.00 0.00 23.12 18.74 2yuz s ALA 68 CO -0.09 -3.53 0.53 -0.51 0.00 0.00 0.00 175.76 172.16 2yuz s LEU 69 N 8.08 3.98 0.00 0.00 1.43 -1.26 -1.00 118.68 129.90 2yuz s LEU 69 Ca 0.64 0.23 0.12 0.00 -1.03 0.00 0.00 54.13 54.09 2yuz s LEU 69 Cb -0.13 -3.10 0.50 0.00 0.03 0.00 0.00 46.19 43.49 2yuz s LEU 69 CO 0.23 -0.37 1.38 0.41 0.23 0.00 0.00 176.35 178.22 2yuz n THR 70 N -1.76 1.19 0.16 5.49 -1.04 -1.26 -1.77 114.28 115.28 2yuz n THR 70 Ca -0.03 0.30 0.09 0.00 -2.04 0.00 0.00 64.05 62.37 2yuz n THR 70 Cb 0.57 -1.10 0.07 0.00 -1.82 0.00 0.00 70.33 68.06 2yuz n THR 70 CO 0.00 0.00 0.00 1.05 -0.64 0.00 0.00 175.07 175.48 2yuz h GLU 71 N 0.00 0.00 0.00 -2.82 4.11 -1.99 -3.25 114.58 110.64 2yuz h GLU 71 Ca 0.00 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 59.40 2yuz h GLU 71 Cb 0.20 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.45 2yuz h GLU 71 CO 0.00 0.09 -0.13 -0.44 0.07 0.00 0.00 179.01 178.61 2yuz h ASP 72 N 0.00 0.00 -2.99 3.06 3.32 -1.74 -3.44 116.42 114.63 2yuz h ASP 72 Ca -0.01 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.50 2yuz h ASP 72 Cb 1.10 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.66 2yuz h ASP 72 CO 0.01 0.13 0.76 -0.70 -1.72 0.00 0.00 179.24 177.72 2yuz s GLU 73 N -3.38 4.32 0.00 3.56 2.12 -1.23 -4.69 118.70 119.41 2yuz s GLU 73 Ca 0.04 1.93 0.00 0.00 0.36 0.00 0.00 54.97 57.30 2yuz s GLU 73 Cb 0.07 -3.47 0.00 0.00 0.26 0.00 0.00 34.13 31.00 2yuz s GLU 73 CO 0.64 -0.48 0.00 0.41 -0.54 0.00 0.00 175.26 175.29 2yuz n GLY 74 N 3.52 -1.41 2.92 -1.50 0.00 -1.26 -5.07 105.19 102.39 2yuz n GLY 74 Ca 0.12 0.66 -0.08 0.00 0.00 0.00 0.00 46.02 46.71 2yuz n GLY 74 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2yuz s ASP 75 N -4.00 0.22 -0.08 1.61 -1.08 -1.26 -4.44 116.67 107.64 2yuz s ASP 75 Ca 0.00 0.05 -0.20 0.00 -0.52 0.00 0.00 52.55 51.88 2yuz s ASP 75 Cb 0.00 1.16 -0.04 0.00 -1.46 0.00 0.00 42.92 42.58 2yuz s ASP 75 CO 0.00 -0.32 0.56 -0.31 0.52 0.00 0.00 175.17 175.63 2yuz s TYR 76 N 2.56 3.57 -0.03 -5.34 2.02 -1.10 -1.39 117.35 117.65 2yuz s TYR 76 Ca 0.12 1.06 0.02 0.00 -0.37 0.00 0.00 57.07 57.89 2yuz s TYR 76 Cb -0.14 -2.63 0.01 0.00 -0.40 0.00 0.00 41.96 38.80 2yuz s TYR 76 CO -0.21 0.19 -0.06 0.08 -1.57 0.00 0.00 175.55 173.98 2yuz s VAL 77 N 0.48 0.59 0.06 0.71 1.01 0.03 -1.19 120.40 122.09 2yuz s VAL 77 Ca 0.30 -0.23 0.08 0.00 0.00 0.00 0.00 61.98 62.13 2yuz s VAL 77 Cb -0.16 -0.56 -0.03 0.00 0.00 0.00 0.00 36.38 35.62 2yuz s VAL 77 CO 0.14 0.21 -0.19 0.12 0.00 0.00 0.00 175.10 175.38 2yuz s PHE 78 N 0.39 2.53 -0.22 5.22 2.19 -1.15 -0.02 117.98 126.92 2yuz s PHE 78 Ca -0.05 -0.27 -0.16 0.00 0.33 0.00 0.00 56.93 56.77 2yuz s PHE 78 Cb -0.09 -1.42 0.06 0.00 -1.31 0.00 0.00 43.02 40.26 2yuz s PHE 78 CO 0.00 0.28 0.57 0.00 1.83 0.00 0.00 175.22 177.90 2yuz s ALA 79 N -0.98 -1.46 0.61 11.12 0.00 -1.06 -1.28 121.76 128.72 2yuz s ALA 79 Ca 0.15 1.81 -0.17 0.00 0.00 0.00 0.00 51.96 53.76 2yuz s ALA 79 Cb -0.10 -1.07 -0.02 0.00 0.00 0.00 0.00 23.12 21.92 2yuz s ALA 79 CO 0.06 -0.30 1.12 -1.25 0.00 0.00 0.00 175.76 175.39 2yuz s PRO 80 N 0.91 3.03 0.00 0.00 0.04 -1.26 -1.25 135.00 136.46 2yuz s PRO 80 Ca -0.05 1.48 0.04 0.00 0.04 0.00 0.00 61.00 62.51 2yuz s PRO 80 Cb -0.05 -1.97 0.10 0.00 0.04 0.00 0.00 34.50 32.62 2yuz s PRO 80 CO -0.08 -1.09 1.09 -0.25 0.04 0.00 0.00 177.00 176.71 2yuz n ASP 81 N -1.96 0.61 -0.01 6.66 9.92 -0.94 -3.49 116.55 127.33 2yuz n ASP 81 Ca 0.11 -2.00 -0.01 0.00 -0.53 0.00 0.00 54.79 52.36 2yuz n ASP 81 Cb 0.52 -0.08 -0.02 0.00 -0.64 0.00 0.00 41.12 40.90 2yuz n ASP 81 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2yuz n ALA 82 N -0.17 1.94 -2.71 2.24 0.00 -1.26 -5.08 120.51 115.47 2yuz n ALA 82 Ca 0.04 -0.15 -0.31 0.00 0.00 0.00 0.00 53.44 53.01 2yuz n ALA 82 Cb 0.10 0.26 -0.08 0.00 0.00 0.00 0.00 19.45 19.72 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 -2.06 2.01 -0.64 0.00 2.02 -1.23 -5.06 117.35 112.39 2yuz s TYR 83 Ca -0.02 -0.91 0.02 0.00 -0.37 0.00 0.00 57.07 55.78 2yuz s TYR 83 Cb 0.01 -1.61 0.39 0.00 -0.40 0.00 0.00 41.96 40.34 2yuz s TYR 83 CO 0.09 0.24 1.56 -1.71 -1.57 0.00 0.00 175.55 174.16 2yuz n ASN 84 N -1.19 6.08 -4.86 2.29 2.85 -1.26 -4.30 115.26 114.87 2yuz n ASN 84 Ca -0.15 -3.78 -0.37 0.00 -0.11 0.00 0.00 54.58 50.17 2yuz n ASN 84 Cb 0.67 -0.75 -0.06 0.00 1.24 0.00 0.00 39.78 40.88 2yuz n ASN 84 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 2yuz s VAL 85 N -5.31 5.26 -0.09 3.44 1.01 -1.26 -5.06 120.40 118.39 2yuz s VAL 85 Ca 0.50 0.47 0.02 0.00 0.00 0.00 0.00 61.98 62.97 2yuz s VAL 85 Cb 0.42 -3.57 0.02 0.00 0.00 0.00 0.00 36.38 33.25 2yuz s VAL 85 CO -0.30 0.54 -0.13 0.42 0.00 0.00 0.00 175.10 175.64 2yuz s THR 86 N -1.11 1.28 -0.41 3.92 -4.23 -1.25 -3.81 115.64 110.02 2yuz s THR 86 Ca 0.22 -0.52 -0.07 0.00 -1.18 0.00 0.00 61.69 60.13 2yuz s THR 86 Cb -0.14 -1.19 0.09 0.00 1.34 0.00 0.00 72.50 72.60 2yuz s THR 86 CO 0.11 0.40 0.24 -0.76 -0.54 0.00 0.00 174.62 174.06 2yuz s LEU 87 N 0.95 5.14 0.37 4.79 1.02 -0.40 -4.91 118.68 125.64 2yuz s LEU 87 Ca -0.09 -1.64 -0.26 0.00 0.02 0.00 0.00 54.13 52.16 2yuz s LEU 87 Cb -0.15 -1.94 -0.09 0.00 0.02 0.00 0.00 46.19 44.03 2yuz s LEU 87 CO -0.00 -0.54 1.20 -2.16 0.02 0.00 0.00 176.35 174.87 2yuz s PRO 88 N 1.35 4.17 -0.03 1.29 0.04 -1.26 -2.91 135.00 137.64 2yuz s PRO 88 Ca 0.04 1.94 -0.10 0.00 0.04 0.00 0.00 61.00 62.91 2yuz s PRO 88 Cb -0.23 -2.82 0.02 0.00 0.04 0.00 0.00 34.50 31.51 2yuz s PRO 88 CO 0.00 -0.25 0.23 0.00 0.04 0.00 0.00 177.00 177.02 2yuz s ALA 89 N -1.32 -0.57 -0.08 8.56 0.00 -0.33 -4.81 121.76 123.22 2yuz s ALA 89 Ca 0.54 0.27 0.03 0.00 0.00 0.00 0.00 51.96 52.80 2yuz s ALA 89 Cb -0.33 -0.05 -0.02 0.00 0.00 0.00 0.00 23.12 22.72 2yuz s ALA 89 CO 0.42 -0.20 -0.17 0.15 0.00 0.00 0.00 175.76 175.96 2yuz s LYS 90 N -0.92 2.81 0.23 0.00 1.02 -1.26 -2.69 119.74 118.93 2yuz s LYS 90 Ca -0.10 -0.76 0.07 0.00 0.02 0.00 0.00 55.97 55.20 2yuz s LYS 90 Cb -0.05 -2.40 -0.05 0.00 -0.52 0.00 0.00 37.83 34.81 2yuz s LYS 90 CO 0.02 0.42 -0.11 0.14 -0.92 0.00 0.00 175.35 174.90 2yuz s VAL 91 N -0.20 1.65 -0.17 3.17 -7.23 -1.26 -3.04 120.40 113.32 2yuz s VAL 91 Ca -0.01 -2.17 -0.10 0.00 -1.81 0.00 0.00 61.98 57.89 2yuz s VAL 91 Cb -0.13 -2.20 0.06 0.00 0.56 0.00 0.00 36.38 34.67 2yuz s VAL 91 CO 0.03 -0.48 0.42 -2.28 -0.31 0.00 0.00 175.10 172.48 2yuz s HIS 92 N -3.02 -0.60 -0.11 2.82 2.46 -1.19 -4.54 115.29 111.11 2yuz s HIS 92 Ca 0.25 1.30 0.03 0.00 0.47 0.00 0.00 55.06 57.11 2yuz s HIS 92 Cb 0.01 0.27 -0.01 0.00 -0.13 0.00 0.00 32.58 32.72 2yuz s HIS 92 CO 0.09 -0.33 -0.20 0.54 -2.47 0.00 0.00 174.74 172.36 2yuz s VAL 93 N 1.25 2.43 -0.02 0.89 0.11 -1.26 -3.22 120.40 120.57 2yuz s VAL 93 Ca -0.08 -0.89 -0.30 0.00 -2.93 0.00 0.00 61.98 57.78 2yuz s VAL 93 Cb -0.08 -1.96 -0.03 0.00 -1.53 0.00 0.00 36.38 32.78 2yuz s VAL 93 CO -0.11 0.55 1.11 -0.63 -3.33 0.00 0.00 175.10 172.69 2yuz s ILE 94 N 0.33 4.44 -0.30 7.04 1.09 -1.23 -4.88 121.20 127.69 2yuz s ILE 94 Ca -0.16 1.75 -0.08 0.00 -1.10 0.00 0.00 60.65 61.06 2yuz s ILE 94 Cb -0.17 -4.12 0.17 0.00 -1.06 0.00 0.00 42.46 37.27 2yuz s ILE 94 CO 0.08 0.07 0.76 -0.94 -0.10 0.00 0.00 174.94 174.81 2yuz s SER 95 N 1.18 -1.02 0.31 3.58 1.04 -1.26 -2.94 113.70 114.60 2yuz s SER 95 Ca 0.54 0.93 0.00 0.00 0.48 0.00 0.00 55.95 57.90 2yuz s SER 95 Cb -0.24 1.97 0.00 0.00 0.10 0.00 0.00 66.02 67.85 2yuz s SER 95 CO 0.25 -0.19 0.00 0.61 0.98 0.00 0.00 173.24 174.89 2yuz n GLY 96 N 5.36 0.35 3.55 7.32 0.00 -1.26 -4.96 105.19 115.56 2yuz n GLY 96 Ca -0.06 -1.85 -0.35 0.00 0.00 0.00 0.00 46.02 43.75 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 -0.88 2.61 -0.06 1.61 0.04 -1.26 -4.97 135.00 132.10 2yuz s PRO 97 Ca 0.00 0.38 -0.17 0.00 0.04 0.00 0.00 61.00 61.25 2yuz s PRO 97 Cb 0.00 -4.56 -0.05 0.00 0.04 0.00 0.00 34.50 29.93 2yuz s PRO 97 CO 0.00 -2.90 0.45 -1.54 0.04 0.00 0.00 177.00 173.05 2yuz s SER 98 N 8.08 6.76 0.05 6.66 1.04 -1.26 -5.08 113.70 129.95 2yuz s SER 98 Ca 0.68 0.90 0.02 0.00 0.48 0.00 0.00 55.95 58.03 2yuz s SER 98 Cb -0.11 -2.27 -0.04 0.00 0.10 0.00 0.00 66.02 63.70 2yuz s SER 98 CO 0.15 0.16 0.07 -0.44 0.98 0.00 0.00 173.24 174.16 2yuz s SER 99 N -0.22 5.50 0.00 7.02 0.01 -1.26 -5.31 113.70 119.44 2yuz s SER 99 Ca 0.25 0.02 0.00 0.00 1.31 0.00 0.00 55.95 57.52 2yuz s SER 99 Cb -0.16 -1.49 0.00 0.00 0.21 0.00 0.00 66.02 64.58 2yuz s SER 99 CO 0.12 0.20 0.00 0.61 0.41 0.00 0.00 173.24 174.58