#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kyz s ARG 2 N 0.00 1.60 -0.09 0.03 1.70 -1.13 -2.35 118.95 118.72 2kyz s ARG 2 Ca 0.00 -1.84 -0.04 0.00 -0.47 0.00 0.00 55.73 53.39 2kyz s ARG 2 Cb 0.00 -1.13 0.05 0.00 -0.57 0.00 0.00 34.95 33.29 2kyz s ARG 2 CO 0.00 -0.01 0.18 0.71 -1.08 0.00 0.00 175.30 175.09 2kyz s TYR 3 N -3.05 -0.22 -0.77 5.89 2.02 -0.47 -1.70 117.35 119.05 2kyz s TYR 3 Ca 0.31 0.64 -0.25 0.00 -0.37 0.00 0.00 57.07 57.41 2kyz s TYR 3 Cb 0.05 -0.16 0.05 0.00 -0.40 0.00 0.00 41.96 41.50 2kyz s TYR 3 CO 0.13 -0.25 1.22 0.08 -1.57 0.00 0.00 175.55 175.16 2kyz s VAL 4 N 1.93 3.94 0.87 0.71 1.01 0.96 -2.73 120.40 127.10 2kyz s VAL 4 Ca -0.01 -0.03 -0.12 0.00 0.00 0.00 0.00 61.98 61.81 2kyz s VAL 4 Cb -0.12 -4.88 0.12 0.00 0.00 0.00 0.00 36.38 31.50 2kyz s VAL 4 CO -0.06 -1.76 1.14 -0.76 0.00 0.00 0.00 175.10 173.66 2kyz s LEU 5 N 5.09 2.19 -0.06 3.92 1.43 0.85 -1.05 118.68 131.04 2kyz s LEU 5 Ca 0.33 0.98 -0.01 0.00 -1.03 0.00 0.00 54.13 54.40 2kyz s LEU 5 Cb -0.09 -3.38 0.03 0.00 0.03 0.00 0.00 46.19 42.78 2kyz s LEU 5 CO 0.09 -2.34 0.01 -0.47 0.23 0.00 0.00 176.35 173.88 2kyz s TYR 6 N -3.31 0.53 -0.38 0.29 5.04 0.61 -2.87 117.35 117.26 2kyz s TYR 6 Ca 0.63 -0.07 0.01 0.00 -2.44 0.00 0.00 57.07 55.20 2kyz s TYR 6 Cb -0.14 -0.72 0.15 0.00 0.35 0.00 0.00 41.96 41.60 2kyz s TYR 6 CO 0.53 -0.29 0.25 0.54 -1.34 0.00 0.00 175.55 175.24 2kyz s VAL 7 N 1.97 0.26 0.26 3.14 0.11 -0.30 0.63 120.40 126.47 2kyz s VAL 7 Ca 0.04 -2.06 0.35 0.00 -2.93 0.00 0.00 61.98 57.38 2kyz s VAL 7 Cb -0.12 -1.20 0.35 0.00 -1.53 0.00 0.00 36.38 33.88 2kyz s VAL 7 CO -0.05 -1.07 2.06 1.55 -3.33 0.00 0.00 175.10 174.27 2kyz h PRO 8 N 6.55 0.00 0.00 1.54 0.13 -1.89 -2.41 132.00 135.93 2kyz h PRO 8 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 2kyz h PRO 8 Cb 0.95 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.08 2kyz h PRO 8 CO 0.31 0.00 0.00 -0.44 -0.23 0.00 0.00 178.00 177.64 2kyz h ASP 9 N 0.00 0.00 0.00 1.44 3.32 -1.94 -2.96 116.42 116.28 2kyz h ASP 9 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2kyz h ASP 9 Cb 0.05 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.60 2kyz h ASP 9 CO 0.00 0.00 0.00 -0.38 -1.72 0.00 0.00 179.24 177.14 2kyz n ILE 10 N -2.51 0.00 0.06 0.35 5.41 -0.91 -4.17 119.36 117.60 2kyz n ILE 10 Ca 0.03 0.00 0.03 0.00 1.00 0.00 0.00 62.75 63.81 2kyz n ILE 10 Cb 0.33 -0.23 0.18 0.00 -0.71 0.00 0.00 39.64 39.21 2kyz n ILE 10 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 176.55 176.31 2kyz n SER 11 N -0.24 0.17 -4.31 4.38 2.88 -1.12 -4.54 113.62 110.84 2kyz n SER 11 Ca 0.00 0.53 -0.20 0.00 -1.33 0.00 0.00 58.87 57.87 2kyz n SER 11 Cb 0.07 -0.55 -0.11 0.00 -0.75 0.00 0.00 64.21 62.87 2kyz n SER 11 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2kyz h ASN 13 N 3.21 0.17 0.09 0.00 -1.24 -1.96 -1.80 115.58 114.05 2kyz h ASN 13 Ca -0.41 -0.09 -0.02 0.00 0.71 0.00 0.00 56.30 56.49 2kyz h ASN 13 Cb 1.21 -0.05 -0.00 0.00 0.73 0.00 0.00 38.32 40.20 2kyz h ASN 13 CO 0.53 0.68 -0.08 -0.74 -1.29 0.00 0.00 177.43 176.52 2kyz h HIS 14 N 0.12 0.00 -0.84 0.67 2.76 -1.97 -1.78 115.15 114.11 2kyz h HIS 14 Ca -0.00 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 2kyz h HIS 14 Cb 0.99 0.00 -0.04 0.00 1.55 0.00 0.00 27.41 29.91 2kyz h HIS 14 CO 0.01 0.08 0.53 0.00 -1.30 0.00 0.00 177.93 177.25 2kyz h LYS 16 N 1.15 0.75 -0.08 0.00 3.64 -1.34 0.32 116.57 121.01 2kyz h LYS 16 Ca 0.31 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.63 2kyz h LYS 16 Cb -0.09 -0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 31.56 2kyz h LYS 16 CO -0.06 0.50 0.02 0.52 -2.27 0.00 0.00 179.45 178.15 2kyz h MET 17 N 0.77 0.10 0.13 1.90 2.86 -1.57 -1.46 114.93 117.67 2kyz h MET 17 Ca 0.39 -0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 58.01 2kyz h MET 17 Cb 0.35 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 31.99 2kyz h MET 17 CO -0.24 0.10 -0.06 0.00 1.06 0.00 0.00 176.91 177.76 2kyz h ARG 18 N 0.10 -0.17 0.86 1.72 3.08 -0.92 0.49 114.38 119.56 2kyz h ARG 18 Ca 0.03 0.01 -0.04 0.00 0.07 0.00 0.00 59.98 60.05 2kyz h ARG 18 Cb 0.05 0.04 0.01 0.00 0.08 0.00 0.00 29.97 30.14 2kyz h ARG 18 CO -0.00 -0.04 -0.42 0.82 -1.07 0.00 0.00 179.97 179.25 2kyz h ILE 19 N -0.25 0.14 -0.40 2.04 5.03 -1.45 -2.93 117.51 119.68 2kyz h ILE 19 Ca -0.02 0.00 -0.03 0.00 -0.12 0.00 0.00 64.86 64.69 2kyz h ILE 19 Cb 0.20 0.14 -0.02 0.00 -3.03 0.00 0.00 36.82 34.11 2kyz h ILE 19 CO 0.03 0.00 0.11 -1.28 -0.68 0.00 0.00 178.15 176.33 2kyz h SER 20 N -1.17 0.54 -0.06 1.72 0.87 -1.16 0.28 113.55 114.57 2kyz h SER 20 Ca -0.12 -0.08 0.01 0.00 -1.23 0.00 0.00 61.79 60.38 2kyz h SER 20 Cb 0.90 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 62.71 2kyz h SER 20 CO 0.19 0.54 -0.00 0.11 -0.53 0.00 0.00 176.83 177.14 2kyz h LYS 21 N 0.58 0.02 0.00 2.24 1.79 -0.89 0.18 116.57 120.50 2kyz h LYS 21 Ca 0.14 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.61 2kyz h LYS 21 Cb 0.21 -0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.85 2kyz h LYS 21 CO -0.01 0.01 0.00 0.00 -1.08 0.00 0.00 179.45 178.38 2kyz n ALA 22 N -2.17 1.10 -0.14 3.86 0.00 -0.43 -2.09 120.51 120.64 2kyz n ALA 22 Ca -0.06 0.09 -0.27 0.00 0.00 0.00 0.00 53.44 53.20 2kyz n ALA 22 Cb 0.05 -1.18 -0.10 0.00 0.00 0.00 0.00 19.45 18.22 2kyz n ALA 22 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2kyz n LEU 23 N -1.88 2.17 0.25 0.00 4.77 -0.04 -3.70 117.00 118.57 2kyz n LEU 23 Ca -0.00 0.24 0.08 0.00 -0.03 0.00 0.00 56.01 56.30 2kyz n LEU 23 Cb 0.04 -0.84 0.62 0.00 -2.33 0.00 0.00 43.42 40.91 2kyz n LEU 23 CO 0.06 0.65 1.03 -0.33 -1.33 0.00 0.00 177.39 177.47 2kyz h GLU 24 N -0.80 0.00 -0.02 3.23 5.08 -0.66 -0.84 114.58 120.56 2kyz h GLU 24 Ca -0.68 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 57.50 2kyz h GLU 24 Cb 1.67 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.91 2kyz h GLU 24 CO -0.36 0.05 -0.79 1.05 -1.00 0.00 0.00 179.01 177.96 2kyz h GLU 25 N 0.00 0.22 0.00 2.33 4.11 -1.64 -3.32 114.58 116.29 2kyz h GLU 25 Ca -0.00 -0.21 0.00 0.00 0.07 0.00 0.00 59.36 59.22 2kyz h GLU 25 Cb 0.09 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.39 2kyz h GLU 25 CO 0.01 0.90 0.00 1.25 0.07 0.00 0.00 179.01 181.23 2kyz h LEU 26 N 0.14 0.00 0.00 3.06 5.85 -1.24 -3.46 115.31 119.66 2kyz h LEU 26 Ca -0.03 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.69 2kyz h LEU 26 Cb 1.37 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.40 2kyz h LEU 26 CO 0.12 0.00 0.00 0.61 -0.34 0.00 0.00 178.44 178.83 2kyz n GLY 27 N 0.22 1.02 3.68 3.75 0.00 -1.05 -5.08 105.19 107.74 2kyz n GLY 27 Ca 0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 2kyz n GLY 27 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kyz s VAL 28 N -2.00 2.05 0.00 1.61 0.11 -1.10 -4.98 120.40 116.09 2kyz s VAL 28 Ca 0.00 0.02 0.00 0.00 -2.93 0.00 0.00 61.98 59.07 2kyz s VAL 28 Cb 0.00 -2.16 0.00 0.00 -1.53 0.00 0.00 36.38 32.69 2kyz s VAL 28 CO 0.00 -0.02 0.00 0.29 -3.33 0.00 0.00 175.10 172.04 2kyz n LYS 29 N -3.95 2.55 -3.61 1.54 4.76 -1.26 -4.84 118.16 113.35 2kyz n LYS 29 Ca 0.12 0.00 -0.24 0.00 -2.87 0.00 0.00 58.31 55.33 2kyz n LYS 29 Cb 0.52 -0.74 -0.17 0.00 -1.84 0.00 0.00 35.03 32.80 2kyz n LYS 29 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 2kyz s ASN 30 N -1.17 1.93 0.11 4.39 -0.87 -1.26 -5.09 114.94 112.97 2kyz s ASN 30 Ca 0.00 -0.39 -0.24 0.00 -1.57 0.00 0.00 52.86 50.67 2kyz s ASN 30 Cb 0.00 -0.14 0.06 0.00 -0.02 0.00 0.00 41.25 41.16 2kyz s ASN 30 CO 0.00 -0.32 0.58 -0.72 -2.57 0.00 0.00 177.10 174.07 2kyz s TYR 31 N 2.17 -0.51 -0.31 2.20 1.13 -1.26 -0.85 117.35 119.92 2kyz s TYR 31 Ca 0.03 0.44 0.03 0.00 -1.41 0.00 0.00 57.07 56.16 2kyz s TYR 31 Cb -0.15 0.47 0.16 0.00 -1.10 0.00 0.00 41.96 41.35 2kyz s TYR 31 CO -0.08 -0.77 0.42 -1.21 -2.51 0.00 0.00 175.55 171.41 2kyz s GLU 32 N -3.14 0.48 0.03 -3.49 2.02 -0.05 -4.99 118.70 109.55 2kyz s GLU 32 Ca -0.02 -0.03 -0.25 0.00 0.02 0.00 0.00 54.97 54.69 2kyz s GLU 32 Cb -0.01 -0.32 -0.05 0.00 0.10 0.00 0.00 34.13 33.85 2kyz s GLU 32 CO -0.07 -1.07 0.79 0.08 0.02 0.00 0.00 175.26 175.00 2kyz s VAL 33 N 2.34 4.77 -0.28 2.63 1.01 -1.26 -0.42 120.40 129.19 2kyz s VAL 33 Ca 0.11 1.67 0.02 0.00 0.00 0.00 0.00 61.98 63.78 2kyz s VAL 33 Cb -0.12 -4.13 0.07 0.00 0.00 0.00 0.00 36.38 32.20 2kyz s VAL 33 CO -0.25 0.33 -0.02 -0.55 0.00 0.00 0.00 175.10 174.61 2kyz s SER 34 N 0.13 4.24 -0.06 3.32 0.15 0.09 -5.01 113.70 116.57 2kyz s SER 34 Ca 0.40 -1.53 -0.26 0.00 0.70 0.00 0.00 55.95 55.26 2kyz s SER 34 Cb -0.20 -1.34 -0.21 0.00 -1.71 0.00 0.00 66.02 62.55 2kyz s SER 34 CO 0.23 -0.28 1.06 0.58 1.20 0.00 0.00 173.24 176.02 2kyz h VAL 35 N 6.66 1.44 -0.47 4.45 2.07 -1.82 0.86 116.25 129.44 2kyz h VAL 35 Ca -0.14 -1.51 -0.01 0.00 0.82 0.00 0.00 66.70 65.86 2kyz h VAL 35 Cb 1.04 2.44 -0.02 0.00 -1.52 0.00 0.00 31.29 33.23 2kyz h VAL 35 CO 0.46 0.38 0.27 -0.33 0.02 0.00 0.00 177.57 178.37 2kyz h GLU 36 N -0.70 0.64 -0.00 1.57 5.08 -1.92 -2.99 114.58 116.27 2kyz h GLU 36 Ca -0.00 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 2kyz h GLU 36 Cb 0.65 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.77 2kyz h GLU 36 CO 0.00 0.49 -0.15 0.39 -1.00 0.00 0.00 179.01 178.75 2kyz n GLU 37 N -4.70 0.08 -2.03 2.33 1.02 -1.23 -4.92 120.64 111.19 2kyz n GLU 37 Ca 0.01 -0.02 -0.15 0.00 -0.02 0.00 0.00 57.16 56.98 2kyz n GLU 37 Cb 0.07 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 29.96 2kyz n GLU 37 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2kyz n LYS 38 N -1.44 -1.76 -4.20 3.49 5.02 0.26 -4.96 118.16 114.57 2kyz n LYS 38 Ca 0.08 0.80 -0.23 0.00 -2.02 0.00 0.00 58.31 56.94 2kyz n LYS 38 Cb 0.33 -5.29 -0.06 0.00 -0.02 0.00 0.00 35.03 29.99 2kyz n LYS 38 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2kyz s LYS 39 N -4.34 2.58 0.10 1.97 1.02 -1.00 -1.15 119.74 118.92 2kyz s LYS 39 Ca 0.00 -1.21 0.09 0.00 0.02 0.00 0.00 55.97 54.87 2kyz s LYS 39 Cb 0.00 -2.37 -0.03 0.00 -0.52 0.00 0.00 37.83 34.91 2kyz s LYS 39 CO 0.00 0.40 -0.24 0.08 -0.92 0.00 0.00 175.35 174.67 2kyz s VAL 40 N -2.15 1.96 -0.06 3.17 1.01 -1.14 -0.74 120.40 122.47 2kyz s VAL 40 Ca 0.31 -1.55 0.06 0.00 0.00 0.00 0.00 61.98 60.80 2kyz s VAL 40 Cb -0.08 -1.74 -0.02 0.00 0.00 0.00 0.00 36.38 34.55 2kyz s VAL 40 CO 0.22 0.09 -0.22 -0.69 0.00 0.00 0.00 175.10 174.49 2kyz s VAL 41 N -1.03 2.30 -0.06 2.92 1.01 0.44 -0.11 120.40 125.88 2kyz s VAL 41 Ca 0.10 -0.98 0.01 0.00 0.00 0.00 0.00 61.98 61.10 2kyz s VAL 41 Cb -0.10 -1.85 0.02 0.00 0.00 0.00 0.00 36.38 34.45 2kyz s VAL 41 CO 0.04 0.57 -0.05 0.68 0.00 0.00 0.00 175.10 176.34 2kyz s VAL 42 N -0.29 0.63 -0.72 2.92 -7.23 -1.11 -0.88 120.40 113.73 2kyz s VAL 42 Ca 0.01 -0.14 -0.19 0.00 -1.81 0.00 0.00 61.98 59.85 2kyz s VAL 42 Cb -0.13 -0.66 0.12 0.00 0.56 0.00 0.00 36.38 36.27 2kyz s VAL 42 CO 0.03 0.26 0.85 -0.70 -0.31 0.00 0.00 175.10 175.22 2kyz s GLU 43 N 1.12 3.27 0.32 4.82 2.12 -0.03 -1.37 118.70 128.95 2kyz s GLU 43 Ca -0.08 -1.54 0.04 0.00 0.36 0.00 0.00 54.97 53.75 2kyz s GLU 43 Cb -0.14 -4.45 -0.03 0.00 0.26 0.00 0.00 34.13 29.77 2kyz s GLU 43 CO -0.01 -1.59 0.20 -0.08 -0.54 0.00 0.00 175.26 173.24 2kyz s THR 44 N 2.47 0.19 -0.76 -1.70 -1.32 -0.99 -4.51 115.64 109.02 2kyz s THR 44 Ca 0.19 -2.00 0.08 0.00 -1.21 0.00 0.00 61.69 58.75 2kyz s THR 44 Cb -0.16 -2.48 -0.00 0.00 -1.51 0.00 0.00 72.50 68.34 2kyz s THR 44 CO 0.01 0.00 0.57 1.21 -2.21 0.00 0.00 174.62 174.20 2kyz n GLU 45 N -0.61 2.18 -3.61 7.08 2.13 -1.26 -3.31 120.64 123.23 2kyz n GLU 45 Ca 0.03 -0.55 -0.29 0.00 0.66 0.00 0.00 57.16 57.00 2kyz n GLU 45 Cb 0.64 -1.03 -0.14 0.00 0.27 0.00 0.00 31.44 31.18 2kyz n GLU 45 CO 0.00 0.00 0.00 1.21 -0.41 0.00 0.00 177.13 177.93 2kyz s ASN 46 N -1.20 3.54 0.25 4.31 3.04 -1.26 -5.00 114.94 118.61 2kyz s ASN 46 Ca 0.07 -1.99 -0.05 0.00 0.04 0.00 0.00 52.86 50.93 2kyz s ASN 46 Cb 0.07 -0.68 0.32 0.00 -1.54 0.00 0.00 41.25 39.42 2kyz s ASN 46 CO 0.21 -0.35 1.89 0.25 -3.04 0.00 0.00 177.10 176.06 2kyz h LEU 47 N 7.48 1.02 -0.88 3.21 5.85 -2.00 -2.09 115.31 127.90 2kyz h LEU 47 Ca -0.06 -0.00 0.17 0.00 0.84 0.00 0.00 57.88 58.83 2kyz h LEU 47 Cb 0.98 -0.23 -0.10 0.00 0.37 0.00 0.00 40.66 41.68 2kyz h LEU 47 CO 0.41 0.69 0.45 -0.78 -0.34 0.00 0.00 178.44 178.87 2kyz h ASP 48 N 1.18 0.52 -0.86 1.25 3.58 -1.98 -0.05 116.42 120.05 2kyz h ASP 48 Ca 0.39 0.11 0.06 0.00 0.42 0.00 0.00 57.03 58.00 2kyz h ASP 48 Cb 0.04 0.03 -0.06 0.00 1.72 0.00 0.00 39.33 41.06 2kyz h ASP 48 CO -0.13 0.18 0.54 -1.28 -2.88 0.00 0.00 179.24 175.67 2kyz h SER 49 N 0.59 0.86 0.13 2.28 0.87 -1.80 0.66 113.55 117.14 2kyz h SER 49 Ca 0.50 0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 61.07 2kyz h SER 49 Cb 0.78 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 62.57 2kyz h SER 49 CO -0.40 0.55 -0.06 0.58 -0.53 0.00 0.00 176.83 176.97 2kyz h VAL 50 N 0.99 1.00 -0.69 2.23 2.07 -1.23 -3.05 116.25 117.57 2kyz h VAL 50 Ca 0.37 -1.15 0.07 0.00 0.82 0.00 0.00 66.70 66.81 2kyz h VAL 50 Cb 0.14 1.64 -0.06 0.00 -1.52 0.00 0.00 31.29 31.50 2kyz h VAL 50 CO -0.16 0.25 0.38 -0.07 0.02 0.00 0.00 177.57 177.98 2kyz h LEU 51 N -0.78 0.54 -0.15 2.57 3.38 -0.48 -0.26 115.31 120.14 2kyz h LEU 51 Ca -0.02 0.04 0.04 0.00 0.09 0.00 0.00 57.88 58.03 2kyz h LEU 51 Cb 0.54 -0.07 -0.05 0.00 0.09 0.00 0.00 40.66 41.18 2kyz h LEU 51 CO 0.03 0.34 -0.14 0.11 0.09 0.00 0.00 178.44 178.87 2kyz h LYS 52 N 0.68 -0.16 -0.77 1.13 1.79 -1.02 -1.40 116.57 116.81 2kyz h LYS 52 Ca 0.32 0.01 -0.02 0.00 -2.18 0.00 0.00 60.65 58.78 2kyz h LYS 52 Cb 0.24 0.04 -0.04 0.00 -1.58 0.00 0.00 32.23 30.89 2kyz h LYS 52 CO -0.21 -0.11 0.38 -0.22 -1.08 0.00 0.00 179.45 178.22 2kyz h LYS 53 N -0.16 1.10 -0.73 3.15 1.63 -1.04 -0.03 116.57 120.49 2kyz h LYS 53 Ca 0.10 -0.15 -0.06 0.00 -0.85 0.00 0.00 60.65 59.69 2kyz h LYS 53 Cb 0.31 -0.21 -0.03 0.00 -0.60 0.00 0.00 32.23 31.70 2kyz h LYS 53 CO -0.24 0.83 0.22 -0.07 -3.45 0.00 0.00 179.45 176.74 2kyz h LEU 54 N 1.09 1.06 -0.28 5.20 4.07 -0.58 -1.00 115.31 124.86 2kyz h LEU 54 Ca 0.27 -0.20 0.02 0.00 0.08 0.00 0.00 57.88 58.05 2kyz h LEU 54 Cb 0.09 -0.28 -0.02 0.00 1.08 0.00 0.00 40.66 41.53 2kyz h LEU 54 CO -0.04 0.98 0.14 -0.33 -1.08 0.00 0.00 178.44 178.12 2kyz h GLU 55 N 1.08 0.29 0.00 1.13 5.08 -0.75 -0.11 114.58 121.30 2kyz h GLU 55 Ca 0.24 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.58 2kyz h GLU 55 Cb 0.31 -0.06 -0.00 0.00 0.50 0.00 0.00 28.75 29.49 2kyz h GLU 55 CO -0.01 0.19 -0.01 0.93 -1.00 0.00 0.00 179.01 179.11 2kyz h GLU 56 N 0.29 0.00 -0.56 2.33 5.08 -0.21 0.42 114.58 121.94 2kyz h GLU 56 Ca 0.12 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 2kyz h GLU 56 Cb 0.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.29 2kyz h GLU 56 CO -0.08 0.01 0.00 0.44 -1.00 0.00 0.00 179.01 178.38 2kyz n ILE 57 N -3.16 0.74 -0.99 3.13 -5.35 -0.46 -4.94 119.36 108.33 2kyz n ILE 57 Ca -0.02 -0.75 0.00 0.00 -0.27 0.00 0.00 62.75 61.71 2kyz n ILE 57 Cb 0.15 0.39 0.00 0.00 -1.74 0.00 0.00 39.64 38.43 2kyz n ILE 57 CO 0.00 0.00 0.00 -0.67 -1.76 0.00 0.00 176.55 174.12 2kyz n ASP 58 N 1.15 -3.34 -3.94 7.28 2.03 0.14 -5.00 116.55 114.87 2kyz n ASP 58 Ca 0.19 0.00 -0.32 0.00 0.52 0.00 0.00 54.79 55.17 2kyz n ASP 58 Cb 0.48 -1.02 -0.08 0.00 -0.72 0.00 0.00 41.12 39.77 2kyz n ASP 58 CO 0.00 0.00 0.00 -1.22 -1.92 0.00 0.00 177.20 174.06 2kyz n TYR 59 N -2.76 3.73 -1.99 -0.67 4.02 -0.07 -4.98 117.16 114.43 2kyz n TYR 59 Ca 0.00 -4.13 -0.42 0.00 -0.01 0.00 0.00 57.90 53.34 2kyz n TYR 59 Cb 0.09 -0.89 -0.03 0.00 -0.02 0.00 0.00 39.34 38.49 2kyz n TYR 59 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 176.86 174.60 2kyz s PRO 60 N -1.64 4.19 0.01 -0.72 0.04 -1.25 -3.88 135.00 131.74 2kyz s PRO 60 Ca 0.29 2.22 -0.32 0.00 0.04 0.00 0.00 61.00 63.23 2kyz s PRO 60 Cb -0.02 -3.90 -0.11 0.00 0.04 0.00 0.00 34.50 30.51 2kyz s PRO 60 CO -0.12 -0.81 1.89 0.28 0.04 0.00 0.00 177.00 178.28 2kyz n VAL 61 N 5.29 0.58 0.06 -0.36 0.31 -1.26 -4.81 118.33 118.14 2kyz n VAL 61 Ca 0.17 -0.10 -0.13 0.00 -0.01 0.00 0.00 64.34 64.27 2kyz n VAL 61 Cb 0.42 -2.05 -0.09 0.00 -0.91 0.00 0.00 33.84 31.21 2kyz n VAL 61 CO 0.00 0.00 0.00 -0.08 -1.32 0.00 0.00 176.83 175.43 2kyz h GLU 62 N 9.41 -0.17 -4.14 5.55 4.81 -0.16 -3.48 114.58 126.40 2kyz h GLU 62 Ca -0.48 0.01 -0.16 0.00 -0.13 0.00 0.00 59.36 58.59 2kyz h GLU 62 Cb 1.25 0.04 -0.12 0.00 0.63 0.00 0.00 28.75 30.55 2kyz h GLU 62 CO 0.94 0.20 -0.36 -1.12 -0.73 0.00 0.00 179.01 177.94 2kyz s SER 63 N -5.39 0.12 0.28 1.04 0.01 -1.21 -5.00 113.70 103.54 2kyz s SER 63 Ca -0.15 -1.19 -0.07 0.00 1.31 0.00 0.00 55.95 55.85 2kyz s SER 63 Cb 0.02 0.49 -0.01 0.00 0.21 0.00 0.00 66.02 66.74 2kyz s SER 63 CO 0.60 -1.01 0.42 -0.72 0.41 0.00 0.00 173.24 172.94 2kyz s TYR 64 N -4.01 0.78 -0.16 2.43 -0.85 -1.26 -0.28 117.35 114.00 2kyz s TYR 64 Ca 0.31 -1.07 -0.13 0.00 -0.52 0.00 0.00 57.07 55.66 2kyz s TYR 64 Cb 0.03 -0.04 0.05 0.00 0.38 0.00 0.00 41.96 42.37 2kyz s TYR 64 CO 0.11 -1.00 0.41 -0.65 -1.52 0.00 0.00 175.55 172.91 2kyz s GLN 65 N -3.63 0.45 0.48 -3.49 -1.52 -0.22 -4.96 119.66 106.78 2kyz s GLN 65 Ca 0.29 0.64 -0.23 0.00 -1.95 0.00 0.00 55.36 54.11 2kyz s GLN 65 Cb 0.01 0.15 -0.07 0.00 -0.22 0.00 0.00 33.01 32.88 2kyz s GLN 65 CO 0.14 -0.09 1.26 -2.00 -0.25 0.00 0.00 175.29 174.35 2kyz s GLU 66 N 0.61 3.55 0.00 2.91 2.12 -1.26 -0.02 118.70 126.60 2kyz s GLU 66 Ca -0.03 2.01 0.00 0.00 0.36 0.00 0.00 54.97 57.31 2kyz s GLU 66 Cb -0.05 -2.41 0.00 0.00 0.26 0.00 0.00 34.13 31.94 2kyz s GLU 66 CO -0.04 -0.79 0.00 1.33 -0.54 0.00 0.00 175.26 175.22