#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kyb h LYS 2 N 0.00 0.00 -5.00 0.03 1.57 -1.98 -3.43 116.57 107.75 2kyb h LYS 2 Ca 0.00 0.00 -0.34 0.00 -1.87 0.00 0.00 60.65 58.44 2kyb h LYS 2 Cb 0.00 0.00 -0.19 0.00 0.08 0.00 0.00 32.23 32.12 2kyb h LYS 2 CO 0.00 0.01 -0.74 0.95 -0.57 0.00 0.00 179.45 179.09 2kyb s THR 3 N -3.87 0.94 0.07 -0.16 -4.23 -1.26 -1.83 115.64 105.29 2kyb s THR 3 Ca -0.01 -1.50 -0.02 0.00 -1.18 0.00 0.00 61.69 58.98 2kyb s THR 3 Cb 0.11 -1.21 -0.04 0.00 1.34 0.00 0.00 72.50 72.70 2kyb s THR 3 CO 0.50 -0.46 0.00 -0.83 -0.54 0.00 0.00 174.62 173.29 2kyb s GLY 4 N -2.19 0.51 -0.12 3.99 0.00 -1.17 -5.02 107.32 103.32 2kyb s GLY 4 Ca 0.02 -1.19 -0.04 0.00 0.00 0.00 0.00 44.72 43.51 2kyb s GLY 4 CO 0.01 -1.27 0.02 -0.26 0.00 0.00 0.00 173.10 171.59 2kyb s ILE 5 N -3.93 4.44 -0.28 0.90 -4.36 -1.26 -3.62 121.20 113.09 2kyb s ILE 5 Ca 0.09 -0.18 -0.33 0.00 -0.26 0.00 0.00 60.65 59.97 2kyb s ILE 5 Cb 0.08 -2.92 -0.10 0.00 1.25 0.00 0.00 42.46 40.77 2kyb s ILE 5 CO -0.08 0.55 2.14 0.52 0.24 0.00 0.00 174.94 178.31 2kyb n VAL 6 N 2.68 0.28 -1.50 8.37 0.31 -1.17 -4.75 118.33 122.57 2kyb n VAL 6 Ca -0.18 -0.28 -0.13 0.00 -0.01 0.00 0.00 64.34 63.74 2kyb n VAL 6 Cb 0.53 -1.90 -0.10 0.00 -0.91 0.00 0.00 33.84 31.47 2kyb n VAL 6 CO 0.00 0.00 0.00 0.59 -1.32 0.00 0.00 176.83 176.10 2kyb n ASN 7 N 9.76 0.88 0.00 4.52 5.03 -1.26 -4.05 115.26 130.13 2kyb n ASN 7 Ca 0.35 -1.96 0.00 0.00 0.87 0.00 0.00 54.58 53.84 2kyb n ASN 7 Cb 0.29 -1.51 0.00 0.00 -1.02 0.00 0.00 39.78 37.54 2kyb n ASN 7 CO 0.00 0.00 0.00 0.52 -1.83 0.00 0.00 177.26 175.95 2kyb n VAL 8 N 8.26 0.00 -1.74 2.41 0.31 -1.26 -4.96 118.33 121.35 2kyb n VAL 8 Ca 0.39 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.72 2kyb n VAL 8 Cb 0.44 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.37 2kyb n VAL 8 CO 0.00 0.00 0.00 -1.20 -1.32 0.00 0.00 176.83 174.31 2kyb n SER 9 N 3.35 -8.47 0.12 4.52 7.64 -1.26 -4.65 113.62 114.87 2kyb n SER 9 Ca 0.00 1.27 -0.08 0.00 1.01 0.00 0.00 58.87 61.07 2kyb n SER 9 Cb 0.00 -4.94 -0.04 0.00 -1.01 0.00 0.00 64.21 58.22 2kyb n SER 9 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2kyb h SER 10 N 2.16 -0.62 -5.05 6.43 0.02 -1.96 -3.40 113.55 111.13 2kyb h SER 10 Ca 0.00 0.05 -0.10 0.00 -0.84 0.00 0.00 61.79 60.90 2kyb h SER 10 Cb 0.00 0.21 -0.17 0.00 0.14 0.00 0.00 62.40 62.57 2kyb h SER 10 CO 0.00 -0.28 -0.30 -0.44 -1.14 0.00 0.00 176.83 174.66 2kyb s SER 11 N -3.19 -0.07 -0.06 3.07 0.01 -1.26 -3.40 113.70 108.80 2kyb s SER 11 Ca -0.08 -0.24 -0.04 0.00 1.31 0.00 0.00 55.95 56.91 2kyb s SER 11 Cb 0.02 0.33 -0.04 0.00 0.21 0.00 0.00 66.02 66.54 2kyb s SER 11 CO 0.26 -0.58 0.11 -0.76 0.41 0.00 0.00 173.24 172.68 2kyb s LEU 12 N -2.02 4.13 -0.70 2.44 2.01 -1.24 -4.96 118.68 118.35 2kyb s LEU 12 Ca -0.06 0.31 -0.24 0.00 0.01 0.00 0.00 54.13 54.15 2kyb s LEU 12 Cb -0.01 -2.20 0.06 0.00 0.01 0.00 0.00 46.19 44.05 2kyb s LEU 12 CO -0.03 0.34 1.09 0.54 1.01 0.00 0.00 176.35 179.30 2kyb s ASN 13 N -1.38 6.19 0.12 2.29 2.20 -1.26 -3.51 114.94 119.59 2kyb s ASN 13 Ca 0.19 -0.84 -0.29 0.00 -0.94 0.00 0.00 52.86 50.98 2kyb s ASN 13 Cb -0.12 -2.47 -0.06 0.00 -2.00 0.00 0.00 41.25 36.60 2kyb s ASN 13 CO 0.09 -1.57 0.93 0.68 -2.94 0.00 0.00 177.10 174.29 2kyb s VAL 14 N 4.62 4.46 0.35 3.54 -7.23 -1.26 -4.82 120.40 120.07 2kyb s VAL 14 Ca 0.27 2.01 0.01 0.00 -1.81 0.00 0.00 61.98 62.46 2kyb s VAL 14 Cb -0.13 -4.30 0.01 0.00 0.56 0.00 0.00 36.38 32.52 2kyb s VAL 14 CO 0.11 0.35 0.06 0.54 -0.31 0.00 0.00 175.10 175.85 2kyb n ARG 15 N 2.58 1.12 0.10 4.82 1.74 -1.15 -2.58 116.66 123.29 2kyb n ARG 15 Ca 0.01 -2.46 0.10 0.00 -0.77 0.00 0.00 57.85 54.73 2kyb n ARG 15 Cb 0.49 0.58 -0.01 0.00 -1.02 0.00 0.00 32.46 32.50 2kyb n ARG 15 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 2kyb h SER 16 N 0.74 0.00 -0.82 0.55 4.64 -1.85 -2.79 113.55 114.01 2kyb h SER 16 Ca -0.27 0.00 0.11 0.00 -0.47 0.00 0.00 61.79 61.15 2kyb h SER 16 Cb 0.86 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.93 2kyb h SER 16 CO 0.45 0.06 0.28 -1.54 -0.87 0.00 0.00 176.83 175.21 2kyb n SER 17 N -2.71 -0.40 -0.36 4.97 3.41 -1.26 -4.84 113.62 112.44 2kyb n SER 17 Ca -0.01 -1.09 0.00 0.00 -0.26 0.00 0.00 58.87 57.51 2kyb n SER 17 Cb 0.58 0.62 0.00 0.00 -0.26 0.00 0.00 64.21 65.15 2kyb n SER 17 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2kyb n ALA 18 N -2.34 1.26 -3.34 7.33 0.00 -1.26 -4.43 120.51 117.72 2kyb n ALA 18 Ca -0.04 0.00 -0.46 0.00 0.00 0.00 0.00 53.44 52.95 2kyb n ALA 18 Cb 0.18 -1.00 -0.05 0.00 0.00 0.00 0.00 19.45 18.59 2kyb n ALA 18 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2kyb s SER 19 N -1.19 6.24 0.00 0.00 0.01 -1.26 -4.90 113.70 112.61 2kyb s SER 19 Ca 0.00 -2.00 0.07 0.00 1.31 0.00 0.00 55.95 55.32 2kyb s SER 19 Cb 0.00 -2.18 0.35 0.00 0.21 0.00 0.00 66.02 64.40 2kyb s SER 19 CO 0.00 -0.78 1.02 0.41 0.41 0.00 0.00 173.24 174.30 2kyb n THR 20 N 4.93 0.67 1.07 1.44 -1.04 -1.26 -0.73 114.28 119.35 2kyb n THR 20 Ca -0.07 0.17 0.12 0.00 -2.04 0.00 0.00 64.05 62.22 2kyb n THR 20 Cb 0.41 -1.06 0.11 0.00 -1.82 0.00 0.00 70.33 67.97 2kyb n THR 20 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 2kyb n SER 21 N -1.21 2.05 0.00 8.00 3.41 -1.26 -4.07 113.62 120.53 2kyb n SER 21 Ca 0.04 -1.52 0.13 0.00 -0.26 0.00 0.00 58.87 57.25 2kyb n SER 21 Cb 0.05 0.30 0.68 0.00 -0.26 0.00 0.00 64.21 64.98 2kyb n SER 21 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2kyb n SER 22 N 0.18 0.00 -0.23 4.04 3.41 0.09 -5.00 113.62 116.11 2kyb n SER 22 Ca 0.11 -0.19 0.00 0.00 -0.26 0.00 0.00 58.87 58.53 2kyb n SER 22 Cb 0.47 -0.25 0.00 0.00 -0.26 0.00 0.00 64.21 64.17 2kyb n SER 22 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 2kyb n LYS 23 N -1.25 0.00 -3.41 4.33 4.81 -1.26 -4.75 118.16 116.64 2kyb n LYS 23 Ca 0.14 0.00 -0.25 0.00 -0.87 0.00 0.00 58.31 57.32 2kyb n LYS 23 Cb 0.19 0.00 -0.02 0.00 0.02 0.00 0.00 35.03 35.23 2kyb n LYS 23 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 2kyb s VAL 24 N 0.00 5.10 0.00 3.15 1.01 -1.26 -4.48 120.40 123.92 2kyb s VAL 24 Ca 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 61.98 61.64 2kyb s VAL 24 Cb 0.00 -3.82 0.00 0.00 0.00 0.00 0.00 36.38 32.56 2kyb s VAL 24 CO 0.00 -0.46 0.00 2.30 0.00 0.00 0.00 175.10 176.94 2kyb n ILE 25 N -1.46 0.00 -1.47 2.22 -5.35 -1.06 -5.00 119.36 107.24 2kyb n ILE 25 Ca -0.04 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.44 2kyb n ILE 25 Cb 0.55 0.05 0.00 0.00 -1.74 0.00 0.00 39.64 38.50 2kyb n ILE 25 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2kyb n GLY 26 N 0.32 3.40 3.51 3.28 0.00 -1.26 -5.10 105.19 109.35 2kyb n GLY 26 Ca 0.00 -0.63 -0.17 0.00 0.00 0.00 0.00 46.02 45.22 2kyb n GLY 26 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2kyb s SER 27 N 1.92 -0.64 0.18 1.61 1.04 -1.26 -4.44 113.70 112.12 2kyb s SER 27 Ca 0.00 0.77 0.10 0.00 0.48 0.00 0.00 55.95 57.30 2kyb s SER 27 Cb 0.00 0.64 -0.04 0.00 0.10 0.00 0.00 66.02 66.72 2kyb s SER 27 CO 0.00 -0.55 -0.21 -0.22 0.98 0.00 0.00 173.24 173.24 2kyb s LEU 28 N -0.99 2.43 0.25 2.42 2.96 -1.23 -5.01 118.68 119.51 2kyb s LEU 28 Ca -0.10 -0.86 0.06 0.00 -0.22 0.00 0.00 54.13 53.02 2kyb s LEU 28 Cb -0.01 -1.02 -0.03 0.00 0.50 0.00 0.00 46.19 45.63 2kyb s LEU 28 CO 0.08 0.05 0.27 -0.94 -1.32 0.00 0.00 176.35 174.49 2kyb s SER 29 N -2.63 5.87 0.78 3.68 1.04 -1.26 -3.59 113.70 117.58 2kyb s SER 29 Ca 0.18 -0.11 -0.12 0.00 0.48 0.00 0.00 55.95 56.38 2kyb s SER 29 Cb -0.07 -1.60 0.06 0.00 0.10 0.00 0.00 66.02 64.51 2kyb s SER 29 CO 0.08 -0.05 1.15 -0.83 0.98 0.00 0.00 173.24 174.57 2kyb s GLY 30 N -3.89 1.60 -1.79 7.32 0.00 -1.22 -3.78 107.32 105.56 2kyb s GLY 30 Ca 0.33 -0.53 0.00 0.00 0.00 0.00 0.00 44.72 44.52 2kyb s GLY 30 CO 0.27 -0.08 0.00 0.70 0.00 0.00 0.00 173.10 173.98 2kyb n ASN 31 N -3.24 -4.56 -4.87 1.64 3.02 -1.26 -4.94 115.26 101.05 2kyb n ASN 31 Ca 0.08 0.39 -0.32 0.00 -0.03 0.00 0.00 54.58 54.70 2kyb n ASN 31 Cb 0.60 -4.09 -0.05 0.00 -0.61 0.00 0.00 39.78 35.62 2kyb n ASN 31 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2kyb s THR 32 N -2.49 4.89 0.08 3.41 2.01 -1.25 -4.88 115.64 117.42 2kyb s THR 32 Ca 0.00 0.53 0.02 0.00 0.31 0.00 0.00 61.69 62.55 2kyb s THR 32 Cb 0.00 -3.63 -0.04 0.00 0.01 0.00 0.00 72.50 68.84 2kyb s THR 32 CO 0.00 -0.12 0.14 -0.75 -0.69 0.00 0.00 174.62 173.20 2kyb s LYS 33 N -2.92 3.11 -0.13 4.92 2.20 -1.26 -3.03 119.74 122.63 2kyb s LYS 33 Ca 0.48 -0.61 -0.25 0.00 -0.36 0.00 0.00 55.97 55.24 2kyb s LYS 33 Cb -0.11 -2.85 0.06 0.00 -1.51 0.00 0.00 37.83 33.42 2kyb s LYS 33 CO 0.21 0.57 0.60 0.54 -0.36 0.00 0.00 175.35 176.92 2kyb s VAL 34 N -1.47 0.01 -0.41 4.02 0.11 -1.24 -5.05 120.40 116.37 2kyb s VAL 34 Ca 0.32 -0.07 -0.10 0.00 -2.93 0.00 0.00 61.98 59.20 2kyb s VAL 34 Cb -0.12 -0.89 0.06 0.00 -1.53 0.00 0.00 36.38 33.90 2kyb s VAL 34 CO 0.25 -0.04 0.24 -0.89 -3.33 0.00 0.00 175.10 171.33 2kyb s THR 35 N -0.53 4.32 0.12 5.04 2.01 -1.26 -3.04 115.64 122.29 2kyb s THR 35 Ca -0.06 -1.25 -0.34 0.00 0.31 0.00 0.00 61.69 60.35 2kyb s THR 35 Cb -0.03 -3.58 -0.18 0.00 0.01 0.00 0.00 72.50 68.73 2kyb s THR 35 CO 0.05 -0.43 0.90 -0.38 -0.69 0.00 0.00 174.62 174.07 2kyb n ILE 36 N 4.94 0.97 -3.21 1.82 2.08 -0.76 -4.89 119.36 120.30 2kyb n ILE 36 Ca -0.11 -0.24 0.00 0.00 0.56 0.00 0.00 62.75 62.96 2kyb n ILE 36 Cb 0.44 -0.23 -0.01 0.00 -0.75 0.00 0.00 39.64 39.08 2kyb n ILE 36 CO 0.00 0.00 0.00 0.68 0.56 0.00 0.00 176.55 177.79 2kyb s VAL 37 N -0.42 -0.97 0.00 1.39 -7.23 -1.20 -5.01 120.40 106.96 2kyb s VAL 37 Ca 0.76 -0.04 0.00 0.00 -1.81 0.00 0.00 61.98 60.89 2kyb s VAL 37 Cb -1.03 -0.05 0.00 0.00 0.56 0.00 0.00 36.38 35.86 2kyb s VAL 37 CO 0.55 -0.02 0.00 0.61 -0.31 0.00 0.00 175.10 175.93 2kyb n GLY 38 N 4.43 1.97 3.63 2.32 0.00 -1.26 -4.27 105.19 112.02 2kyb n GLY 38 Ca 0.11 -1.05 -0.35 0.00 0.00 0.00 0.00 46.02 44.73 2kyb n GLY 38 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2kyb s GLU 39 N -2.98 3.69 -0.28 1.61 1.03 -1.26 -1.17 118.70 119.35 2kyb s GLU 39 Ca 0.00 -0.38 0.00 0.00 0.03 0.00 0.00 54.97 54.63 2kyb s GLU 39 Cb 0.00 -3.07 0.15 0.00 -0.80 0.00 0.00 34.13 30.41 2kyb s GLU 39 CO 0.00 0.39 0.39 -2.00 -1.33 0.00 0.00 175.26 172.70 2kyb s GLU 40 N 0.02 0.38 3.56 -4.83 2.12 -0.45 -4.99 118.70 114.51 2kyb s GLU 40 Ca 0.04 0.21 0.00 0.00 0.36 0.00 0.00 54.97 55.58 2kyb s GLU 40 Cb -0.12 -0.40 0.00 0.00 0.26 0.00 0.00 34.13 33.87 2kyb s GLU 40 CO 0.01 -0.92 0.00 0.41 -0.54 0.00 0.00 175.26 174.22 2kyb n GLY 41 N 5.35 1.15 0.38 -1.50 0.00 -1.26 -1.53 105.19 107.78 2kyb n GLY 41 Ca -0.01 -0.58 0.00 0.00 0.00 0.00 0.00 46.02 45.43 2kyb n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kyb n ALA 42 N 5.01 2.13 -2.32 4.61 0.00 -1.26 -4.74 120.51 123.93 2kyb n ALA 42 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 2kyb n ALA 42 Cb 0.00 -1.00 -0.10 0.00 0.00 0.00 0.00 19.45 18.35 2kyb n ALA 42 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2kyb s PHE 43 N -1.24 1.06 0.27 0.00 0.40 -0.58 -3.63 117.98 114.25 2kyb s PHE 43 Ca 0.00 -0.77 0.06 0.00 -0.60 0.00 0.00 56.93 55.62 2kyb s PHE 43 Cb 0.00 -0.57 -0.06 0.00 0.51 0.00 0.00 43.02 42.90 2kyb s PHE 43 CO 0.00 -0.02 -0.04 0.71 0.70 0.00 0.00 175.22 176.57 2kyb s TYR 44 N -3.07 1.86 -0.16 0.36 1.51 -1.15 -1.35 117.35 115.35 2kyb s TYR 44 Ca 0.11 -0.76 -0.05 0.00 -1.01 0.00 0.00 57.07 55.36 2kyb s TYR 44 Cb 0.01 -1.08 -0.03 0.00 -0.11 0.00 0.00 41.96 40.76 2kyb s TYR 44 CO -0.01 0.19 -0.02 0.21 -1.11 0.00 0.00 175.55 174.81 2kyb s LYS 45 N -3.77 3.73 0.39 -0.62 2.20 -0.31 -3.42 119.74 117.94 2kyb s LYS 45 Ca 0.29 -0.48 0.06 0.00 -0.36 0.00 0.00 55.97 55.48 2kyb s LYS 45 Cb 0.04 -2.98 -0.08 0.00 -1.51 0.00 0.00 37.83 33.30 2kyb s LYS 45 CO 0.11 0.23 0.02 0.96 -0.36 0.00 0.00 175.35 176.32 2kyb s ILE 46 N 0.40 1.78 -0.29 5.43 -4.36 -0.99 -3.21 121.20 119.96 2kyb s ILE 46 Ca -0.02 -2.00 -0.01 0.00 -0.26 0.00 0.00 60.65 58.36 2kyb s ILE 46 Cb -0.14 -2.94 0.09 0.00 1.25 0.00 0.00 42.46 40.72 2kyb s ILE 46 CO 0.02 0.00 0.07 -1.83 0.24 0.00 0.00 174.94 173.45 2kyb s GLU 47 N -3.76 0.82 0.07 0.37 -1.05 -1.26 -3.30 118.70 110.59 2kyb s GLU 47 Ca 0.35 -1.02 -0.00 0.00 -0.15 0.00 0.00 54.97 54.15 2kyb s GLU 47 Cb 0.10 -2.12 -0.04 0.00 -0.44 0.00 0.00 34.13 31.62 2kyb s GLU 47 CO 0.17 -0.91 -0.03 -0.47 0.95 0.00 0.00 175.26 174.97 2kyb s TYR 48 N 1.59 0.64 -1.01 4.83 5.04 -0.77 -4.82 117.35 122.85 2kyb s TYR 48 Ca 0.07 -1.04 0.00 0.00 -2.44 0.00 0.00 57.07 53.66 2kyb s TYR 48 Cb -0.17 -0.43 0.00 0.00 0.35 0.00 0.00 41.96 41.71 2kyb s TYR 48 CO -0.20 -0.33 0.00 1.63 -1.34 0.00 0.00 175.55 175.31 2kyb n LYS 49 N 0.06 -1.96 -0.89 4.97 5.02 -1.26 0.75 118.16 124.85 2kyb n LYS 49 Ca -0.13 0.57 0.00 0.00 -2.02 0.00 0.00 58.31 56.73 2kyb n LYS 49 Cb 0.61 -5.02 0.00 0.00 -0.02 0.00 0.00 35.03 30.60 2kyb n LYS 49 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2kyb n GLY 50 N -0.58 0.23 3.75 0.72 0.00 -1.26 -4.95 105.19 103.11 2kyb n GLY 50 Ca -0.12 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.60 2kyb n GLY 50 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2kyb s SER 51 N -2.12 4.21 -0.08 1.61 1.04 0.23 -5.15 113.70 113.44 2kyb s SER 51 Ca 0.00 -1.44 0.02 0.00 0.48 0.00 0.00 55.95 55.01 2kyb s SER 51 Cb 0.00 0.17 -0.02 0.00 0.10 0.00 0.00 66.02 66.27 2kyb s SER 51 CO 0.00 -0.77 -0.14 -1.38 0.98 0.00 0.00 173.24 171.93 2kyb s HIS 52 N -2.78 2.74 0.14 5.02 -3.43 -1.26 -1.85 115.29 113.87 2kyb s HIS 52 Ca 0.22 -0.38 -0.01 0.00 -0.80 0.00 0.00 55.06 54.08 2kyb s HIS 52 Cb 0.03 -1.72 -0.04 0.00 -1.43 0.00 0.00 32.58 29.42 2kyb s HIS 52 CO 0.12 0.00 0.07 0.20 -2.00 0.00 0.00 174.74 173.13 2kyb s GLY 53 N -0.25 1.05 -0.03 -1.38 0.00 -1.21 -4.82 107.32 100.69 2kyb s GLY 53 Ca 0.01 -1.50 0.03 0.00 0.00 0.00 0.00 44.72 43.26 2kyb s GLY 53 CO 0.03 -1.36 -0.12 -0.19 0.00 0.00 0.00 173.10 171.46 2kyb s TYR 54 N -4.07 1.17 0.01 1.90 1.51 -1.05 -2.36 117.35 114.46 2kyb s TYR 54 Ca 0.26 -0.29 -0.05 0.00 -1.01 0.00 0.00 57.07 55.98 2kyb s TYR 54 Cb 0.07 -0.80 -0.01 0.00 -0.11 0.00 0.00 41.96 41.12 2kyb s TYR 54 CO 0.03 -0.10 0.09 0.08 -1.11 0.00 0.00 175.55 174.54 2kyb s VAL 55 N 0.06 0.09 0.08 0.71 1.01 -1.22 -2.95 120.40 118.18 2kyb s VAL 55 Ca -0.02 -0.78 -0.31 0.00 0.00 0.00 0.00 61.98 60.88 2kyb s VAL 55 Cb -0.09 -0.40 -0.08 0.00 0.00 0.00 0.00 36.38 35.81 2kyb s VAL 55 CO 0.01 -0.43 1.49 0.00 0.00 0.00 0.00 175.10 176.17 2kyb s ALA 56 N -1.47 3.64 -0.13 5.51 0.00 -1.26 -2.95 121.76 125.11 2kyb s ALA 56 Ca -0.15 1.12 0.27 0.00 0.00 0.00 0.00 51.96 53.20 2kyb s ALA 56 Cb -0.08 -3.61 0.82 0.00 0.00 0.00 0.00 23.12 20.25 2kyb s ALA 56 CO 0.01 -0.84 1.78 1.57 0.00 0.00 0.00 175.76 178.28 2kyb h LYS 57 N 7.46 0.00 -0.50 0.00 2.10 -1.92 -3.12 116.57 120.58 2kyb h LYS 57 Ca -0.41 0.00 -0.08 0.00 -2.00 0.00 0.00 60.65 58.16 2kyb h LYS 57 Cb 1.20 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.51 2kyb h LYS 57 CO 0.90 0.06 -0.00 1.49 -2.00 0.00 0.00 179.45 179.89 2kyb h GLU 58 N 0.00 0.84 -0.04 0.07 4.81 -1.90 -2.62 114.58 115.73 2kyb h GLU 58 Ca -0.00 -0.23 -0.18 0.00 -0.13 0.00 0.00 59.36 58.82 2kyb h GLU 58 Cb 0.79 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.07 2kyb h GLU 58 CO 0.01 0.84 -0.76 1.88 -0.73 0.00 0.00 179.01 180.25 2kyb h TYR 59 N 0.78 0.39 -0.01 0.92 -1.99 -1.95 -3.52 116.97 111.59 2kyb h TYR 59 Ca 0.15 -0.18 0.00 0.00 2.00 0.00 0.00 58.73 60.70 2kyb h TYR 59 Cb 0.47 -0.06 0.00 0.00 2.00 0.00 0.00 36.73 39.15 2kyb h TYR 59 CO 0.03 0.93 0.00 -0.89 -0.00 0.00 0.00 178.16 178.23