#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 6.51 -0.02 1.61 1.04 -1.26 -5.06 113.70 116.52 2yuz s SER 2 Ca 0.00 0.61 -0.00 0.00 0.48 0.00 0.00 55.95 57.04 2yuz s SER 2 Cb 0.00 -2.26 0.02 0.00 0.10 0.00 0.00 66.02 63.89 2yuz s SER 2 CO 0.00 -0.08 0.04 -0.55 0.98 0.00 0.00 173.24 173.62 2yuz s SER 3 N 0.97 0.03 -0.19 7.02 0.15 -1.26 -5.15 113.70 115.27 2yuz s SER 3 Ca 0.21 0.06 -0.28 0.00 0.70 0.00 0.00 55.95 56.64 2yuz s SER 3 Cb -0.15 -0.02 0.11 0.00 -1.71 0.00 0.00 66.02 64.26 2yuz s SER 3 CO 0.09 -0.09 0.95 -0.83 1.20 0.00 0.00 173.24 174.55 2yuz s GLY 4 N 0.76 -0.29 -0.43 9.45 0.00 -1.26 -5.11 107.32 110.46 2yuz s GLY 4 Ca -0.06 2.15 -0.27 0.00 0.00 0.00 0.00 44.72 46.54 2yuz s GLY 4 CO -0.02 1.33 2.03 -0.45 0.00 0.00 0.00 173.10 175.99 2yuz s SER 5 N -0.59 5.30 -0.13 1.64 0.15 -1.26 -4.96 113.70 113.85 2yuz s SER 5 Ca -0.01 1.09 -0.11 0.00 0.70 0.00 0.00 55.95 57.61 2yuz s SER 5 Cb -0.02 -2.52 -0.05 0.00 -1.71 0.00 0.00 66.02 61.72 2yuz s SER 5 CO 0.00 -2.21 0.24 -0.44 1.20 0.00 0.00 173.24 172.02 2yuz s SER 6 N 8.46 6.43 -0.03 5.45 0.01 -1.26 -5.09 113.70 127.67 2yuz s SER 6 Ca 0.84 0.51 0.05 0.00 1.31 0.00 0.00 55.95 58.66 2yuz s SER 6 Cb -0.20 -2.14 -0.03 0.00 0.21 0.00 0.00 66.02 63.86 2yuz s SER 6 CO 0.29 0.24 -0.15 -0.83 0.41 0.00 0.00 173.24 173.19 2yuz s GLY 7 N -0.20 1.54 0.41 3.44 0.00 -1.26 -5.09 107.32 106.15 2yuz s GLY 7 Ca 0.15 -1.03 -0.24 0.00 0.00 0.00 0.00 44.72 43.60 2yuz s GLY 7 CO 0.04 -0.85 0.93 -0.10 0.00 0.00 0.00 173.10 173.13 2yuz n LEU 8 N 2.12 2.14 -4.39 0.66 7.94 -1.26 -5.00 117.00 119.21 2yuz n LEU 8 Ca -0.17 1.02 -0.29 0.00 -1.11 0.00 0.00 56.01 55.46 2yuz n LEU 8 Cb 0.52 -1.31 -0.13 0.00 0.53 0.00 0.00 43.42 43.03 2yuz n LEU 8 CO 0.26 -1.72 -0.56 -0.54 -1.11 0.00 0.00 177.39 173.72 2yuz s LYS 9 N -1.93 1.53 -0.65 1.96 1.02 -1.26 -5.01 119.74 115.40 2yuz s LYS 9 Ca 0.63 -1.28 -0.18 0.00 0.02 0.00 0.00 55.97 55.17 2yuz s LYS 9 Cb -0.57 -1.94 0.13 0.00 -0.52 0.00 0.00 37.83 34.92 2yuz s LYS 9 CO 0.57 0.47 0.72 0.42 -0.92 0.00 0.00 175.35 176.60 2yuz s ILE 10 N -1.01 5.00 -0.09 2.17 1.09 -1.26 -2.14 121.20 124.96 2yuz s ILE 10 Ca 0.14 -1.36 -0.23 0.00 -1.10 0.00 0.00 60.65 58.10 2yuz s ILE 10 Cb -0.10 -4.49 -0.19 0.00 -1.06 0.00 0.00 42.46 36.62 2yuz s ILE 10 CO 0.05 -1.10 0.78 -0.07 -0.10 0.00 0.00 174.94 174.50 2yuz h LEU 11 N 9.50 -0.05 -6.76 2.97 3.38 -1.85 -3.42 115.31 119.08 2yuz h LEU 11 Ca -0.20 -0.63 -0.60 0.00 0.09 0.00 0.00 57.88 56.54 2yuz h LEU 11 Cb 1.08 0.01 -0.40 0.00 0.09 0.00 0.00 40.66 41.44 2yuz h LEU 11 CO 1.04 0.70 -0.80 -0.89 0.09 0.00 0.00 178.44 178.58 2yuz s THR 12 N -2.77 0.92 0.44 0.22 2.01 -0.20 -4.94 115.64 111.32 2yuz s THR 12 Ca -0.15 -2.40 -0.23 0.00 0.31 0.00 0.00 61.69 59.21 2yuz s THR 12 Cb -0.01 -1.64 -0.08 0.00 0.01 0.00 0.00 72.50 70.78 2yuz s THR 12 CO 0.55 -0.99 1.17 -2.16 -0.69 0.00 0.00 174.62 172.50 2yuz s PRO 13 N 0.42 3.83 -0.29 4.92 0.04 -1.26 -0.26 135.00 142.40 2yuz s PRO 13 Ca 0.21 1.80 -0.41 0.00 0.04 0.00 0.00 61.00 62.64 2yuz s PRO 13 Cb -0.18 -2.48 -0.16 0.00 0.04 0.00 0.00 34.50 31.72 2yuz s PRO 13 CO -0.04 -0.50 1.71 1.28 0.04 0.00 0.00 177.00 179.49 2yuz n LEU 14 N -0.34 2.19 -4.80 -3.56 4.77 -1.26 -4.92 117.00 109.07 2yuz n LEU 14 Ca 0.06 1.09 -0.37 0.00 -0.03 0.00 0.00 56.01 56.77 2yuz n LEU 14 Cb 0.48 -1.11 -0.06 0.00 -2.33 0.00 0.00 43.42 40.40 2yuz n LEU 14 CO 0.48 -0.52 -0.02 0.42 -1.33 0.00 0.00 177.39 176.43 2yuz s THR 15 N 3.35 5.27 0.08 -5.08 -4.23 -1.26 -4.45 115.64 109.32 2yuz s THR 15 Ca 0.99 0.54 -0.30 0.00 -1.18 0.00 0.00 61.69 61.74 2yuz s THR 15 Cb -1.13 -3.59 -0.16 0.00 1.34 0.00 0.00 72.50 68.96 2yuz s THR 15 CO 0.67 0.51 0.70 -0.90 -0.54 0.00 0.00 174.62 175.07 2yuz n ASP 16 N 2.57 -0.49 -3.93 3.99 5.68 -1.26 -4.84 116.55 118.27 2yuz n ASP 16 Ca -0.15 0.98 -0.21 0.00 -0.50 0.00 0.00 54.79 54.91 2yuz n ASP 16 Cb 0.53 -0.80 -0.16 0.00 -1.14 0.00 0.00 41.12 39.55 2yuz n ASP 16 CO 0.00 0.00 0.00 -1.58 -1.33 0.00 0.00 177.20 174.29 2yuz s GLN 17 N -0.39 1.05 -0.25 0.11 2.00 -0.70 -4.97 119.66 116.52 2yuz s GLN 17 Ca 0.67 -0.19 0.01 0.00 -2.00 0.00 0.00 55.36 53.85 2yuz s GLN 17 Cb -0.95 -0.97 0.05 0.00 0.80 0.00 0.00 33.01 31.93 2yuz s GLN 17 CO 0.48 -0.04 -0.11 0.99 -0.50 0.00 0.00 175.29 176.12 2yuz s THR 18 N 0.79 2.34 0.11 -0.34 2.01 -1.26 -3.20 115.64 116.09 2yuz s THR 18 Ca -0.12 -1.40 0.06 0.00 0.31 0.00 0.00 61.69 60.54 2yuz s THR 18 Cb -0.14 -2.28 -0.04 0.00 0.01 0.00 0.00 72.50 70.05 2yuz s THR 18 CO 0.01 0.10 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.20 2yuz s VAL 19 N 1.18 1.31 1.30 3.82 1.01 -1.14 -5.00 120.40 122.88 2yuz s VAL 19 Ca -0.05 -1.61 -0.18 0.00 0.00 0.00 0.00 61.98 60.14 2yuz s VAL 19 Cb -0.18 -1.43 0.31 0.00 0.00 0.00 0.00 36.38 35.08 2yuz s VAL 19 CO -0.06 -0.34 0.80 -3.20 0.00 0.00 0.00 175.10 172.30 2yuz n ASN 20 N 0.75 -3.03 -4.68 3.32 2.85 -1.26 -3.21 115.26 110.00 2yuz n ASN 20 Ca -0.17 -0.50 -0.41 0.00 -0.11 0.00 0.00 54.58 53.38 2yuz n ASN 20 Cb 0.56 -1.08 -0.04 0.00 1.24 0.00 0.00 39.78 40.47 2yuz n ASN 20 CO 0.00 0.00 0.00 -0.22 -2.11 0.00 0.00 177.26 174.93 2yuz s LEU 21 N -6.41 4.21 0.00 1.20 0.20 -1.03 -3.57 118.68 113.29 2yuz s LEU 21 Ca 0.64 1.25 0.00 0.00 0.69 0.00 0.00 54.13 56.71 2yuz s LEU 21 Cb -0.17 -3.27 0.00 0.00 -0.43 0.00 0.00 46.19 42.31 2yuz s LEU 21 CO 0.59 -0.36 0.00 0.61 -0.29 0.00 0.00 176.35 176.90 2yuz n GLY 22 N 3.34 3.28 3.39 7.98 0.00 0.96 -4.90 105.19 119.24 2yuz n GLY 22 Ca 0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 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 -1.36 -1.80 -2.68 1.61 4.76 -1.23 -2.77 118.16 114.69 2yuz n LYS 23 Ca 0.00 -0.50 -0.42 0.00 -2.87 0.00 0.00 58.31 54.52 2yuz n LYS 23 Cb 0.00 -1.94 -0.03 0.00 -1.84 0.00 0.00 35.03 31.22 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 -3.91 3.39 0.52 1.97 2.12 -1.25 -0.74 118.70 120.79 2yuz s GLU 24 Ca 0.62 -0.93 -0.21 0.00 0.36 0.00 0.00 54.97 54.80 2yuz s GLU 24 Cb -0.19 -4.74 -0.08 0.00 0.26 0.00 0.00 34.13 29.39 2yuz s GLU 24 CO 0.65 -2.04 0.94 -0.89 -0.54 0.00 0.00 175.26 173.38 2yuz n ILE 25 N 6.32 2.95 -3.67 -3.70 2.08 -0.79 -4.75 119.36 117.80 2yuz n ILE 25 Ca 0.16 -0.50 -0.12 0.00 0.56 0.00 0.00 62.75 62.85 2yuz n ILE 25 Cb 0.49 -1.11 -0.12 0.00 -0.75 0.00 0.00 39.64 38.15 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 2.30 1.17 0.10 0.00 1.43 -0.20 -4.98 118.68 118.50 2yuz s LEU 27 Ca -0.01 -0.89 0.09 0.00 -1.03 0.00 0.00 54.13 52.29 2yuz s LEU 27 Cb -0.12 -0.58 -0.04 0.00 0.03 0.00 0.00 46.19 45.49 2yuz s LEU 27 CO -0.10 -0.32 -0.22 -0.75 0.23 0.00 0.00 176.35 175.19 2yuz s LYS 28 N 1.87 1.72 0.20 1.70 2.20 -1.26 -0.63 119.74 125.54 2yuz s LYS 28 Ca 0.00 -1.19 -0.09 0.00 -0.36 0.00 0.00 55.97 54.33 2yuz s LYS 28 Cb -0.17 -2.05 -0.01 0.00 -1.51 0.00 0.00 37.83 34.09 2yuz s LYS 28 CO -0.11 0.49 0.34 0.00 -0.36 0.00 0.00 175.35 175.71 2yuz s GLU 30 N -4.02 1.85 0.23 0.00 2.12 0.64 -2.78 118.70 116.74 2yuz s GLU 30 Ca 0.23 -0.69 0.04 0.00 0.36 0.00 0.00 54.97 54.91 2yuz s GLU 30 Cb 0.02 -1.65 -0.05 0.00 0.26 0.00 0.00 34.13 32.71 2yuz s GLU 30 CO 0.05 0.33 -0.03 0.96 -0.54 0.00 0.00 175.26 176.03 2yuz s ILE 31 N -0.16 1.21 -0.50 -3.70 -4.36 -1.03 -1.04 121.20 111.62 2yuz s ILE 31 Ca 0.00 -2.06 -0.02 0.00 -0.26 0.00 0.00 60.65 58.30 2yuz s ILE 31 Cb -0.11 -2.28 0.20 0.00 1.25 0.00 0.00 42.46 41.53 2yuz s ILE 31 CO 0.01 -0.39 2.34 -1.20 0.24 0.00 0.00 174.94 175.95 2yuz n SER 32 N -0.42 6.81 -3.59 4.36 7.64 -0.91 -4.78 113.62 122.73 2yuz n SER 32 Ca -0.06 -3.34 -0.05 0.00 1.01 0.00 0.00 58.87 56.43 2yuz n SER 32 Cb 0.63 -1.12 -0.02 0.00 -1.01 0.00 0.00 64.21 62.69 2yuz n SER 32 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 2yuz s GLU 33 N -2.39 0.33 -0.56 1.43 2.56 -1.26 -4.64 118.70 114.16 2yuz s GLU 33 Ca 0.51 -0.11 0.03 0.00 0.00 0.00 0.00 54.97 55.40 2yuz s GLU 33 Cb 0.37 0.15 0.39 0.00 2.00 0.00 0.00 34.13 37.05 2yuz s GLU 33 CO -0.16 -0.14 1.31 0.27 -0.56 0.00 0.00 175.26 175.98 2yuz n ASN 34 N -0.07 5.38 -4.68 -1.70 0.23 -1.26 -4.32 115.26 108.84 2yuz n ASN 34 Ca -0.00 -3.74 -0.30 0.00 -0.53 0.00 0.00 54.58 50.01 2yuz n ASN 34 Cb 0.58 -0.62 -0.08 0.00 -2.08 0.00 0.00 39.78 37.58 2yuz n ASN 34 CO 0.00 0.00 0.00 0.27 -0.93 0.00 0.00 177.26 176.60 2yuz s ILE 35 N -5.31 3.98 0.28 1.53 -5.25 -1.26 -4.97 121.20 110.20 2yuz s ILE 35 Ca 0.49 -1.01 -0.29 0.00 -0.99 0.00 0.00 60.65 58.84 2yuz s ILE 35 Cb 0.39 -2.90 -0.10 0.00 2.95 0.00 0.00 42.46 42.81 2yuz s ILE 35 CO -0.23 0.11 1.25 -2.16 -1.79 0.00 0.00 174.94 172.12 2yuz s PRO 36 N -2.32 4.44 0.19 0.37 0.04 -1.26 -4.92 135.00 131.54 2yuz s PRO 36 Ca 0.26 2.06 0.00 0.00 0.04 0.00 0.00 61.00 63.36 2yuz s PRO 36 Cb -0.12 -3.14 -0.04 0.00 0.04 0.00 0.00 34.50 31.24 2yuz s PRO 36 CO 0.18 -0.10 0.06 0.20 0.04 0.00 0.00 177.00 177.38 2yuz s GLY 37 N -0.33 1.35 0.07 0.56 0.00 -1.26 -2.51 107.32 105.19 2yuz s GLY 37 Ca 0.50 -1.66 0.09 0.00 0.00 0.00 0.00 44.72 43.65 2yuz s GLY 37 CO 0.45 -1.48 -0.24 1.25 0.00 0.00 0.00 173.10 173.07 2yuz s LYS 38 N -4.02 1.52 0.32 2.90 2.47 -0.25 -4.91 119.74 117.77 2yuz s LYS 38 Ca 0.30 -1.13 0.02 0.00 -1.56 0.00 0.00 55.97 53.61 2yuz s LYS 38 Cb 0.07 -1.77 -0.03 0.00 -1.46 0.00 0.00 37.83 34.64 2yuz s LYS 38 CO 0.07 0.44 0.50 -1.58 0.16 0.00 0.00 175.35 174.95 2yuz s TRP 39 N -0.90 3.46 -0.08 4.03 0.52 -1.26 -1.35 118.94 123.36 2yuz s TRP 39 Ca 0.11 0.22 -0.07 0.00 0.02 0.00 0.00 56.10 56.38 2yuz s TRP 39 Cb -0.10 -1.83 0.02 0.00 -1.15 0.00 0.00 33.47 30.42 2yuz s TRP 39 CO 0.03 0.18 0.22 0.95 0.02 0.00 0.00 176.95 178.35 2yuz s THR 40 N -2.23 -0.01 -0.03 2.01 -4.23 0.21 -2.90 115.64 108.45 2yuz s THR 40 Ca 0.39 0.02 0.02 0.00 -1.18 0.00 0.00 61.69 60.94 2yuz s THR 40 Cb -0.09 -0.31 -0.03 0.00 1.34 0.00 0.00 72.50 73.40 2yuz s THR 40 CO 0.34 0.01 -0.07 -0.75 -0.54 0.00 0.00 174.62 173.61 2yuz s LYS 41 N 0.26 2.66 -1.49 3.99 2.36 0.85 -1.09 119.74 127.27 2yuz s LYS 41 Ca -0.01 -0.63 -0.19 0.00 -2.55 0.00 0.00 55.97 52.59 2yuz s LYS 41 Cb -0.03 -2.55 0.19 0.00 -1.05 0.00 0.00 37.83 34.39 2yuz s LYS 41 CO -0.01 0.64 0.47 0.09 1.55 0.00 0.00 175.35 178.08 2yuz n ASN 42 N 1.91 -1.40 -2.15 1.43 3.02 -0.42 0.19 115.26 117.84 2yuz n ASN 42 Ca -0.17 -0.99 -0.11 0.00 -0.03 0.00 0.00 54.58 53.28 2yuz n ASN 42 Cb 0.53 -1.27 0.04 0.00 -0.61 0.00 0.00 39.78 38.47 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 -0.97 0.13 3.11 7.41 0.00 -1.26 -5.05 105.19 108.56 2yuz n GLY 43 Ca 0.09 -0.19 -0.11 0.00 0.00 0.00 0.00 46.02 45.81 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 -4.26 1.58 -0.61 0.99 1.43 0.51 -5.10 118.68 113.21 2yuz s LEU 44 Ca 0.21 -0.25 -0.26 0.00 -1.03 0.00 0.00 54.13 52.80 2yuz s LEU 44 Cb -0.09 0.68 -0.02 0.00 0.03 0.00 0.00 46.19 46.78 2yuz s LEU 44 CO 0.38 -0.39 1.86 -2.16 0.23 0.00 0.00 176.35 176.27 2yuz s PRO 45 N -1.55 2.62 -0.05 1.29 0.04 -1.26 -0.11 135.00 135.99 2yuz s PRO 45 Ca -0.14 0.61 -0.37 0.00 0.04 0.00 0.00 61.00 61.14 2yuz s PRO 45 Cb -0.07 -4.39 -0.15 0.00 0.04 0.00 0.00 34.50 29.93 2yuz s PRO 45 CO 0.01 -2.74 1.57 0.28 0.04 0.00 0.00 177.00 176.16 2yuz n VAL 46 N 7.22 0.17 -2.59 -0.36 0.31 -1.14 -4.86 118.33 117.08 2yuz n VAL 46 Ca 0.20 -0.03 -0.41 0.00 -0.01 0.00 0.00 64.34 64.09 2yuz n VAL 46 Cb 0.52 -1.17 -0.03 0.00 -0.91 0.00 0.00 33.84 32.25 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 2.01 3.23 0.26 5.55 0.74 -1.26 -4.93 119.66 125.26 2yuz s GLN 47 Ca 0.90 -0.41 -0.29 0.00 0.05 0.00 0.00 55.36 55.60 2yuz s GLN 47 Cb -0.93 -4.31 -0.09 0.00 1.10 0.00 0.00 33.01 28.77 2yuz s GLN 47 CO 0.53 -2.12 1.24 -1.21 -0.55 0.00 0.00 175.29 173.18 2yuz s GLU 48 N 5.45 4.46 0.29 1.67 2.02 -1.26 -4.87 118.70 126.46 2yuz s GLU 48 Ca 0.35 2.02 -0.19 0.00 0.02 0.00 0.00 54.97 57.17 2yuz s GLU 48 Cb -0.08 -3.16 0.02 0.00 0.10 0.00 0.00 34.13 31.01 2yuz s GLU 48 CO 0.12 -0.08 0.69 -1.12 0.02 0.00 0.00 175.26 174.88 2yuz s SER 49 N -0.28 -0.17 0.21 -0.19 0.01 -1.05 -4.96 113.70 107.27 2yuz s SER 49 Ca 0.50 -0.76 -0.03 0.00 1.31 0.00 0.00 55.95 56.97 2yuz s SER 49 Cb -0.36 0.73 0.41 0.00 0.21 0.00 0.00 66.02 67.01 2yuz s SER 49 CO 0.44 -1.37 1.13 0.47 0.41 0.00 0.00 173.24 174.32 2yuz n ASP 50 N -0.62 -0.20 0.04 2.44 9.92 -1.26 0.13 116.55 127.00 2yuz n ASP 50 Ca -0.04 1.24 -0.12 0.00 -0.53 0.00 0.00 54.79 55.34 2yuz n ASP 50 Cb 0.60 -0.40 -0.08 0.00 -0.64 0.00 0.00 41.12 40.60 2yuz n ASP 50 CO 0.00 0.00 0.00 0.08 0.13 0.00 0.00 177.20 177.41 2yuz h ARG 51 N 0.00 -0.03 -5.43 -1.24 0.11 -1.97 -3.40 114.38 102.42 2yuz h ARG 51 Ca 0.38 0.00 -0.64 0.00 0.10 0.00 0.00 59.98 59.82 2yuz h ARG 51 Cb 0.65 0.01 -0.14 0.00 1.11 0.00 0.00 29.97 31.60 2yuz h ARG 51 CO -0.73 0.09 0.11 -1.17 0.10 0.00 0.00 179.97 178.38 2yuz s LEU 52 N -9.96 4.35 -0.14 0.08 0.20 0.35 -3.36 118.68 110.19 2yuz s LEU 52 Ca -0.14 -0.04 0.02 0.00 0.69 0.00 0.00 54.13 54.67 2yuz s LEU 52 Cb 0.05 -2.74 0.01 0.00 -0.43 0.00 0.00 46.19 43.08 2yuz s LEU 52 CO 0.66 -0.64 -0.20 -0.75 -0.29 0.00 0.00 176.35 175.13 2yuz s LYS 53 N 2.71 2.82 -0.50 1.98 2.47 -1.24 -2.52 119.74 125.45 2yuz s LYS 53 Ca 0.23 -0.78 -0.17 0.00 -1.56 0.00 0.00 55.97 53.69 2yuz s LYS 53 Cb -0.14 -2.32 0.08 0.00 -1.46 0.00 0.00 37.83 33.99 2yuz s LYS 53 CO 0.16 -0.05 0.49 0.08 0.16 0.00 0.00 175.35 176.19 2yuz s VAL 54 N 0.93 5.12 0.04 4.02 1.01 -1.26 -3.54 120.40 126.72 2yuz s VAL 54 Ca -0.05 -1.03 -0.19 0.00 0.00 0.00 0.00 61.98 60.71 2yuz s VAL 54 Cb -0.15 -4.24 -0.06 0.00 0.00 0.00 0.00 36.38 31.93 2yuz s VAL 54 CO -0.03 -0.73 0.55 -0.69 0.00 0.00 0.00 175.10 174.19 2yuz s VAL 55 N 1.93 4.83 -0.08 2.92 1.01 -0.15 -4.95 120.40 125.90 2yuz s VAL 55 Ca 0.07 1.17 0.04 0.00 0.00 0.00 0.00 61.98 63.25 2yuz s VAL 55 Cb -0.24 -3.88 0.00 0.00 0.00 0.00 0.00 36.38 32.26 2yuz s VAL 55 CO 0.07 0.52 -0.21 -1.58 0.00 0.00 0.00 175.10 173.90 2yuz s GLN 56 N -0.85 2.63 -0.38 2.72 0.74 -1.26 -0.42 119.66 122.83 2yuz s GLN 56 Ca 0.29 -0.78 0.01 0.00 0.05 0.00 0.00 55.36 54.93 2yuz s GLN 56 Cb -0.19 -2.06 0.12 0.00 1.10 0.00 0.00 33.01 31.99 2yuz s GLN 56 CO 0.18 0.19 0.17 0.15 -0.55 0.00 0.00 175.29 175.43 2yuz s LYS 57 N 0.30 1.05 3.43 1.67 -0.14 -0.32 -5.01 119.74 120.72 2yuz s LYS 57 Ca -0.15 -1.62 0.00 0.00 -1.36 0.00 0.00 55.97 52.84 2yuz s LYS 57 Cb -0.16 -2.20 0.00 0.00 -1.68 0.00 0.00 37.83 33.78 2yuz s LYS 57 CO 0.07 -1.09 0.00 0.41 -0.76 0.00 0.00 175.35 173.98 2yuz n GLY 58 N 4.09 0.37 2.44 -3.33 0.00 -1.26 -1.55 105.19 105.94 2yuz n GLY 58 Ca 0.05 0.68 -0.30 0.00 0.00 0.00 0.00 46.02 46.44 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 3.25 -3.69 1.61 1.74 -1.26 -4.14 116.66 114.16 2yuz n ARG 59 Ca 0.00 -4.07 -0.10 0.00 -0.77 0.00 0.00 57.85 52.90 2yuz n ARG 59 Cb 0.00 -2.27 -0.11 0.00 -1.02 0.00 0.00 32.46 29.06 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 -5.12 -0.15 -0.32 0.55 1.01 -0.60 -2.46 121.20 114.11 2yuz s ILE 60 Ca 0.52 0.12 -0.09 0.00 0.00 0.00 0.00 60.65 61.20 2yuz s ILE 60 Cb 0.42 -0.58 0.01 0.00 0.01 0.00 0.00 42.46 42.32 2yuz s ILE 60 CO -0.16 0.05 0.14 -1.00 0.00 0.00 0.00 174.94 173.98 2yuz s HIS 61 N 1.63 3.19 -0.00 3.97 3.76 -1.12 -1.17 115.29 125.55 2yuz s HIS 61 Ca -0.08 -0.82 0.01 0.00 -0.15 0.00 0.00 55.06 54.03 2yuz s HIS 61 Cb -0.09 -2.34 -0.04 0.00 1.11 0.00 0.00 32.58 31.22 2yuz s HIS 61 CO -0.12 -0.55 0.00 0.21 -0.85 0.00 0.00 174.74 173.43 2yuz s LYS 62 N 1.56 2.79 -0.24 1.40 2.20 0.44 -2.54 119.74 125.34 2yuz s LYS 62 Ca 0.03 -0.61 -0.03 0.00 -0.36 0.00 0.00 55.97 55.01 2yuz s LYS 62 Cb -0.18 -2.67 0.11 0.00 -1.51 0.00 0.00 37.83 33.58 2yuz s LYS 62 CO 0.05 0.62 0.26 -1.17 -0.36 0.00 0.00 175.35 174.76 2yuz s LEU 63 N -1.57 -0.20 -0.03 5.43 0.20 0.20 -0.98 118.68 121.73 2yuz s LEU 63 Ca 0.20 -0.37 0.06 0.00 0.69 0.00 0.00 54.13 54.70 2yuz s LEU 63 Cb -0.12 0.49 -0.02 0.00 -0.43 0.00 0.00 46.19 46.12 2yuz s LEU 63 CO 0.10 -0.35 -0.20 0.68 -0.29 0.00 0.00 176.35 176.30 2yuz s VAL 64 N 2.36 2.60 -0.01 1.68 -7.23 -1.23 -1.03 120.40 117.54 2yuz s VAL 64 Ca 0.09 -0.91 0.01 0.00 -1.81 0.00 0.00 61.98 59.35 2yuz s VAL 64 Cb -0.15 -1.98 -0.04 0.00 0.56 0.00 0.00 36.38 34.78 2yuz s VAL 64 CO -0.20 0.58 0.02 -0.63 -0.31 0.00 0.00 175.10 174.56 2yuz s ILE 65 N -0.68 4.32 0.02 -0.62 1.01 -0.32 -3.68 121.20 121.24 2yuz s ILE 65 Ca 0.11 -0.51 -0.11 0.00 0.00 0.00 0.00 60.65 60.13 2yuz s ILE 65 Cb -0.10 -2.93 -0.06 0.00 0.01 0.00 0.00 42.46 39.37 2yuz s ILE 65 CO -0.00 0.39 1.14 0.00 0.00 0.00 0.00 174.94 176.47 2yuz h ALA 66 N 4.36 -1.08 -3.78 9.38 0.00 -1.87 -2.11 119.26 124.16 2yuz h ALA 66 Ca -0.49 -0.09 -0.65 0.00 0.00 0.00 0.00 54.91 53.67 2yuz h ALA 66 Cb 1.18 0.16 -0.38 0.00 0.00 0.00 0.00 17.79 18.75 2yuz h ALA 66 CO 0.58 -1.05 -0.78 1.21 0.00 0.00 0.00 179.25 179.21 2yuz s ASN 67 N -2.65 4.36 0.06 0.00 3.84 -1.26 -3.81 114.94 115.48 2yuz s ASN 67 Ca -0.06 -1.47 -0.33 0.00 0.21 0.00 0.00 52.86 51.21 2yuz s ASN 67 Cb 0.01 -1.47 -0.12 0.00 -0.55 0.00 0.00 41.25 39.12 2yuz s ASN 67 CO 0.18 -0.23 1.78 0.00 -2.79 0.00 0.00 177.10 176.03 2yuz n ALA 68 N 4.46 1.43 -2.59 1.71 0.00 0.08 -4.75 120.51 120.86 2yuz n ALA 68 Ca -0.11 0.34 -0.26 0.00 0.00 0.00 0.00 53.44 53.41 2yuz n ALA 68 Cb 0.42 -2.49 -0.09 0.00 0.00 0.00 0.00 19.45 17.30 2yuz n ALA 68 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2yuz s LEU 69 N 2.70 3.05 0.32 0.00 1.43 -1.26 -0.03 118.68 124.89 2yuz s LEU 69 Ca 0.85 -0.58 0.08 0.00 -1.03 0.00 0.00 54.13 53.46 2yuz s LEU 69 Cb -0.62 -1.70 0.92 0.00 0.03 0.00 0.00 46.19 44.83 2yuz s LEU 69 CO 0.43 0.08 1.61 0.71 0.23 0.00 0.00 176.35 179.41 2yuz h THR 70 N 2.55 0.16 -0.95 5.49 1.35 -1.98 0.48 112.91 120.01 2yuz h THR 70 Ca -0.46 -0.04 0.28 0.00 -0.55 0.00 0.00 66.41 65.64 2yuz h THR 70 Cb 1.21 0.02 -0.15 0.00 -1.73 0.00 0.00 68.15 67.51 2yuz h THR 70 CO 0.56 0.02 0.42 -0.33 -0.25 0.00 0.00 175.52 175.94 2yuz h GLU 71 N 0.12 0.27 -0.92 4.72 4.39 -2.00 0.29 114.58 121.44 2yuz h GLU 71 Ca 0.66 -0.02 0.26 0.00 0.34 0.00 0.00 59.36 60.61 2yuz h GLU 71 Cb 1.49 -0.06 -0.15 0.00 -0.10 0.00 0.00 28.75 29.93 2yuz h GLU 71 CO -0.75 0.18 0.34 0.38 -1.16 0.00 0.00 179.01 178.00 2yuz h ASP 72 N 0.27 0.16 -1.84 1.42 3.04 -0.43 -3.38 116.42 115.66 2yuz h ASP 72 Ca 0.65 0.20 -0.60 0.00 -3.24 0.00 0.00 57.03 54.04 2yuz h ASP 72 Cb 1.42 0.23 -0.00 0.00 -1.04 0.00 0.00 39.33 39.94 2yuz h ASP 72 CO -0.63 -0.15 1.45 1.21 -2.04 0.00 0.00 179.24 179.08 2yuz n GLU 73 N -5.18 1.86 0.00 4.15 0.00 0.10 -4.49 120.64 117.08 2yuz n GLU 73 Ca 0.25 0.53 0.00 0.00 0.00 0.00 0.00 57.16 57.93 2yuz n GLU 73 Cb 0.78 -3.07 0.00 0.00 0.00 0.00 0.00 31.44 29.16 2yuz n GLU 73 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2yuz n GLY 74 N 5.80 -0.71 3.24 8.31 0.00 -1.26 -5.06 105.19 115.51 2yuz n GLY 74 Ca 0.31 0.52 -0.09 0.00 0.00 0.00 0.00 46.02 46.76 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 -0.20 -0.15 1.61 2.15 -1.26 -4.22 116.67 110.60 2yuz s ASP 75 Ca 0.00 0.94 -0.07 0.00 0.43 0.00 0.00 52.55 53.85 2yuz s ASP 75 Cb 0.00 1.24 -0.04 0.00 -0.30 0.00 0.00 42.92 43.82 2yuz s ASP 75 CO 0.00 -0.23 0.09 -0.31 -0.17 0.00 0.00 175.17 174.55 2yuz s TYR 76 N 2.53 3.39 -0.03 -5.34 1.51 -0.45 -1.30 117.35 117.65 2yuz s TYR 76 Ca -0.02 0.30 0.00 0.00 -1.01 0.00 0.00 57.07 56.34 2yuz s TYR 76 Cb -0.12 -2.00 0.03 0.00 -0.11 0.00 0.00 41.96 39.76 2yuz s TYR 76 CO -0.12 0.43 0.00 0.08 -1.11 0.00 0.00 175.55 174.83 2yuz s VAL 77 N -0.31 0.13 -0.10 0.71 1.01 -0.25 -0.74 120.40 120.86 2yuz s VAL 77 Ca 0.10 0.10 -0.08 0.00 0.00 0.00 0.00 61.98 62.09 2yuz s VAL 77 Cb -0.12 -0.23 -0.04 0.00 0.00 0.00 0.00 36.38 35.99 2yuz s VAL 77 CO 0.01 0.13 0.18 0.12 0.00 0.00 0.00 175.10 175.54 2yuz s PHE 78 N 0.95 3.62 -0.04 5.22 5.36 -1.16 -0.62 117.98 131.29 2yuz s PHE 78 Ca -0.09 0.60 -0.02 0.00 -0.96 0.00 0.00 56.93 56.46 2yuz s PHE 78 Cb -0.13 -2.00 0.03 0.00 -0.34 0.00 0.00 43.02 40.58 2yuz s PHE 78 CO -0.02 0.71 0.07 0.00 -1.46 0.00 0.00 175.22 174.53 2yuz s ALA 79 N -1.00 0.18 0.70 11.12 0.00 -0.45 -2.69 121.76 129.62 2yuz s ALA 79 Ca 0.16 0.23 -0.13 0.00 0.00 0.00 0.00 51.96 52.22 2yuz s ALA 79 Cb -0.13 -0.63 0.02 0.00 0.00 0.00 0.00 23.12 22.38 2yuz s ALA 79 CO 0.05 -0.49 1.10 -1.25 0.00 0.00 0.00 175.76 175.18 2yuz s PRO 80 N 2.16 2.61 0.00 0.00 0.04 -1.26 -1.09 135.00 137.46 2yuz s PRO 80 Ca 0.04 1.31 0.14 0.00 0.04 0.00 0.00 61.00 62.54 2yuz s PRO 80 Cb -0.12 -1.93 0.39 0.00 0.04 0.00 0.00 34.50 32.88 2yuz s PRO 80 CO -0.03 -1.39 1.33 -3.47 0.04 0.00 0.00 177.00 173.48 2yuz n ASP 81 N -2.80 2.36 0.00 6.66 -0.08 -1.05 -4.02 116.55 117.62 2yuz n ASP 81 Ca 0.10 -2.00 0.00 0.00 -1.51 0.00 0.00 54.79 51.38 2yuz n ASP 81 Cb 0.52 -0.29 0.00 0.00 2.34 0.00 0.00 41.12 43.69 2yuz n ASP 81 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2yuz n ALA 82 N 0.79 1.93 -4.56 -1.67 0.00 -1.26 -5.08 120.51 110.66 2yuz n ALA 82 Ca 0.15 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.31 2yuz n ALA 82 Cb 0.37 0.30 -0.06 0.00 0.00 0.00 0.00 19.45 20.06 2yuz n ALA 82 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2yuz n TYR 83 N -2.04 0.67 -2.32 0.00 4.02 -1.26 -5.07 117.16 111.17 2yuz n TYR 83 Ca 0.00 -2.34 -0.31 0.00 -0.01 0.00 0.00 57.90 55.24 2yuz n TYR 83 Cb 0.45 -0.18 0.01 0.00 -0.02 0.00 0.00 39.34 39.61 2yuz n TYR 83 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 2yuz n ASN 84 N -1.40 5.65 -4.85 7.72 4.13 -1.26 -4.24 115.26 121.01 2yuz n ASN 84 Ca -0.13 -3.76 -0.37 0.00 1.68 0.00 0.00 54.58 52.00 2yuz n ASN 84 Cb 0.58 -0.67 -0.06 0.00 -1.54 0.00 0.00 39.78 38.09 2yuz n ASN 84 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2yuz s VAL 85 N -5.35 5.07 -0.05 2.41 1.01 -1.26 -5.03 120.40 117.19 2yuz s VAL 85 Ca 0.49 0.68 0.03 0.00 0.00 0.00 0.00 61.98 63.19 2yuz s VAL 85 Cb 0.41 -3.68 0.01 0.00 0.00 0.00 0.00 36.38 33.12 2yuz s VAL 85 CO -0.26 0.48 -0.14 0.42 0.00 0.00 0.00 175.10 175.60 2yuz s THR 86 N -1.19 1.20 -0.32 3.92 -4.23 -1.25 -4.02 115.64 109.74 2yuz s THR 86 Ca 0.27 -0.55 0.02 0.00 -1.18 0.00 0.00 61.69 60.25 2yuz s THR 86 Cb -0.16 -1.06 0.09 0.00 1.34 0.00 0.00 72.50 72.71 2yuz s THR 86 CO 0.15 0.36 0.02 -0.76 -0.54 0.00 0.00 174.62 173.84 2yuz s LEU 87 N 0.37 4.36 0.30 4.79 1.02 -1.09 -4.91 118.68 123.52 2yuz s LEU 87 Ca -0.09 -1.85 -0.29 0.00 0.02 0.00 0.00 54.13 51.92 2yuz s LEU 87 Cb -0.13 -1.63 -0.10 0.00 0.02 0.00 0.00 46.19 44.34 2yuz s LEU 87 CO 0.03 -0.33 1.23 -2.16 0.02 0.00 0.00 176.35 175.14 2yuz s PRO 88 N 1.01 4.46 -0.13 1.29 0.04 -1.26 -3.01 135.00 137.41 2yuz s PRO 88 Ca 0.04 2.06 -0.05 0.00 0.04 0.00 0.00 61.00 63.08 2yuz s PRO 88 Cb -0.20 -3.12 0.06 0.00 0.04 0.00 0.00 34.50 31.28 2yuz s PRO 88 CO -0.06 -0.05 0.28 0.00 0.04 0.00 0.00 177.00 177.21 2yuz s ALA 89 N -1.07 -0.63 -0.09 8.56 0.00 0.08 -4.55 121.76 124.06 2yuz s ALA 89 Ca 0.48 1.04 -0.12 0.00 0.00 0.00 0.00 51.96 53.36 2yuz s ALA 89 Cb -0.37 -0.86 -0.05 0.00 0.00 0.00 0.00 23.12 21.85 2yuz s ALA 89 CO 0.48 -0.42 0.29 0.15 0.00 0.00 0.00 175.76 176.25 2yuz s LYS 90 N 1.84 3.90 0.18 0.00 1.02 -1.26 -1.34 119.74 124.08 2yuz s LYS 90 Ca -0.04 0.13 0.07 0.00 0.02 0.00 0.00 55.97 56.15 2yuz s LYS 90 Cb -0.11 -3.28 -0.05 0.00 -0.52 0.00 0.00 37.83 33.87 2yuz s LYS 90 CO -0.09 0.56 -0.13 0.14 -0.92 0.00 0.00 175.35 174.91 2yuz s VAL 91 N -0.51 1.55 -0.20 3.17 -7.23 -1.26 -1.71 120.40 114.20 2yuz s VAL 91 Ca 0.18 -2.16 -0.09 0.00 -1.81 0.00 0.00 61.98 58.10 2yuz s VAL 91 Cb -0.14 -1.98 0.08 0.00 0.56 0.00 0.00 36.38 34.90 2yuz s VAL 91 CO 0.07 -0.64 0.47 -1.00 -0.31 0.00 0.00 175.10 173.69 2yuz s HIS 92 N -3.08 -0.78 -0.10 2.82 3.76 -1.19 -4.25 115.29 112.47 2yuz s HIS 92 Ca 0.20 1.55 -0.07 0.00 -0.15 0.00 0.00 55.06 56.60 2yuz s HIS 92 Cb 0.00 0.37 -0.04 0.00 1.11 0.00 0.00 32.58 34.02 2yuz s HIS 92 CO 0.05 -0.43 0.15 0.54 -0.85 0.00 0.00 174.74 174.19 2yuz s VAL 93 N 1.91 5.50 -0.21 -0.90 0.11 -1.26 -2.89 120.40 122.66 2yuz s VAL 93 Ca -0.07 0.17 -0.15 0.00 -2.93 0.00 0.00 61.98 59.01 2yuz s VAL 93 Cb -0.09 -3.42 -0.04 0.00 -1.53 0.00 0.00 36.38 31.29 2yuz s VAL 93 CO -0.14 0.58 0.34 -0.63 -3.33 0.00 0.00 175.10 171.92 2yuz s ILE 94 N -1.07 5.24 0.74 7.04 1.01 -1.20 -4.90 121.20 128.06 2yuz s ILE 94 Ca 0.17 0.58 -0.01 0.00 0.00 0.00 0.00 60.65 61.39 2yuz s ILE 94 Cb -0.12 -3.67 0.13 0.00 0.01 0.00 0.00 42.46 38.81 2yuz s ILE 94 CO 0.06 0.28 1.01 -0.94 0.00 0.00 0.00 174.94 175.35 2yuz s SER 95 N 1.02 4.27 0.00 3.58 1.04 -1.26 -2.45 113.70 119.90 2yuz s SER 95 Ca 0.16 -0.37 0.00 0.00 0.48 0.00 0.00 55.95 56.23 2yuz s SER 95 Cb -0.14 0.02 0.00 0.00 0.10 0.00 0.00 66.02 66.00 2yuz s SER 95 CO 0.07 -1.92 0.00 0.61 0.98 0.00 0.00 173.24 172.98 2yuz n GLY 96 N -2.88 0.39 3.60 7.32 0.00 -1.26 -4.99 105.19 107.37 2yuz n GLY 96 Ca 0.15 -1.56 -0.43 0.00 0.00 0.00 0.00 46.02 44.19 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 3.33 0.10 1.61 0.04 -1.26 -4.90 135.00 131.92 2yuz s PRO 97 Ca 0.00 1.24 -0.20 0.00 0.04 0.00 0.00 61.00 62.09 2yuz s PRO 97 Cb 0.00 -4.17 -0.04 0.00 0.04 0.00 0.00 34.50 30.32 2yuz s PRO 97 CO 0.00 -1.86 1.09 0.45 0.04 0.00 0.00 177.00 176.72 2yuz n SER 98 N 10.14 -0.67 -4.52 6.66 2.88 -1.26 -2.69 113.62 124.17 2yuz n SER 98 Ca 0.21 1.24 -0.42 0.00 -1.33 0.00 0.00 58.87 58.57 2yuz n SER 98 Cb 0.47 -0.20 -0.02 0.00 -0.75 0.00 0.00 64.21 63.71 2yuz n SER 98 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2yuz s SER 99 N -5.02 6.65 0.00 -3.46 0.01 -1.26 -5.16 113.70 105.45 2yuz s SER 99 Ca -0.08 -1.93 0.27 0.00 1.31 0.00 0.00 55.95 55.52 2yuz s SER 99 Cb 0.07 -2.50 0.75 0.00 0.21 0.00 0.00 66.02 64.55 2yuz s SER 99 CO 0.39 -1.24 1.58 0.61 0.41 0.00 0.00 173.24 174.99