#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 5.59 0.00 1.61 0.01 -1.26 -4.95 113.70 114.70 2yuz s SER 2 Ca 0.00 -0.01 0.02 0.00 1.31 0.00 0.00 55.95 57.26 2yuz s SER 2 Cb 0.00 -2.54 -0.01 0.00 0.21 0.00 0.00 66.02 63.68 2yuz s SER 2 CO 0.00 -2.19 -0.05 -0.55 0.41 0.00 0.00 173.24 170.86 2yuz s SER 3 N 6.56 0.58 -0.50 2.44 0.15 -1.26 -5.08 113.70 116.58 2yuz s SER 3 Ca 0.56 -0.13 0.06 0.00 0.70 0.00 0.00 55.95 57.14 2yuz s SER 3 Cb -0.10 -0.05 0.20 0.00 -1.71 0.00 0.00 66.02 64.35 2yuz s SER 3 CO 0.17 0.03 0.78 0.61 1.20 0.00 0.00 173.24 176.03 2yuz n GLY 4 N 2.82 -0.60 3.90 9.45 0.00 -1.26 -4.96 105.19 114.54 2yuz n GLY 4 Ca -0.14 0.49 -0.29 0.00 0.00 0.00 0.00 46.02 46.09 2yuz n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2yuz n SER 5 N 2.76 -3.64 -4.15 1.61 7.64 -1.26 -4.95 113.62 111.62 2yuz n SER 5 Ca 0.16 -0.82 -0.34 0.00 1.01 0.00 0.00 58.87 58.88 2yuz n SER 5 Cb 0.58 -3.77 -0.14 0.00 -1.01 0.00 0.00 64.21 59.87 2yuz n SER 5 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2yuz s SER 6 N -3.59 4.50 0.00 6.43 0.01 -1.26 -5.01 113.70 114.78 2yuz s SER 6 Ca 0.49 -1.15 0.00 0.00 1.31 0.00 0.00 55.95 56.60 2yuz s SER 6 Cb -0.25 -1.64 0.00 0.00 0.21 0.00 0.00 66.02 64.34 2yuz s SER 6 CO 0.84 -0.19 0.00 0.61 0.41 0.00 0.00 173.24 174.91 2yuz n GLY 7 N 4.58 3.62 3.62 3.44 0.00 -1.26 -5.01 105.19 114.19 2yuz n GLY 7 Ca -0.15 -1.41 -0.43 0.00 0.00 0.00 0.00 46.02 44.03 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 3.60 -4.27 0.99 7.94 -1.26 -4.93 117.00 119.07 2yuz n LEU 8 Ca 0.00 0.52 -0.44 0.00 -1.11 0.00 0.00 56.01 54.98 2yuz n LEU 8 Cb 0.00 -1.53 -0.06 0.00 0.53 0.00 0.00 43.42 42.36 2yuz n LEU 8 CO 0.00 -0.31 0.12 -0.75 -1.11 0.00 0.00 177.39 175.34 2yuz s LYS 9 N 5.52 2.87 -0.35 1.96 2.20 -1.26 -4.92 119.74 125.75 2yuz s LYS 9 Ca 0.96 -1.87 -0.30 0.00 -0.36 0.00 0.00 55.97 54.40 2yuz s LYS 9 Cb -0.41 -4.16 -0.08 0.00 -1.51 0.00 0.00 37.83 31.68 2yuz s LYS 9 CO 0.39 -1.27 2.28 -0.89 -0.36 0.00 0.00 175.35 175.50 2yuz n ILE 10 N 4.87 0.19 -0.01 5.43 2.08 -1.26 -2.50 119.36 128.15 2yuz n ILE 10 Ca -0.07 -0.47 -0.19 0.00 0.56 0.00 0.00 62.75 62.59 2yuz n ILE 10 Cb 0.41 -2.28 -0.14 0.00 -0.75 0.00 0.00 39.64 36.88 2yuz n ILE 10 CO 0.00 0.00 0.00 -0.07 0.56 0.00 0.00 176.55 177.04 2yuz h LEU 11 N 15.26 0.25 -7.03 1.39 3.38 -1.81 -3.42 115.31 123.33 2yuz h LEU 11 Ca -0.32 -0.88 -0.62 0.00 0.09 0.00 0.00 57.88 56.15 2yuz h LEU 11 Cb 1.27 -0.08 -0.40 0.00 0.09 0.00 0.00 40.66 41.54 2yuz h LEU 11 CO 1.04 1.35 -0.71 -0.89 0.09 0.00 0.00 178.44 179.32 2yuz s THR 12 N -2.37 1.81 0.60 0.22 2.01 -0.88 -4.93 115.64 112.09 2yuz s THR 12 Ca -0.19 -3.02 -0.17 0.00 0.31 0.00 0.00 61.69 58.62 2yuz s THR 12 Cb 0.01 -2.24 -0.03 0.00 0.01 0.00 0.00 72.50 70.25 2yuz s THR 12 CO 0.74 -0.93 1.12 -2.16 -0.69 0.00 0.00 174.62 172.71 2yuz s PRO 13 N -0.12 3.07 1.12 4.92 0.04 -1.26 -0.10 135.00 142.66 2yuz s PRO 13 Ca 0.20 1.50 -0.17 0.00 0.04 0.00 0.00 61.00 62.57 2yuz s PRO 13 Cb -0.19 -1.98 0.15 0.00 0.04 0.00 0.00 34.50 32.52 2yuz s PRO 13 CO -0.05 -1.05 0.29 1.28 0.04 0.00 0.00 177.00 177.51 2yuz n LEU 14 N -1.88 -1.89 -4.10 -3.56 4.77 -1.26 -4.90 117.00 104.18 2yuz n LEU 14 Ca 0.11 -0.10 -0.08 0.00 -0.03 0.00 0.00 56.01 55.92 2yuz n LEU 14 Cb 0.51 -1.05 -0.10 0.00 -2.33 0.00 0.00 43.42 40.45 2yuz n LEU 14 CO 0.45 -3.17 -0.36 0.42 -1.33 0.00 0.00 177.39 173.40 2yuz s THR 15 N -2.29 0.27 -0.14 -5.08 -4.23 -1.26 -4.94 115.64 97.96 2yuz s THR 15 Ca 0.59 -1.79 -0.29 0.00 -1.18 0.00 0.00 61.69 59.02 2yuz s THR 15 Cb -0.16 -1.50 -0.04 0.00 1.34 0.00 0.00 72.50 72.15 2yuz s THR 15 CO 0.66 -0.97 1.60 1.51 -0.54 0.00 0.00 174.62 176.88 2yuz s ASP 16 N -2.88 6.55 -0.05 3.99 -4.77 -1.26 -4.62 116.67 113.63 2yuz s ASP 16 Ca 0.07 1.89 0.05 0.00 -3.30 0.00 0.00 52.55 51.26 2yuz s ASP 16 Cb 0.07 -2.53 -0.02 0.00 -1.09 0.00 0.00 42.92 39.35 2yuz s ASP 16 CO -0.09 -1.07 -0.20 -1.10 0.70 0.00 0.00 175.17 173.40 2yuz s GLN 17 N 4.30 2.44 -0.14 2.11 1.11 -1.11 -5.01 119.66 123.36 2yuz s GLN 17 Ca 0.71 -0.81 0.01 0.00 0.01 0.00 0.00 55.36 55.27 2yuz s GLN 17 Cb -0.28 -2.24 0.02 0.00 -1.01 0.00 0.00 33.01 29.49 2yuz s GLN 17 CO 0.28 0.53 -0.15 0.99 0.01 0.00 0.00 175.29 176.94 2yuz s THR 18 N -0.51 1.62 0.02 -0.19 2.01 -1.26 -3.43 115.64 113.90 2yuz s THR 18 Ca 0.07 -0.68 0.00 0.00 0.31 0.00 0.00 61.69 61.39 2yuz s THR 18 Cb -0.11 -1.51 -0.02 0.00 0.01 0.00 0.00 72.50 70.87 2yuz s THR 18 CO 0.01 0.47 -0.03 0.68 -0.69 0.00 0.00 174.62 175.06 2yuz s VAL 19 N 1.36 0.11 1.35 3.82 -7.23 -1.12 -5.04 120.40 113.65 2yuz s VAL 19 Ca 0.03 -0.69 -0.21 0.00 -1.81 0.00 0.00 61.98 59.30 2yuz s VAL 19 Cb -0.13 -0.22 0.34 0.00 0.56 0.00 0.00 36.38 36.93 2yuz s VAL 19 CO -0.09 -0.36 0.97 0.20 -0.31 0.00 0.00 175.10 175.51 2yuz s ASN 20 N -1.09 -0.45 0.12 4.85 -0.87 -1.26 -2.95 114.94 113.29 2yuz s ASN 20 Ca -0.12 0.93 -0.30 0.00 -1.57 0.00 0.00 52.86 51.80 2yuz s ASN 20 Cb -0.07 -1.35 -0.06 0.00 -0.02 0.00 0.00 41.25 39.74 2yuz s ASN 20 CO -0.01 -5.00 1.09 -0.22 -2.57 0.00 0.00 177.10 170.39 2yuz s LEU 21 N -7.61 4.45 0.00 0.60 0.20 -1.23 -3.07 118.68 112.02 2yuz s LEU 21 Ca 0.69 1.98 0.00 0.00 0.69 0.00 0.00 54.13 57.49 2yuz s LEU 21 Cb -0.15 -3.59 0.00 0.00 -0.43 0.00 0.00 46.19 42.02 2yuz s LEU 21 CO 0.59 -0.26 0.00 0.61 -0.29 0.00 0.00 176.35 177.00 2yuz n GLY 22 N 2.44 2.24 3.78 7.98 0.00 -0.67 -4.85 105.19 116.11 2yuz n GLY 22 Ca 0.04 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 2yuz n GLY 22 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2yuz s LYS 23 N -0.47 2.95 -0.69 1.61 -0.14 -1.17 -4.03 119.74 117.79 2yuz s LYS 23 Ca 0.00 1.37 -0.25 0.00 -1.36 0.00 0.00 55.97 55.73 2yuz s LYS 23 Cb 0.00 -1.97 0.05 0.00 -1.68 0.00 0.00 37.83 34.22 2yuz s LYS 23 CO 0.00 -1.13 1.14 -2.00 -0.76 0.00 0.00 175.35 172.60 2yuz s GLU 24 N -4.03 3.19 0.32 1.68 2.12 -1.26 -1.81 118.70 118.90 2yuz s GLU 24 Ca 0.67 -0.43 -0.29 0.00 0.36 0.00 0.00 54.97 55.28 2yuz s GLU 24 Cb -0.20 -4.18 -0.10 0.00 0.26 0.00 0.00 34.13 29.91 2yuz s GLU 24 CO 0.39 -1.96 1.31 0.42 -0.54 0.00 0.00 175.26 174.88 2yuz s ILE 25 N 4.98 2.76 -0.07 -3.70 1.01 -1.18 -4.86 121.20 120.13 2yuz s ILE 25 Ca 0.30 0.74 0.03 0.00 0.00 0.00 0.00 60.65 61.73 2yuz s ILE 25 Cb -0.11 -3.47 0.00 0.00 0.01 0.00 0.00 42.46 38.89 2yuz s ILE 25 CO 0.14 0.17 -0.18 0.00 0.00 0.00 0.00 174.94 175.07 2yuz s LEU 27 N 0.41 0.14 -0.03 0.00 1.43 -0.77 -4.99 118.68 114.88 2yuz s LEU 27 Ca -0.14 0.50 -0.03 0.00 -1.03 0.00 0.00 54.13 53.43 2yuz s LEU 27 Cb -0.16 0.63 0.01 0.00 0.03 0.00 0.00 46.19 46.70 2yuz s LEU 27 CO 0.06 -0.20 0.10 -0.75 0.23 0.00 0.00 176.35 175.78 2yuz s LYS 28 N 1.76 0.14 0.15 1.70 2.20 -1.26 -0.15 119.74 124.29 2yuz s LYS 28 Ca -0.04 0.08 -0.01 0.00 -0.36 0.00 0.00 55.97 55.64 2yuz s LYS 28 Cb -0.11 0.07 -0.04 0.00 -1.51 0.00 0.00 37.83 36.23 2yuz s LYS 28 CO -0.08 -0.02 0.07 0.00 -0.36 0.00 0.00 175.35 174.96 2yuz s GLU 30 N -4.06 1.57 0.06 0.00 2.12 0.85 -1.67 118.70 117.56 2yuz s GLU 30 Ca 0.27 -1.11 0.01 0.00 0.36 0.00 0.00 54.97 54.51 2yuz s GLU 30 Cb 0.07 -1.79 -0.03 0.00 0.26 0.00 0.00 34.13 32.65 2yuz s GLU 30 CO 0.04 0.45 -0.06 0.96 -0.54 0.00 0.00 175.26 176.11 2yuz s ILE 31 N -0.87 0.48 -0.43 -3.70 -4.36 -0.99 -2.08 121.20 109.25 2yuz s ILE 31 Ca 0.10 -1.46 -0.02 0.00 -0.26 0.00 0.00 60.65 59.01 2yuz s ILE 31 Cb -0.10 -1.07 0.18 0.00 1.25 0.00 0.00 42.46 42.73 2yuz s ILE 31 CO 0.03 -0.66 2.33 -0.24 0.24 0.00 0.00 174.94 176.64 2yuz n SER 32 N 0.76 6.65 -3.52 4.36 2.88 -1.04 -4.76 113.62 118.94 2yuz n SER 32 Ca -0.18 -3.23 -0.13 0.00 -1.33 0.00 0.00 58.87 53.99 2yuz n SER 32 Cb 0.58 -1.12 -0.05 0.00 -0.75 0.00 0.00 64.21 62.87 2yuz n SER 32 CO 0.00 0.00 0.00 -0.70 -1.23 0.00 0.00 175.04 173.11 2yuz s GLU 33 N -2.08 0.90 -0.83 -1.46 2.56 -1.26 -4.52 118.70 112.01 2yuz s GLU 33 Ca 0.47 0.04 0.02 0.00 0.00 0.00 0.00 54.97 55.49 2yuz s GLU 33 Cb 0.34 0.42 0.32 0.00 2.00 0.00 0.00 34.13 37.21 2yuz s GLU 33 CO -0.11 -0.32 1.36 0.09 -0.56 0.00 0.00 175.26 175.72 2yuz n ASN 34 N 0.50 5.85 -4.24 -1.70 4.13 -1.26 -4.59 115.26 113.96 2yuz n ASN 34 Ca -0.14 -3.63 -0.24 0.00 1.68 0.00 0.00 54.58 52.24 2yuz n ASN 34 Cb 0.59 -0.91 -0.14 0.00 -1.54 0.00 0.00 39.78 37.78 2yuz n ASN 34 CO 0.00 0.00 0.00 0.27 0.28 0.00 0.00 177.26 177.81 2yuz s ILE 35 N -4.01 1.59 0.02 2.41 -5.25 -1.26 -5.09 121.20 109.62 2yuz s ILE 35 Ca 0.42 -1.26 -0.30 0.00 -0.99 0.00 0.00 60.65 58.52 2yuz s ILE 35 Cb 0.20 -1.41 -0.06 0.00 2.95 0.00 0.00 42.46 44.14 2yuz s ILE 35 CO -0.09 0.11 1.43 -2.16 -1.79 0.00 0.00 174.94 172.43 2yuz s PRO 36 N -1.36 4.28 0.52 0.37 0.04 -1.26 -4.91 135.00 132.69 2yuz s PRO 36 Ca 0.06 2.02 0.05 0.00 0.04 0.00 0.00 61.00 63.17 2yuz s PRO 36 Cb -0.09 -3.53 0.02 0.00 0.04 0.00 0.00 34.50 30.94 2yuz s PRO 36 CO 0.02 -0.57 0.30 0.20 0.04 0.00 0.00 177.00 176.99 2yuz s GLY 37 N 1.83 2.51 -0.01 0.56 0.00 -1.26 -2.99 107.32 107.97 2yuz s GLY 37 Ca 0.65 -1.13 0.02 0.00 0.00 0.00 0.00 44.72 44.25 2yuz s GLY 37 CO 0.28 -1.99 -0.05 0.54 0.00 0.00 0.00 173.10 171.88 2yuz s LYS 38 N -4.16 0.43 0.29 2.90 1.02 -0.70 -4.90 119.74 114.61 2yuz s LYS 38 Ca 0.28 -0.17 -0.05 0.00 0.02 0.00 0.00 55.97 56.05 2yuz s LYS 38 Cb -0.01 -0.42 -0.05 0.00 -0.52 0.00 0.00 37.83 36.83 2yuz s LYS 38 CO 0.17 0.10 0.56 -1.58 -0.92 0.00 0.00 175.35 173.68 2yuz s TRP 39 N -0.05 3.47 -0.01 3.18 0.52 -1.26 -1.39 118.94 123.41 2yuz s TRP 39 Ca 0.01 0.67 -0.01 0.00 0.02 0.00 0.00 56.10 56.79 2yuz s TRP 39 Cb -0.03 -2.12 0.01 0.00 -1.15 0.00 0.00 33.47 30.17 2yuz s TRP 39 CO -0.00 0.17 0.02 0.95 0.02 0.00 0.00 176.95 178.11 2yuz s THR 40 N -2.07 -0.01 0.02 2.01 -4.23 0.15 -2.57 115.64 108.93 2yuz s THR 40 Ca 0.44 0.03 0.05 0.00 -1.18 0.00 0.00 61.69 61.03 2yuz s THR 40 Cb -0.11 -0.04 -0.03 0.00 1.34 0.00 0.00 72.50 73.66 2yuz s THR 40 CO 0.29 0.01 -0.14 -0.75 -0.54 0.00 0.00 174.62 173.49 2yuz s LYS 41 N 0.14 2.28 -1.38 3.99 2.20 0.12 -0.67 119.74 126.41 2yuz s LYS 41 Ca -0.01 -0.87 -0.14 0.00 -0.36 0.00 0.00 55.97 54.59 2yuz s LYS 41 Cb -0.02 -2.31 0.14 0.00 -1.51 0.00 0.00 37.83 34.13 2yuz s LYS 41 CO -0.00 0.57 0.35 0.09 -0.36 0.00 0.00 175.35 175.99 2yuz n ASN 42 N 1.64 -0.88 -2.63 1.43 3.02 -0.78 0.22 115.26 117.27 2yuz n ASN 42 Ca -0.16 -0.96 -0.16 0.00 -0.03 0.00 0.00 54.58 53.27 2yuz n ASN 42 Cb 0.52 -1.22 0.06 0.00 -0.61 0.00 0.00 39.78 38.53 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 -1.24 -0.08 3.12 7.41 0.00 -1.26 -5.03 105.19 108.11 2yuz n GLY 43 Ca 0.01 -0.04 -0.11 0.00 0.00 0.00 0.00 46.02 45.87 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 -5.27 1.48 -0.29 0.99 1.43 0.60 -5.12 118.68 112.49 2yuz s LEU 44 Ca 0.33 -0.17 -0.29 0.00 -1.03 0.00 0.00 54.13 52.98 2yuz s LEU 44 Cb -0.15 0.74 -0.02 0.00 0.03 0.00 0.00 46.19 46.79 2yuz s LEU 44 CO 0.50 -0.37 1.66 -2.16 0.23 0.00 0.00 176.35 176.21 2yuz s PRO 45 N -1.35 3.58 0.19 1.29 0.04 -1.26 0.13 135.00 137.61 2yuz s PRO 45 Ca -0.14 1.47 -0.31 0.00 0.04 0.00 0.00 61.00 62.06 2yuz s PRO 45 Cb -0.07 -4.10 -0.10 0.00 0.04 0.00 0.00 34.50 30.27 2yuz s PRO 45 CO 0.02 -1.56 1.47 0.08 0.04 0.00 0.00 177.00 177.05 2yuz s VAL 46 N 5.92 2.80 -0.34 -0.36 1.01 -1.06 -4.89 120.40 123.47 2yuz s VAL 46 Ca 0.74 0.61 -0.17 0.00 0.00 0.00 0.00 61.98 63.16 2yuz s VAL 46 Cb -0.22 -3.39 -0.01 0.00 0.00 0.00 0.00 36.38 32.76 2yuz s VAL 46 CO 0.32 0.07 0.44 -1.58 0.00 0.00 0.00 175.10 174.35 2yuz s GLN 47 N 0.46 3.64 0.13 2.72 2.00 -1.26 -4.90 119.66 122.45 2yuz s GLN 47 Ca 0.64 -0.23 -0.31 0.00 -2.00 0.00 0.00 55.36 53.45 2yuz s GLN 47 Cb -0.41 -3.79 -0.09 0.00 0.80 0.00 0.00 33.01 29.52 2yuz s GLN 47 CO 0.36 -0.56 1.47 -1.21 -0.50 0.00 0.00 175.29 174.85 2yuz s GLU 48 N 2.22 4.27 0.30 1.67 2.02 -1.26 -4.88 118.70 123.04 2yuz s GLU 48 Ca 0.16 2.20 0.02 0.00 0.02 0.00 0.00 54.97 57.37 2yuz s GLU 48 Cb -0.16 -3.23 -0.01 0.00 0.10 0.00 0.00 34.13 30.84 2yuz s GLU 48 CO 0.12 -0.52 0.35 0.43 0.02 0.00 0.00 175.26 175.66 2yuz n SER 49 N 4.05 -0.94 -0.36 -0.19 7.64 -0.92 -4.97 113.62 117.92 2yuz n SER 49 Ca 0.13 -2.78 0.04 0.00 1.01 0.00 0.00 58.87 57.26 2yuz n SER 49 Cb 0.41 1.90 0.20 0.00 -1.01 0.00 0.00 64.21 65.70 2yuz n SER 49 CO 0.00 0.00 0.00 -2.24 -3.01 0.00 0.00 175.04 169.79 2yuz h ASP 50 N 1.76 1.01 1.67 6.43 2.03 -2.03 0.23 116.42 127.52 2yuz h ASP 50 Ca -0.22 0.02 0.00 0.00 -0.73 0.00 0.00 57.03 56.09 2yuz h ASP 50 Cb 1.05 -0.19 0.00 0.00 -0.83 0.00 0.00 39.33 39.36 2yuz h ASP 50 CO 0.31 0.62 0.00 0.08 -1.03 0.00 0.00 179.24 179.22 2yuz h ARG 51 N 1.13 0.00 -3.57 4.15 0.11 -1.97 -3.39 114.38 110.83 2yuz h ARG 51 Ca 0.45 0.00 -0.64 0.00 0.10 0.00 0.00 59.98 59.89 2yuz h ARG 51 Cb 0.25 0.00 -0.41 0.00 1.11 0.00 0.00 29.97 30.92 2yuz h ARG 51 CO -0.19 0.00 -0.65 -1.17 0.10 0.00 0.00 179.97 178.06 2yuz s LEU 52 N -5.36 4.36 -0.29 0.08 0.20 0.07 -2.31 118.68 115.43 2yuz s LEU 52 Ca 0.08 -2.88 -0.11 0.00 0.69 0.00 0.00 54.13 51.91 2yuz s LEU 52 Cb 0.09 -1.63 -0.04 0.00 -0.43 0.00 0.00 46.19 44.17 2yuz s LEU 52 CO 0.62 -0.25 0.19 -0.75 -0.29 0.00 0.00 176.35 175.87 2yuz s LYS 53 N -0.11 3.87 -0.49 1.98 2.47 -1.24 -2.16 119.74 124.07 2yuz s LYS 53 Ca 0.16 -0.37 -0.16 0.00 -1.56 0.00 0.00 55.97 54.04 2yuz s LYS 53 Cb -0.25 -3.67 0.08 0.00 -1.46 0.00 0.00 37.83 32.53 2yuz s LYS 53 CO -0.01 -0.22 0.44 0.08 0.16 0.00 0.00 175.35 175.80 2yuz s VAL 54 N 1.75 5.18 -0.07 4.02 1.01 -1.26 -3.94 120.40 127.08 2yuz s VAL 54 Ca 0.07 -1.02 -0.10 0.00 0.00 0.00 0.00 61.98 60.92 2yuz s VAL 54 Cb -0.16 -4.18 -0.05 0.00 0.00 0.00 0.00 36.38 31.99 2yuz s VAL 54 CO 0.11 -0.65 0.25 -0.69 0.00 0.00 0.00 175.10 174.12 2yuz s VAL 55 N 1.79 5.31 -0.06 2.92 1.01 -0.44 -5.00 120.40 125.93 2yuz s VAL 55 Ca 0.06 0.48 0.03 0.00 0.00 0.00 0.00 61.98 62.54 2yuz s VAL 55 Cb -0.24 -3.53 0.01 0.00 0.00 0.00 0.00 36.38 32.61 2yuz s VAL 55 CO 0.07 0.60 -0.15 -1.58 0.00 0.00 0.00 175.10 174.04 2yuz s GLN 56 N -1.00 1.80 -0.34 2.72 0.74 -1.26 -0.57 119.66 121.74 2yuz s GLN 56 Ca 0.19 -0.51 0.02 0.00 0.05 0.00 0.00 55.36 55.10 2yuz s GLN 56 Cb -0.14 -1.50 0.10 0.00 1.10 0.00 0.00 33.01 32.58 2yuz s GLN 56 CO 0.08 0.12 0.10 0.15 -0.55 0.00 0.00 175.29 175.18 2yuz s LYS 57 N 0.39 1.11 2.82 1.67 1.02 0.54 -5.01 119.74 122.28 2yuz s LYS 57 Ca -0.10 -1.53 0.00 0.00 0.02 0.00 0.00 55.97 54.35 2yuz s LYS 57 Cb -0.14 -2.55 0.00 0.00 -0.52 0.00 0.00 37.83 34.62 2yuz s LYS 57 CO 0.03 -0.99 0.00 0.41 -0.92 0.00 0.00 175.35 173.89 2yuz n GLY 58 N 4.44 1.13 2.61 -3.33 0.00 -1.26 -0.81 105.19 107.97 2yuz n GLY 58 Ca 0.02 0.59 -0.35 0.00 0.00 0.00 0.00 46.02 46.28 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 2.93 -3.66 1.61 1.74 -1.26 -4.70 116.66 113.32 2yuz n ARG 59 Ca 0.00 -3.70 -0.07 0.00 -0.77 0.00 0.00 57.85 53.32 2yuz n ARG 59 Cb 0.00 -2.27 -0.08 0.00 -1.02 0.00 0.00 32.46 29.09 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 -5.05 -0.47 -0.24 0.55 1.01 0.01 -2.34 121.20 114.67 2yuz s ILE 60 Ca 0.55 0.08 -0.08 0.00 0.00 0.00 0.00 60.65 61.19 2yuz s ILE 60 Cb 0.45 -0.80 -0.04 0.00 0.01 0.00 0.00 42.46 42.08 2yuz s ILE 60 CO -0.23 0.03 0.10 -1.00 0.00 0.00 0.00 174.94 173.84 2yuz s HIS 61 N 2.22 3.17 -0.06 3.97 3.76 -0.67 -0.34 115.29 127.35 2yuz s HIS 61 Ca -0.06 -0.12 0.05 0.00 -0.15 0.00 0.00 55.06 54.78 2yuz s HIS 61 Cb -0.10 -2.22 -0.02 0.00 1.11 0.00 0.00 32.58 31.35 2yuz s HIS 61 CO -0.16 -0.14 -0.20 0.21 -0.85 0.00 0.00 174.74 173.60 2yuz s LYS 62 N 1.25 2.54 -0.11 1.40 2.20 0.26 -1.64 119.74 125.64 2yuz s LYS 62 Ca 0.05 -0.81 -0.04 0.00 -0.36 0.00 0.00 55.97 54.81 2yuz s LYS 62 Cb -0.14 -2.27 0.06 0.00 -1.51 0.00 0.00 37.83 33.97 2yuz s LYS 62 CO 0.04 0.48 0.22 -1.17 -0.36 0.00 0.00 175.35 174.57 2yuz s LEU 63 N -0.40 -0.15 -0.03 5.43 0.20 0.79 -1.33 118.68 123.20 2yuz s LEU 63 Ca 0.04 0.48 0.02 0.00 0.69 0.00 0.00 54.13 55.36 2yuz s LEU 63 Cb -0.12 0.53 0.01 0.00 -0.43 0.00 0.00 46.19 46.17 2yuz s LEU 63 CO 0.02 -0.24 -0.09 0.68 -0.29 0.00 0.00 176.35 176.44 2yuz s VAL 64 N 2.28 0.78 0.15 1.68 -7.23 -1.25 -1.84 120.40 114.96 2yuz s VAL 64 Ca 0.01 -0.34 -0.11 0.00 -1.81 0.00 0.00 61.98 59.73 2yuz s VAL 64 Cb -0.12 -0.71 -0.07 0.00 0.56 0.00 0.00 36.38 36.05 2yuz s VAL 64 CO -0.07 0.25 0.50 -0.63 -0.31 0.00 0.00 175.10 174.84 2yuz s ILE 65 N 0.33 4.96 0.08 -0.62 1.01 -1.00 -4.12 121.20 121.83 2yuz s ILE 65 Ca -0.05 0.59 -0.16 0.00 0.00 0.00 0.00 60.65 61.03 2yuz s ILE 65 Cb -0.10 -3.67 -0.13 0.00 0.01 0.00 0.00 42.46 38.56 2yuz s ILE 65 CO 0.01 0.17 1.33 0.00 0.00 0.00 0.00 174.94 176.44 2yuz h ALA 66 N 3.31 0.32 -3.27 9.38 0.00 -1.78 -3.12 119.26 124.08 2yuz h ALA 66 Ca -0.48 -0.48 -0.50 0.00 0.00 0.00 0.00 54.91 53.45 2yuz h ALA 66 Cb 1.19 -0.05 -0.39 0.00 0.00 0.00 0.00 17.79 18.54 2yuz h ALA 66 CO 0.67 0.46 -0.77 -0.80 0.00 0.00 0.00 179.25 178.82 2yuz s ASN 67 N -6.69 2.61 -1.04 0.00 -0.87 -1.26 -4.39 114.94 103.30 2yuz s ASN 67 Ca -0.12 -0.64 -0.24 0.00 -1.57 0.00 0.00 52.86 50.29 2yuz s ASN 67 Cb 0.08 -0.60 -0.09 0.00 -0.02 0.00 0.00 41.25 40.62 2yuz s ASN 67 CO 0.84 -0.27 1.99 0.00 -2.57 0.00 0.00 177.10 177.09 2yuz s ALA 68 N 1.86 1.56 0.44 0.60 0.00 -0.75 -4.73 121.76 120.73 2yuz s ALA 68 Ca 0.01 -1.75 -0.19 0.00 0.00 0.00 0.00 51.96 50.02 2yuz s ALA 68 Cb -0.16 -4.63 -0.10 0.00 0.00 0.00 0.00 23.12 18.24 2yuz s ALA 68 CO -0.07 -5.26 0.93 -0.51 0.00 0.00 0.00 175.76 170.85 2yuz s LEU 69 N 11.43 3.87 0.43 0.00 1.43 -1.26 -1.67 118.68 132.91 2yuz s LEU 69 Ca 0.72 1.60 0.29 0.00 -1.03 0.00 0.00 54.13 55.71 2yuz s LEU 69 Cb -0.04 -4.47 1.40 0.00 0.03 0.00 0.00 46.19 43.11 2yuz s LEU 69 CO 0.08 -0.41 1.63 0.71 0.23 0.00 0.00 176.35 178.59 2yuz h THR 70 N 1.63 0.13 -0.87 5.49 1.35 -1.98 0.68 112.91 119.35 2yuz h THR 70 Ca -0.48 -0.03 0.15 0.00 -0.55 0.00 0.00 66.41 65.50 2yuz h THR 70 Cb 1.18 0.03 -0.10 0.00 -1.73 0.00 0.00 68.15 67.53 2yuz h THR 70 CO 0.62 0.02 0.45 -0.33 -0.25 0.00 0.00 175.52 176.03 2yuz h GLU 71 N 0.10 0.61 -0.71 4.72 5.08 -1.98 0.22 114.58 122.61 2yuz h GLU 71 Ca 0.81 -0.04 0.21 0.00 -1.00 0.00 0.00 59.36 59.34 2yuz h GLU 71 Cb 2.51 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 31.59 2yuz h GLU 71 CO -0.44 0.40 0.61 0.22 -1.00 0.00 0.00 179.01 178.81 2yuz h ASP 72 N 0.63 0.00 -2.56 1.42 3.58 0.04 -3.39 116.42 116.13 2yuz h ASP 72 Ca 0.48 0.00 -0.57 0.00 0.42 0.00 0.00 57.03 57.36 2yuz h ASP 72 Cb 0.69 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.72 2yuz h ASP 72 CO -0.37 0.00 1.26 -0.70 -2.88 0.00 0.00 179.24 176.55 2yuz s GLU 73 N -4.78 3.53 0.00 0.28 2.12 0.76 -4.55 118.70 116.06 2yuz s GLU 73 Ca -0.05 1.71 0.00 0.00 0.36 0.00 0.00 54.97 57.00 2yuz s GLU 73 Cb 0.18 -4.17 0.00 0.00 0.26 0.00 0.00 34.13 30.41 2yuz s GLU 73 CO 0.66 -1.63 0.00 0.41 -0.54 0.00 0.00 175.26 174.16 2yuz n GLY 74 N 5.15 -0.84 3.34 -1.50 0.00 -1.25 -5.02 105.19 105.06 2yuz n GLY 74 Ca 0.22 0.48 -0.14 0.00 0.00 0.00 0.00 46.02 46.58 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 -0.42 -0.00 1.61 1.01 -1.26 -3.57 116.67 110.03 2yuz s ASP 75 Ca 0.00 0.67 0.08 0.00 0.71 0.00 0.00 52.55 54.00 2yuz s ASP 75 Cb 0.00 0.72 -0.02 0.00 1.01 0.00 0.00 42.92 44.62 2yuz s ASP 75 CO 0.00 -0.29 -0.24 -0.31 0.21 0.00 0.00 175.17 174.54 2yuz s TYR 76 N -0.35 2.17 -0.05 4.23 1.51 0.14 -1.86 117.35 123.14 2yuz s TYR 76 Ca -0.05 -0.41 -0.02 0.00 -1.01 0.00 0.00 57.07 55.58 2yuz s TYR 76 Cb -0.03 -1.37 0.03 0.00 -0.11 0.00 0.00 41.96 40.48 2yuz s TYR 76 CO 0.03 -0.00 0.12 0.08 -1.11 0.00 0.00 175.55 174.66 2yuz s VAL 77 N -0.62 -0.04 -0.15 0.71 1.01 0.15 -0.25 120.40 121.21 2yuz s VAL 77 Ca 0.10 0.16 -0.03 0.00 0.00 0.00 0.00 61.98 62.20 2yuz s VAL 77 Cb -0.09 -0.19 -0.03 0.00 0.00 0.00 0.00 36.38 36.06 2yuz s VAL 77 CO -0.00 0.06 -0.03 0.12 0.00 0.00 0.00 175.10 175.25 2yuz s PHE 78 N 0.97 3.03 -0.07 5.22 5.36 -1.18 0.29 117.98 131.60 2yuz s PHE 78 Ca -0.08 -0.24 0.01 0.00 -0.96 0.00 0.00 56.93 55.66 2yuz s PHE 78 Cb -0.10 -1.94 0.02 0.00 -0.34 0.00 0.00 43.02 40.66 2yuz s PHE 78 CO -0.04 0.02 -0.08 0.00 -1.46 0.00 0.00 175.22 173.65 2yuz s ALA 79 N 0.23 1.10 0.57 11.12 0.00 -0.48 -2.28 121.76 132.01 2yuz s ALA 79 Ca -0.02 -0.35 -0.19 0.00 0.00 0.00 0.00 51.96 51.41 2yuz s ALA 79 Cb -0.14 -0.64 -0.05 0.00 0.00 0.00 0.00 23.12 22.30 2yuz s ALA 79 CO 0.03 -0.09 1.13 -1.25 0.00 0.00 0.00 175.76 175.57 2yuz s PRO 80 N 1.09 3.25 -0.04 0.00 0.04 -1.26 -1.72 135.00 136.36 2yuz s PRO 80 Ca -0.07 1.57 0.07 0.00 0.04 0.00 0.00 61.00 62.61 2yuz s PRO 80 Cb -0.14 -1.99 0.27 0.00 0.04 0.00 0.00 34.50 32.67 2yuz s PRO 80 CO -0.01 -0.93 1.11 -3.47 0.04 0.00 0.00 177.00 173.74 2yuz n ASP 81 N -1.52 2.03 0.00 6.66 2.03 -1.16 -3.72 116.55 120.86 2yuz n ASP 81 Ca 0.11 -2.14 0.00 0.00 0.52 0.00 0.00 54.79 53.28 2yuz n ASP 81 Cb 0.51 -0.34 0.00 0.00 -0.72 0.00 0.00 41.12 40.57 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 0.28 1.67 -4.53 -1.67 0.00 -1.26 -5.06 120.51 109.94 2yuz n ALA 82 Ca 0.10 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.27 2yuz n ALA 82 Cb 0.39 0.16 -0.06 0.00 0.00 0.00 0.00 19.45 19.94 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 -1.50 0.56 -1.78 0.00 4.02 -1.24 -5.06 117.16 112.17 2yuz n TYR 83 Ca 0.00 -2.33 -0.29 0.00 -0.01 0.00 0.00 57.90 55.26 2yuz n TYR 83 Cb 0.32 -0.14 0.04 0.00 -0.02 0.00 0.00 39.34 39.54 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 -1.43 6.16 -4.88 7.72 4.13 -1.26 -4.32 115.26 121.38 2yuz n ASN 84 Ca -0.12 -3.77 -0.30 0.00 1.68 0.00 0.00 54.58 52.08 2yuz n ASN 84 Cb 0.57 -0.64 -0.02 0.00 -1.54 0.00 0.00 39.78 38.14 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 -4.78 4.81 -0.12 2.41 1.01 -1.26 -5.03 120.40 117.44 2yuz s VAL 85 Ca 0.56 0.54 -0.05 0.00 0.00 0.00 0.00 61.98 63.02 2yuz s VAL 85 Cb 0.45 -3.76 0.06 0.00 0.00 0.00 0.00 36.38 33.12 2yuz s VAL 85 CO -0.02 -0.60 0.27 0.42 0.00 0.00 0.00 175.10 175.17 2yuz s THR 86 N -2.46 -0.19 -0.41 3.92 -4.23 -1.25 -4.06 115.64 106.95 2yuz s THR 86 Ca 0.50 0.19 -0.07 0.00 -1.18 0.00 0.00 61.69 61.14 2yuz s THR 86 Cb -0.10 -0.43 0.09 0.00 1.34 0.00 0.00 72.50 73.39 2yuz s THR 86 CO 0.35 0.08 0.23 -0.76 -0.54 0.00 0.00 174.62 173.97 2yuz s LEU 87 N 1.73 5.10 0.24 4.79 1.02 -0.97 -4.91 118.68 125.68 2yuz s LEU 87 Ca -0.05 -1.66 -0.30 0.00 0.02 0.00 0.00 54.13 52.14 2yuz s LEU 87 Cb -0.11 -1.92 -0.09 0.00 0.02 0.00 0.00 46.19 44.09 2yuz s LEU 87 CO -0.09 -0.53 1.28 -2.16 0.02 0.00 0.00 176.35 174.87 2yuz s PRO 88 N 1.33 4.42 -0.04 1.29 0.04 -1.26 -3.12 135.00 137.66 2yuz s PRO 88 Ca 0.04 2.05 -0.01 0.00 0.04 0.00 0.00 61.00 63.11 2yuz s PRO 88 Cb -0.23 -3.17 0.03 0.00 0.04 0.00 0.00 34.50 31.17 2yuz s PRO 88 CO -0.00 -0.17 0.08 0.00 0.04 0.00 0.00 177.00 176.95 2yuz s ALA 89 N -0.32 -0.09 -0.08 8.56 0.00 0.65 -4.75 121.76 125.73 2yuz s ALA 89 Ca 0.53 0.45 -0.12 0.00 0.00 0.00 0.00 51.96 52.83 2yuz s ALA 89 Cb -0.36 -0.32 -0.05 0.00 0.00 0.00 0.00 23.12 22.38 2yuz s ALA 89 CO 0.42 -0.12 0.28 0.15 0.00 0.00 0.00 175.76 176.49 2yuz s LYS 90 N 1.03 3.83 0.13 0.00 3.01 -1.26 -0.68 119.74 125.79 2yuz s LYS 90 Ca -0.08 0.14 0.06 0.00 -1.01 0.00 0.00 55.97 55.08 2yuz s LYS 90 Cb -0.11 -3.26 -0.04 0.00 -1.01 0.00 0.00 37.83 33.41 2yuz s LYS 90 CO -0.04 0.61 -0.15 0.14 0.51 0.00 0.00 175.35 176.43 2yuz s VAL 91 N -0.69 1.39 -0.22 3.17 -7.23 -1.23 -2.76 120.40 112.84 2yuz s VAL 91 Ca 0.19 -1.74 -0.14 0.00 -1.81 0.00 0.00 61.98 58.48 2yuz s VAL 91 Cb -0.14 -1.57 0.06 0.00 0.56 0.00 0.00 36.38 35.30 2yuz s VAL 91 CO 0.08 -0.40 0.54 -2.28 -0.31 0.00 0.00 175.10 172.73 2yuz s HIS 92 N -2.11 -0.77 -0.05 2.82 2.46 -1.22 -3.82 115.29 112.60 2yuz s HIS 92 Ca 0.10 1.63 -0.00 0.00 0.47 0.00 0.00 55.06 57.25 2yuz s HIS 92 Cb -0.05 0.38 -0.03 0.00 -0.13 0.00 0.00 32.58 32.74 2yuz s HIS 92 CO 0.03 -0.39 0.01 0.54 -2.47 0.00 0.00 174.74 172.46 2yuz s VAL 93 N 1.20 4.28 0.06 0.89 0.11 -1.26 -2.81 120.40 122.87 2yuz s VAL 93 Ca -0.07 -0.40 -0.27 0.00 -2.93 0.00 0.00 61.98 58.31 2yuz s VAL 93 Cb -0.06 -2.85 -0.05 0.00 -1.53 0.00 0.00 36.38 31.88 2yuz s VAL 93 CO -0.12 0.50 0.85 -0.63 -3.33 0.00 0.00 175.10 172.37 2yuz s ILE 94 N -0.99 4.68 -0.09 7.04 -1.09 -1.15 -4.94 121.20 124.66 2yuz s ILE 94 Ca 0.16 1.81 -0.00 0.00 -2.23 0.00 0.00 60.65 60.39 2yuz s ILE 94 Cb -0.11 -4.20 0.02 0.00 -1.58 0.00 0.00 42.46 36.59 2yuz s ILE 94 CO 0.06 0.32 -0.07 -0.94 -1.23 0.00 0.00 174.94 173.09 2yuz s SER 95 N 0.09 1.91 -0.32 3.58 1.04 -1.26 -3.49 113.70 115.25 2yuz s SER 95 Ca 0.43 -0.25 -0.10 0.00 0.48 0.00 0.00 55.95 56.51 2yuz s SER 95 Cb -0.21 -0.73 0.19 0.00 0.10 0.00 0.00 66.02 65.36 2yuz s SER 95 CO 0.26 -0.11 1.05 -0.83 0.98 0.00 0.00 173.24 174.59 2yuz s GLY 96 N 1.54 -1.46 0.20 7.32 0.00 -1.26 -5.01 107.32 108.65 2yuz s GLY 96 Ca 0.01 1.39 0.21 0.00 0.00 0.00 0.00 44.72 46.34 2yuz s GLY 96 CO -0.05 4.28 1.65 -1.55 0.00 0.00 0.00 173.10 177.43 2yuz n PRO 97 N 3.89 0.15 -2.20 2.90 -0.04 -1.26 -4.74 135.00 133.69 2yuz n PRO 97 Ca 0.06 0.38 -0.42 0.00 -0.04 0.00 0.00 63.50 63.48 2yuz n PRO 97 Cb 0.63 -1.78 -0.03 0.00 -0.04 0.00 0.00 33.50 32.27 2yuz n PRO 97 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2yuz s SER 98 N -3.95 6.84 0.79 3.54 0.01 -1.26 -5.00 113.70 114.68 2yuz s SER 98 Ca 0.05 2.19 -0.10 0.00 1.31 0.00 0.00 55.95 59.39 2yuz s SER 98 Cb 0.09 -2.57 0.07 0.00 0.21 0.00 0.00 66.02 63.82 2yuz s SER 98 CO 0.36 -0.70 1.10 -0.44 0.41 0.00 0.00 173.24 173.97 2yuz s SER 99 N 1.67 4.32 0.00 2.44 0.01 -1.26 -5.24 113.70 115.64 2yuz s SER 99 Ca 0.64 1.85 0.30 0.00 1.31 0.00 0.00 55.95 60.06 2yuz s SER 99 Cb -0.33 -2.52 1.47 0.00 0.21 0.00 0.00 66.02 64.85 2yuz s SER 99 CO 0.28 -2.16 1.98 0.61 0.41 0.00 0.00 173.24 174.36