#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 1.75 -0.17 0.03 1.70 -1.26 -1.81 118.95 119.20 2kyz s ARG 2 Ca 0.00 -1.80 -0.09 0.00 -0.47 0.00 0.00 55.73 53.38 2kyz s ARG 2 Cb 0.00 -1.78 0.06 0.00 -0.57 0.00 0.00 34.95 32.67 2kyz s ARG 2 CO 0.00 0.28 0.40 0.71 -1.08 0.00 0.00 175.30 175.61 2kyz s TYR 3 N -2.53 -0.61 -0.09 5.89 2.02 -0.52 -2.05 117.35 119.47 2kyz s TYR 3 Ca 0.31 1.28 -0.24 0.00 -0.37 0.00 0.00 57.07 58.05 2kyz s TYR 3 Cb -0.03 0.25 -0.03 0.00 -0.40 0.00 0.00 41.96 41.75 2kyz s TYR 3 CO 0.16 -0.35 0.76 0.14 -1.57 0.00 0.00 175.55 174.68 2kyz s VAL 4 N 1.55 4.98 0.04 0.71 -7.23 -0.70 -1.36 120.40 118.38 2kyz s VAL 4 Ca -0.08 1.54 0.07 0.00 -1.81 0.00 0.00 61.98 61.70 2kyz s VAL 4 Cb -0.09 -4.09 -0.03 0.00 0.56 0.00 0.00 36.38 32.73 2kyz s VAL 4 CO -0.12 0.18 -0.20 -0.76 -0.31 0.00 0.00 175.10 173.88 2kyz s LEU 5 N 1.24 2.52 -0.51 1.32 1.43 -0.15 -1.64 118.68 122.89 2kyz s LEU 5 Ca 0.39 -0.45 -0.14 0.00 -1.03 0.00 0.00 54.13 52.90 2kyz s LEU 5 Cb -0.18 -1.47 0.11 0.00 0.03 0.00 0.00 46.19 44.69 2kyz s LEU 5 CO 0.17 0.26 0.43 -0.47 0.23 0.00 0.00 176.35 176.98 2kyz s TYR 6 N -0.89 3.29 -0.73 0.29 5.04 0.34 -1.36 117.35 123.33 2kyz s TYR 6 Ca 0.14 -1.37 -0.00 0.00 -2.44 0.00 0.00 57.07 53.39 2kyz s TYR 6 Cb -0.10 -3.58 0.18 0.00 0.35 0.00 0.00 41.96 38.81 2kyz s TYR 6 CO 0.04 -0.97 0.56 0.08 -1.34 0.00 0.00 175.55 173.93 2kyz s VAL 7 N 1.54 3.69 0.64 3.14 1.01 -0.40 -1.28 120.40 128.74 2kyz s VAL 7 Ca 0.04 -3.59 0.36 0.00 0.00 0.00 0.00 61.98 58.79 2kyz s VAL 7 Cb -0.28 -3.37 0.38 0.00 0.00 0.00 0.00 36.38 33.12 2kyz s VAL 7 CO 0.03 -0.97 2.19 1.55 0.00 0.00 0.00 175.10 177.90 2kyz h PRO 8 N 6.28 0.00 0.00 2.72 0.13 -1.85 -2.77 132.00 136.51 2kyz h PRO 8 Ca 0.07 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.20 2kyz h PRO 8 Cb 0.86 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.99 2kyz h PRO 8 CO 0.76 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.28 2kyz n ASP 9 N -3.27 0.58 0.00 1.44 8.00 -1.26 -2.81 116.55 119.23 2kyz n ASP 9 Ca -0.02 0.71 0.08 0.00 0.71 0.00 0.00 54.79 56.27 2kyz n ASP 9 Cb 0.20 -0.81 0.46 0.00 -0.02 0.00 0.00 41.12 40.96 2kyz n ASP 9 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 2kyz n ILE 10 N -2.21 0.00 0.00 0.53 5.41 -1.05 -4.11 119.36 117.93 2kyz n ILE 10 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 2kyz n ILE 10 Cb 0.12 -0.60 0.00 0.00 -0.71 0.00 0.00 39.64 38.45 2kyz n ILE 10 CO 0.00 0.00 0.00 -1.20 0.00 0.00 0.00 176.55 175.35 2kyz n SER 11 N -0.90 0.00 -4.48 4.38 7.64 -1.12 -4.41 113.62 114.72 2kyz n SER 11 Ca 0.12 0.37 -0.27 0.00 1.01 0.00 0.00 58.87 60.11 2kyz n SER 11 Cb 0.05 -0.37 -0.11 0.00 -1.01 0.00 0.00 64.21 62.77 2kyz n SER 11 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2kyz h ASN 13 N 3.03 0.07 -0.94 0.00 4.21 -1.96 -0.49 115.58 119.49 2kyz h ASN 13 Ca -0.46 -0.02 0.00 0.00 1.21 0.00 0.00 56.30 57.04 2kyz h ASN 13 Cb 1.21 -0.02 -0.05 0.00 -1.12 0.00 0.00 38.32 38.35 2kyz h ASN 13 CO 0.51 0.30 0.60 -0.74 -1.29 0.00 0.00 177.43 176.81 2kyz h HIS 14 N 0.06 1.21 -0.54 1.19 2.76 -1.96 -3.00 115.15 114.87 2kyz h HIS 14 Ca 0.01 0.02 -0.05 0.00 -2.20 0.00 0.00 60.37 58.15 2kyz h HIS 14 Cb 0.45 -0.41 -0.03 0.00 1.55 0.00 0.00 27.41 28.98 2kyz h HIS 14 CO 0.00 0.78 0.14 0.00 -1.30 0.00 0.00 177.93 177.55 2kyz h LYS 16 N 0.80 0.75 -0.68 0.00 3.64 -1.45 -0.60 116.57 119.02 2kyz h LYS 16 Ca 0.18 -0.05 -0.06 0.00 -1.27 0.00 0.00 60.65 59.45 2kyz h LYS 16 Cb 0.28 -0.17 -0.03 0.00 -0.41 0.00 0.00 32.23 31.91 2kyz h LYS 16 CO -0.00 0.50 0.19 0.52 -2.27 0.00 0.00 179.45 178.39 2kyz h MET 17 N 0.77 1.08 -0.73 1.90 2.86 -1.38 -2.98 114.93 116.44 2kyz h MET 17 Ca 0.50 -0.24 0.02 0.00 -2.06 0.00 0.00 59.70 57.91 2kyz h MET 17 Cb 0.75 -0.15 -0.04 0.00 0.06 0.00 0.00 31.60 32.22 2kyz h MET 17 CO -0.27 0.94 0.48 0.00 1.06 0.00 0.00 176.91 179.12 2kyz h ARG 18 N 1.01 0.92 0.19 1.72 3.08 -0.98 0.10 114.38 120.43 2kyz h ARG 18 Ca 0.22 -0.06 -0.01 0.00 0.07 0.00 0.00 59.98 60.20 2kyz h ARG 18 Cb 0.33 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 30.17 2kyz h ARG 18 CO -0.00 0.61 -0.09 0.82 -1.07 0.00 0.00 179.97 180.23 2kyz h ILE 19 N 0.95 0.00 -0.56 2.04 5.03 -1.58 -3.10 117.51 120.30 2kyz h ILE 19 Ca 0.28 0.00 0.09 0.00 -0.12 0.00 0.00 64.86 65.12 2kyz h ILE 19 Cb -0.05 0.00 -0.07 0.00 -3.03 0.00 0.00 36.82 33.66 2kyz h ILE 19 CO -0.08 0.00 0.14 0.28 -0.68 0.00 0.00 178.15 177.81 2kyz h SER 20 N -0.26 0.06 0.50 1.72 0.02 -1.29 0.70 113.55 115.01 2kyz h SER 20 Ca -0.03 0.09 0.00 0.00 -0.84 0.00 0.00 61.79 61.02 2kyz h SER 20 Cb 0.20 0.11 0.00 0.00 0.14 0.00 0.00 62.40 62.85 2kyz h SER 20 CO 0.04 0.05 0.00 1.17 -1.14 0.00 0.00 176.83 176.95 2kyz n LYS 21 N -5.08 0.03 -0.03 3.45 4.81 0.32 -1.00 118.16 120.66 2kyz n LYS 21 Ca 0.07 0.30 -0.22 0.00 -0.87 0.00 0.00 58.31 57.60 2kyz n LYS 21 Cb 0.27 -1.57 -0.13 0.00 0.02 0.00 0.00 35.03 33.62 2kyz n LYS 21 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2kyz h ALA 22 N 2.42 0.30 -0.50 3.14 0.00 -0.85 -3.40 119.26 120.38 2kyz h ALA 22 Ca 0.00 -1.24 -0.01 0.00 0.00 0.00 0.00 54.91 53.67 2kyz h ALA 22 Cb 0.25 0.64 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 2kyz h ALA 22 CO 0.00 0.96 0.28 -0.07 0.00 0.00 0.00 179.25 180.43 2kyz h LEU 23 N -0.38 0.61 -0.76 0.00 3.38 0.44 -1.79 115.31 116.81 2kyz h LEU 23 Ca -0.36 -0.08 0.06 0.00 0.09 0.00 0.00 57.88 57.59 2kyz h LEU 23 Cb 1.72 -0.16 -0.06 0.00 0.09 0.00 0.00 40.66 42.26 2kyz h LEU 23 CO -0.01 0.51 0.45 -0.33 0.09 0.00 0.00 178.44 179.15 2kyz h GLU 24 N 0.66 0.81 0.00 1.13 4.39 -1.34 -0.76 114.58 119.48 2kyz h GLU 24 Ca 0.18 -0.05 -0.01 0.00 0.34 0.00 0.00 59.36 59.82 2kyz h GLU 24 Cb 0.03 -0.18 -0.00 0.00 -0.10 0.00 0.00 28.75 28.49 2kyz h GLU 24 CO -0.03 0.54 -0.03 0.93 -1.16 0.00 0.00 179.01 179.26 2kyz h GLU 25 N 0.84 0.00 0.00 2.33 5.08 -1.70 -3.15 114.58 117.98 2kyz h GLU 25 Ca 0.33 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.69 2kyz h GLU 25 Cb 0.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.41 2kyz h GLU 25 CO -0.17 0.03 0.00 -0.11 -1.00 0.00 0.00 179.01 177.76 2kyz n LEU 26 N -3.12 0.00 -0.02 1.33 0.00 -0.29 -4.88 117.00 110.02 2kyz n LEU 26 Ca 0.02 0.47 -0.00 0.00 0.00 0.00 0.00 56.01 56.50 2kyz n LEU 26 Cb 0.42 -0.47 -0.00 0.00 0.00 0.00 0.00 43.42 43.38 2kyz n LEU 26 CO 0.31 -0.20 -0.00 0.61 0.00 0.00 0.00 177.39 178.11 2kyz n GLY 27 N 0.22 0.37 3.67 -3.96 0.00 -1.19 -5.06 105.19 99.24 2kyz n GLY 27 Ca 0.05 -0.93 -0.30 0.00 0.00 0.00 0.00 46.02 44.84 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 -2.01 2.44 0.00 1.61 0.11 -1.21 -5.03 120.40 116.31 2kyz s VAL 28 Ca 0.00 0.14 0.00 0.00 -2.93 0.00 0.00 61.98 59.19 2kyz s VAL 28 Cb 0.00 -2.52 0.00 0.00 -1.53 0.00 0.00 36.38 32.33 2kyz s VAL 28 CO 0.00 -0.19 0.00 0.29 -3.33 0.00 0.00 175.10 171.87 2kyz n LYS 29 N -4.11 3.25 -3.68 1.54 4.76 -1.26 -4.94 118.16 113.72 2kyz n LYS 29 Ca 0.07 0.00 -0.15 0.00 -2.87 0.00 0.00 58.31 55.35 2kyz n LYS 29 Cb 0.55 -0.53 -0.15 0.00 -1.84 0.00 0.00 35.03 33.06 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 -0.71 0.51 0.27 4.39 0.01 -1.26 -5.08 114.94 113.08 2kyz s ASN 30 Ca 0.00 0.39 -0.16 0.00 -0.71 0.00 0.00 52.86 52.38 2kyz s ASN 30 Cb 0.00 0.36 0.01 0.00 0.41 0.00 0.00 41.25 42.03 2kyz s ASN 30 CO 0.00 -0.23 0.61 -0.72 -1.51 0.00 0.00 177.10 175.25 2kyz s TYR 31 N 2.13 0.11 0.06 2.20 1.13 -1.26 -0.83 117.35 120.90 2kyz s TYR 31 Ca 0.01 -0.53 -0.10 0.00 -1.41 0.00 0.00 57.07 55.03 2kyz s TYR 31 Cb -0.12 0.46 0.00 0.00 -1.10 0.00 0.00 41.96 41.20 2kyz s TYR 31 CO -0.06 -1.14 0.21 -1.21 -2.51 0.00 0.00 175.55 170.84 2kyz s GLU 32 N -3.86 0.78 -0.11 -3.49 2.02 -0.60 -4.94 118.70 108.51 2kyz s GLU 32 Ca 0.17 -0.74 -0.08 0.00 0.02 0.00 0.00 54.97 54.34 2kyz s GLU 32 Cb -0.03 0.32 0.03 0.00 0.10 0.00 0.00 34.13 34.55 2kyz s GLU 32 CO 0.09 -0.24 0.27 0.08 0.02 0.00 0.00 175.26 175.48 2kyz s VAL 33 N -3.07 -0.01 -0.02 2.63 1.01 -1.26 -1.13 120.40 118.55 2kyz s VAL 33 Ca -0.01 0.05 0.00 0.00 0.00 0.00 0.00 61.98 62.02 2kyz s VAL 33 Cb 0.01 -0.39 0.02 0.00 0.00 0.00 0.00 36.38 36.02 2kyz s VAL 33 CO -0.07 0.02 0.01 -0.55 0.00 0.00 0.00 175.10 174.51 2kyz s SER 34 N 0.57 0.21 0.04 3.32 0.15 -0.77 -5.02 113.70 112.20 2kyz s SER 34 Ca -0.04 -0.00 -0.20 0.00 0.70 0.00 0.00 55.95 56.42 2kyz s SER 34 Cb -0.05 -0.10 -0.15 0.00 -1.71 0.00 0.00 66.02 64.01 2kyz s SER 34 CO -0.03 -0.07 1.31 0.58 1.20 0.00 0.00 173.24 176.23 2kyz h VAL 35 N 5.87 1.36 -0.11 4.45 2.07 -1.89 -1.17 116.25 126.84 2kyz h VAL 35 Ca -0.38 -1.47 -0.00 0.00 0.82 0.00 0.00 66.70 65.68 2kyz h VAL 35 Cb 1.15 1.97 -0.01 0.00 -1.52 0.00 0.00 31.29 32.89 2kyz h VAL 35 CO 0.49 0.43 0.06 -0.33 0.02 0.00 0.00 177.57 178.24 2kyz h GLU 36 N 0.02 0.15 0.00 1.57 4.39 -1.96 -3.20 114.58 115.55 2kyz h GLU 36 Ca 0.01 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2kyz h GLU 36 Cb 0.80 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.42 2kyz h GLU 36 CO 0.05 0.16 -0.06 0.93 -1.16 0.00 0.00 179.01 178.93 2kyz h GLU 37 N 0.09 0.00 -6.32 2.33 4.39 -1.98 -3.47 114.58 109.62 2kyz h GLU 37 Ca 0.04 0.00 -0.49 0.00 0.34 0.00 0.00 59.36 59.25 2kyz h GLU 37 Cb 0.05 0.00 -0.16 0.00 -0.10 0.00 0.00 28.75 28.55 2kyz h GLU 37 CO -0.01 0.00 -0.73 1.63 -1.16 0.00 0.00 179.01 178.74 2kyz n LYS 38 N -2.40 -3.40 -4.32 2.33 5.02 -0.44 -4.95 118.16 110.00 2kyz n LYS 38 Ca 0.05 0.41 -0.24 0.00 -2.02 0.00 0.00 58.31 56.51 2kyz n LYS 38 Cb 0.45 -5.15 -0.12 0.00 -0.02 0.00 0.00 35.03 30.19 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 -6.61 1.22 0.15 1.97 1.02 -1.20 -1.28 119.74 115.00 2kyz s LYS 39 Ca 0.63 -1.27 0.08 0.00 0.02 0.00 0.00 55.97 55.43 2kyz s LYS 39 Cb -0.34 -1.45 -0.04 0.00 -0.52 0.00 0.00 37.83 35.47 2kyz s LYS 39 CO 0.78 0.33 -0.17 0.08 -0.92 0.00 0.00 175.35 175.45 2kyz s VAL 40 N -1.42 1.65 0.06 3.17 1.01 -0.46 -1.84 120.40 122.57 2kyz s VAL 40 Ca 0.11 -1.83 0.07 0.00 0.00 0.00 0.00 61.98 60.32 2kyz s VAL 40 Cb -0.09 -1.72 -0.03 0.00 0.00 0.00 0.00 36.38 34.54 2kyz s VAL 40 CO 0.05 -0.33 -0.18 -0.69 0.00 0.00 0.00 175.10 173.95 2kyz s VAL 41 N -2.02 1.48 -0.01 2.92 1.01 -0.28 -0.97 120.40 122.52 2kyz s VAL 41 Ca 0.13 -1.23 0.02 0.00 0.00 0.00 0.00 61.98 60.90 2kyz s VAL 41 Cb -0.06 -1.32 -0.00 0.00 0.00 0.00 0.00 36.38 35.00 2kyz s VAL 41 CO 0.05 0.05 -0.07 0.68 0.00 0.00 0.00 175.10 175.82 2kyz s VAL 42 N -0.93 0.59 -0.84 2.92 -7.23 -0.47 -1.55 120.40 112.89 2kyz s VAL 42 Ca 0.05 -0.29 -0.07 0.00 -1.81 0.00 0.00 61.98 59.86 2kyz s VAL 42 Cb -0.09 -0.51 0.21 0.00 0.56 0.00 0.00 36.38 36.55 2kyz s VAL 42 CO 0.02 0.18 0.74 -0.70 -0.31 0.00 0.00 175.10 175.03 2kyz s GLU 43 N 0.02 3.35 0.13 4.82 2.12 -0.01 -1.43 118.70 127.70 2kyz s GLU 43 Ca 0.00 -2.79 -0.04 0.00 0.36 0.00 0.00 54.97 52.50 2kyz s GLU 43 Cb -0.05 -4.16 -0.03 0.00 0.26 0.00 0.00 34.13 30.15 2kyz s GLU 43 CO -0.00 -1.24 0.13 -0.08 -0.54 0.00 0.00 175.26 173.53 2kyz s THR 44 N -0.47 0.11 -0.09 -1.70 -1.32 -0.75 -4.43 115.64 106.98 2kyz s THR 44 Ca 0.22 -1.67 -0.27 0.00 -1.21 0.00 0.00 61.69 58.76 2kyz s THR 44 Cb -0.12 -1.87 -0.24 0.00 -1.51 0.00 0.00 72.50 68.76 2kyz s THR 44 CO -0.08 -0.48 0.95 -0.33 -2.21 0.00 0.00 174.62 172.47 2kyz h GLU 45 N 2.78 0.03 -3.82 7.08 3.07 -1.96 -1.43 114.58 120.32 2kyz h GLU 45 Ca -0.34 -0.04 -0.79 0.00 -0.50 0.00 0.00 59.36 57.70 2kyz h GLU 45 Cb 1.20 0.01 -0.26 0.00 -0.84 0.00 0.00 28.75 28.87 2kyz h GLU 45 CO 0.56 0.86 0.52 1.21 -1.40 0.00 0.00 179.01 180.75 2kyz s ASN 46 N -6.11 7.17 0.26 1.42 3.04 -1.26 -4.69 114.94 114.77 2kyz s ASN 46 Ca -0.18 -3.30 -0.02 0.00 0.04 0.00 0.00 52.86 49.41 2kyz s ASN 46 Cb -0.01 -2.24 0.46 0.00 -1.54 0.00 0.00 41.25 37.92 2kyz s ASN 46 CO 0.70 -0.43 1.83 0.25 -3.04 0.00 0.00 177.10 176.41 2kyz h LEU 47 N 7.40 0.84 -1.35 3.21 5.85 -2.00 -2.69 115.31 126.57 2kyz h LEU 47 Ca 0.18 0.04 0.04 0.00 0.84 0.00 0.00 57.88 58.99 2kyz h LEU 47 Cb 0.91 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.77 2kyz h LEU 47 CO 1.00 0.48 0.47 -0.78 -0.34 0.00 0.00 178.44 179.27 2kyz h ASP 48 N 0.94 0.72 -0.87 1.25 3.58 -1.99 0.14 116.42 120.20 2kyz h ASP 48 Ca 0.44 -0.00 0.05 0.00 0.42 0.00 0.00 57.03 57.94 2kyz h ASP 48 Cb 0.37 -0.16 -0.05 0.00 1.72 0.00 0.00 39.33 41.21 2kyz h ASP 48 CO -0.24 0.48 0.57 -1.28 -2.88 0.00 0.00 179.24 175.89 2kyz h SER 49 N 0.83 0.89 0.12 2.28 0.87 -1.90 0.57 113.55 117.20 2kyz h SER 49 Ca 0.30 -0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.85 2kyz h SER 49 Cb 0.13 -0.19 0.00 0.00 -0.44 0.00 0.00 62.40 61.90 2kyz h SER 49 CO -0.09 0.59 -0.06 0.58 -0.53 0.00 0.00 176.83 177.32 2kyz h VAL 50 N 1.02 1.07 -0.77 2.23 2.07 -1.11 -2.17 116.25 118.59 2kyz h VAL 50 Ca 0.36 -1.07 0.02 0.00 0.82 0.00 0.00 66.70 66.83 2kyz h VAL 50 Cb 0.12 1.71 -0.04 0.00 -1.52 0.00 0.00 31.29 31.56 2kyz h VAL 50 CO -0.12 0.24 0.50 -0.07 0.02 0.00 0.00 177.57 178.14 2kyz h LEU 51 N -0.69 0.83 -0.31 2.57 3.38 -0.73 -0.72 115.31 119.65 2kyz h LEU 51 Ca -0.02 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 2kyz h LEU 51 Cb 0.52 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 2kyz h LEU 51 CO 0.03 0.58 0.11 0.50 0.09 0.00 0.00 178.44 179.75 2kyz h LYS 52 N 0.98 0.46 -0.86 1.13 3.64 -0.98 -0.88 116.57 120.06 2kyz h LYS 52 Ca 0.30 -0.09 0.10 0.00 -1.27 0.00 0.00 60.65 59.69 2kyz h LYS 52 Cb -0.03 -0.07 -0.08 0.00 -0.41 0.00 0.00 32.23 31.64 2kyz h LYS 52 CO -0.10 0.49 0.50 -0.22 -2.27 0.00 0.00 179.45 177.85 2kyz h LYS 53 N 0.34 0.80 0.05 1.90 1.63 -0.68 0.13 116.57 120.74 2kyz h LYS 53 Ca 0.10 -0.05 -0.00 0.00 -0.85 0.00 0.00 60.65 59.85 2kyz h LYS 53 Cb 0.20 -0.18 0.00 0.00 -0.60 0.00 0.00 32.23 31.65 2kyz h LYS 53 CO -0.01 0.53 -0.02 -0.07 -3.45 0.00 0.00 179.45 176.43 2kyz h LEU 54 N 0.83 -0.05 -1.38 5.20 -0.00 -0.61 -1.87 115.31 117.42 2kyz h LEU 54 Ca 0.42 -0.14 -0.02 0.00 -0.00 0.00 0.00 57.88 58.13 2kyz h LEU 54 Cb 0.40 0.01 -0.02 0.00 -0.00 0.00 0.00 40.66 41.05 2kyz h LEU 54 CO -0.26 0.11 0.16 -0.33 -0.00 0.00 0.00 178.44 178.12 2kyz h GLU 55 N -0.22 0.58 0.00 1.13 5.08 -0.71 -1.05 114.58 119.39 2kyz h GLU 55 Ca -0.01 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 2kyz h GLU 55 Cb 0.20 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.34 2kyz h GLU 55 CO 0.01 0.49 0.00 0.39 -1.00 0.00 0.00 179.01 178.90 2kyz n GLU 56 N -4.37 0.37 -0.42 2.33 -0.58 0.40 -2.18 120.64 116.18 2kyz n GLU 56 Ca 0.03 0.03 0.10 0.00 -0.42 0.00 0.00 57.16 56.90 2kyz n GLU 56 Cb 0.15 -1.50 0.31 0.00 -0.57 0.00 0.00 31.44 29.83 2kyz n GLU 56 CO 0.00 0.00 0.00 0.44 -0.48 0.00 0.00 177.13 177.09 2kyz n ILE 57 N -1.29 1.29 -1.13 -3.67 -5.35 -0.69 -4.95 119.36 103.57 2kyz n ILE 57 Ca 0.12 -1.08 -0.04 0.00 -0.27 0.00 0.00 62.75 61.48 2kyz n ILE 57 Cb 0.22 0.37 -0.02 0.00 -1.74 0.00 0.00 39.64 38.47 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 1.28 -3.54 -3.94 7.28 2.03 -0.93 -5.02 116.55 113.71 2kyz n ASP 58 Ca 0.23 0.11 -0.32 0.00 0.52 0.00 0.00 54.79 55.33 2kyz n ASP 58 Cb 0.68 -1.43 -0.08 0.00 -0.72 0.00 0.00 41.12 39.57 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 -2.87 3.72 -2.06 -0.67 4.02 -0.48 -5.00 117.16 113.81 2kyz n TYR 59 Ca -0.04 -4.14 -0.42 0.00 -0.01 0.00 0.00 57.90 53.28 2kyz n TYR 59 Cb 0.15 -0.88 -0.03 0.00 -0.02 0.00 0.00 39.34 38.56 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 -1.62 4.21 0.12 -0.72 0.04 -1.26 -3.73 135.00 132.03 2kyz s PRO 60 Ca 0.28 2.14 -0.30 0.00 0.04 0.00 0.00 61.00 63.16 2kyz s PRO 60 Cb -0.03 -3.82 -0.07 0.00 0.04 0.00 0.00 34.50 30.62 2kyz s PRO 60 CO -0.12 -0.77 1.20 0.08 0.04 0.00 0.00 177.00 177.43 2kyz s VAL 61 N 3.44 3.80 -0.03 -0.36 1.01 -1.26 -4.74 120.40 122.26 2kyz s VAL 61 Ca 0.70 1.39 -0.22 0.00 0.00 0.00 0.00 61.98 63.85 2kyz s VAL 61 Cb -0.33 -3.89 -0.16 0.00 0.00 0.00 0.00 36.38 32.00 2kyz s VAL 61 CO 0.28 0.16 0.99 -0.08 0.00 0.00 0.00 175.10 176.46 2kyz h GLU 62 N 6.06 -0.27 -3.53 2.72 4.81 -1.57 -3.48 114.58 119.31 2kyz h GLU 62 Ca -0.43 0.02 -0.07 0.00 -0.13 0.00 0.00 59.36 58.75 2kyz h GLU 62 Cb 1.21 0.06 -0.07 0.00 0.63 0.00 0.00 28.75 30.59 2kyz h GLU 62 CO 0.78 0.11 -0.01 -1.12 -0.73 0.00 0.00 179.01 178.04 2kyz s SER 63 N -5.33 0.10 0.20 1.04 0.01 -1.26 -5.02 113.70 103.43 2kyz s SER 63 Ca -0.13 -1.03 -0.03 0.00 1.31 0.00 0.00 55.95 56.08 2kyz s SER 63 Cb 0.01 0.67 -0.03 0.00 0.21 0.00 0.00 66.02 66.88 2kyz s SER 63 CO 0.50 -1.30 0.17 -0.72 0.41 0.00 0.00 173.24 172.30 2kyz s TYR 64 N -3.52 0.99 0.04 2.43 -0.85 -1.26 -0.51 117.35 114.67 2kyz s TYR 64 Ca 0.21 -1.26 -0.27 0.00 -0.52 0.00 0.00 57.07 55.23 2kyz s TYR 64 Cb -0.02 -0.44 0.08 0.00 0.38 0.00 0.00 41.96 41.96 2kyz s TYR 64 CO 0.11 -0.67 0.68 1.14 -1.52 0.00 0.00 175.55 175.29 2kyz s GLN 65 N -4.12 1.11 0.58 -3.49 -2.07 -0.65 -5.00 119.66 106.02 2kyz s GLN 65 Ca 0.34 -0.11 -0.18 0.00 -1.82 0.00 0.00 55.36 53.60 2kyz s GLN 65 Cb 0.06 0.52 -0.04 0.00 -1.09 0.00 0.00 33.01 32.46 2kyz s GLN 65 CO 0.10 -0.42 1.12 -2.00 -1.32 0.00 0.00 175.29 172.77 2kyz s GLU 66 N -2.44 3.17 0.00 9.60 2.12 -1.26 -1.73 118.70 128.16 2kyz s GLU 66 Ca -0.04 1.53 0.00 0.00 0.36 0.00 0.00 54.97 56.82 2kyz s GLU 66 Cb -0.01 -1.99 0.00 0.00 0.26 0.00 0.00 34.13 32.40 2kyz s GLU 66 CO -0.02 -0.98 0.00 1.55 -0.54 0.00 0.00 175.26 175.27