#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 1.23 -0.01 0.03 1.70 -1.26 -1.79 118.95 118.85 2kyz s ARG 2 Ca 0.00 -1.63 -0.11 0.00 -0.47 0.00 0.00 55.73 53.52 2kyz s ARG 2 Cb 0.00 -0.16 0.01 0.00 -0.57 0.00 0.00 34.95 34.23 2kyz s ARG 2 CO 0.00 -0.24 0.22 0.71 -1.08 0.00 0.00 175.30 174.91 2kyz s TYR 3 N -3.79 -0.07 -0.32 5.89 2.02 -1.09 -1.89 117.35 118.10 2kyz s TYR 3 Ca 0.32 0.09 -0.10 0.00 -0.37 0.00 0.00 57.07 57.00 2kyz s TYR 3 Cb 0.07 0.02 -0.00 0.00 -0.40 0.00 0.00 41.96 41.65 2kyz s TYR 3 CO 0.09 -0.32 0.17 0.08 -1.57 0.00 0.00 175.55 174.00 2kyz s VAL 4 N -1.25 4.70 0.41 0.71 1.01 0.02 -3.79 120.40 122.20 2kyz s VAL 4 Ca -0.13 -0.45 -0.03 0.00 0.00 0.00 0.00 61.98 61.37 2kyz s VAL 4 Cb -0.06 -3.43 -0.04 0.00 0.00 0.00 0.00 36.38 32.85 2kyz s VAL 4 CO 0.03 0.02 0.67 -0.76 0.00 0.00 0.00 175.10 175.05 2kyz s LEU 5 N 1.62 3.83 -0.29 3.92 1.02 -0.76 -1.56 118.68 126.46 2kyz s LEU 5 Ca 0.04 0.72 0.03 0.00 0.02 0.00 0.00 54.13 54.95 2kyz s LEU 5 Cb -0.17 -3.62 0.07 0.00 0.02 0.00 0.00 46.19 42.49 2kyz s LEU 5 CO 0.07 -0.42 -0.05 -0.47 0.02 0.00 0.00 176.35 175.50 2kyz s TYR 6 N -2.49 3.40 -0.65 0.29 5.04 0.65 -3.13 117.35 120.45 2kyz s TYR 6 Ca 0.44 -2.55 0.04 0.00 -2.44 0.00 0.00 57.07 52.57 2kyz s TYR 6 Cb -0.10 -2.28 0.16 0.00 0.35 0.00 0.00 41.96 40.09 2kyz s TYR 6 CO 0.39 -0.90 0.43 0.08 -1.34 0.00 0.00 175.55 174.21 2kyz s VAL 7 N 1.05 2.87 0.40 3.14 1.01 -0.91 -0.19 120.40 127.77 2kyz s VAL 7 Ca -0.01 -3.93 0.39 0.00 0.00 0.00 0.00 61.98 58.42 2kyz s VAL 7 Cb -0.20 -2.91 0.39 0.00 0.00 0.00 0.00 36.38 33.66 2kyz s VAL 7 CO -0.06 -0.94 2.17 1.55 0.00 0.00 0.00 175.10 177.82 2kyz h PRO 8 N 5.82 0.00 0.00 2.72 0.13 -1.85 -2.27 132.00 136.54 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 0.81 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.94 2kyz h PRO 8 CO 0.71 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.23 2kyz n ASP 9 N -2.89 0.36 -0.42 1.44 9.92 -1.26 -1.89 116.55 121.80 2kyz n ASP 9 Ca -0.02 0.64 0.00 0.00 -0.53 0.00 0.00 54.79 54.88 2kyz n ASP 9 Cb 0.09 -0.69 0.00 0.00 -0.64 0.00 0.00 41.12 39.88 2kyz n ASP 9 CO 0.00 0.00 0.00 -0.38 0.13 0.00 0.00 177.20 176.95 2kyz n ILE 10 N -1.95 0.00 -0.36 0.53 5.41 -0.85 -4.23 119.36 117.91 2kyz n ILE 10 Ca 0.00 0.00 0.32 0.00 1.00 0.00 0.00 62.75 64.07 2kyz n ILE 10 Cb 0.08 -0.40 0.65 0.00 -0.71 0.00 0.00 39.64 39.26 2kyz n ILE 10 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.55 176.83 2kyz h SER 11 N 0.05 0.21 -2.95 4.38 0.02 -1.64 -3.41 113.55 110.21 2kyz h SER 11 Ca 0.00 0.05 -0.61 0.00 -0.84 0.00 0.00 61.79 60.39 2kyz h SER 11 Cb 0.39 0.02 -0.12 0.00 0.14 0.00 0.00 62.40 62.84 2kyz h SER 11 CO 0.00 0.01 -0.68 0.00 -1.14 0.00 0.00 176.83 175.02 2kyz h ASN 13 N 2.81 1.05 -0.61 0.00 2.35 -1.97 -1.79 115.58 117.42 2kyz h ASN 13 Ca -0.47 -0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.23 2kyz h ASN 13 Cb 1.20 -0.23 -0.03 0.00 0.05 0.00 0.00 38.32 39.31 2kyz h ASN 13 CO 0.57 0.70 0.19 -0.74 -1.65 0.00 0.00 177.43 176.51 2kyz h HIS 14 N 1.21 0.98 -0.43 1.19 2.76 -1.96 -3.17 115.15 115.72 2kyz h HIS 14 Ca 0.40 -0.10 -0.00 0.00 -2.20 0.00 0.00 60.37 58.47 2kyz h HIS 14 Cb 0.06 -0.29 -0.02 0.00 1.55 0.00 0.00 27.41 28.71 2kyz h HIS 14 CO -0.00 0.81 0.25 0.00 -1.30 0.00 0.00 177.93 177.69 2kyz h LYS 16 N 0.59 -0.10 -0.02 0.00 3.64 -1.49 -1.44 116.57 117.75 2kyz h LYS 16 Ca 0.16 0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.51 2kyz h LYS 16 Cb -0.01 0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.82 2kyz h LYS 16 CO -0.03 -0.07 -0.16 0.52 -2.27 0.00 0.00 179.45 177.45 2kyz h MET 17 N -0.10 0.03 -0.64 1.90 2.86 -1.47 -2.84 114.93 114.66 2kyz h MET 17 Ca 0.24 -0.01 0.09 0.00 -2.06 0.00 0.00 59.70 57.97 2kyz h MET 17 Cb 0.49 -0.01 -0.07 0.00 0.06 0.00 0.00 31.60 32.07 2kyz h MET 17 CO -0.60 0.19 0.29 0.00 1.06 0.00 0.00 176.91 177.85 2kyz h ARG 18 N 0.03 0.49 0.94 1.72 3.08 -1.23 -1.84 114.38 117.57 2kyz h ARG 18 Ca 0.01 -0.03 -0.05 0.00 0.07 0.00 0.00 59.98 59.98 2kyz h ARG 18 Cb 0.30 -0.11 0.01 0.00 0.08 0.00 0.00 29.97 30.25 2kyz h ARG 18 CO 0.02 0.32 -0.45 0.82 -1.07 0.00 0.00 179.97 179.62 2kyz h ILE 19 N 0.51 0.00 -0.51 2.04 5.03 -1.55 -3.26 117.51 119.77 2kyz h ILE 19 Ca 0.32 -0.05 0.01 0.00 -0.12 0.00 0.00 64.86 65.02 2kyz h ILE 19 Cb 0.35 0.00 -0.03 0.00 -3.03 0.00 0.00 36.82 34.11 2kyz h ILE 19 CO -0.27 0.00 0.33 0.28 -0.68 0.00 0.00 178.15 177.81 2kyz h SER 20 N -1.30 0.57 -0.52 1.72 0.02 -1.21 -0.36 113.55 112.47 2kyz h SER 20 Ca -0.13 -0.01 -0.00 0.00 -0.84 0.00 0.00 61.79 60.81 2kyz h SER 20 Cb 0.96 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 63.34 2kyz h SER 20 CO 0.21 0.41 0.32 0.50 -1.14 0.00 0.00 176.83 177.13 2kyz h LYS 21 N 0.68 0.70 -0.21 3.45 3.64 -1.52 -0.82 116.57 122.49 2kyz h LYS 21 Ca 0.19 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.50 2kyz h LYS 21 Cb -0.06 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 31.59 2kyz h LYS 21 CO -0.05 0.50 0.07 0.00 -2.27 0.00 0.00 179.45 177.70 2kyz h ALA 22 N 1.16 1.73 0.21 5.00 0.00 -1.28 -1.71 119.26 124.37 2kyz h ALA 22 Ca 0.19 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 2kyz h ALA 22 Cb -0.03 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.67 2kyz h ALA 22 CO -0.04 0.22 -0.10 -0.07 0.00 0.00 0.00 179.25 179.26 2kyz h LEU 23 N 0.29 -0.24 -1.36 0.00 3.38 0.05 -0.63 115.31 116.79 2kyz h LEU 23 Ca 0.07 -0.26 0.01 0.00 0.09 0.00 0.00 57.88 57.79 2kyz h LEU 23 Cb 0.09 0.06 -0.03 0.00 0.09 0.00 0.00 40.66 40.87 2kyz h LEU 23 CO -0.01 0.17 0.44 -0.33 0.09 0.00 0.00 178.44 178.81 2kyz h GLU 24 N -0.71 0.85 -0.21 1.13 5.08 -1.06 -0.80 114.58 118.85 2kyz h GLU 24 Ca -0.03 -0.05 -0.17 0.00 -1.00 0.00 0.00 59.36 58.11 2kyz h GLU 24 Cb 0.49 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 29.55 2kyz h GLU 24 CO 0.05 0.56 -0.57 0.93 -1.00 0.00 0.00 179.01 178.98 2kyz h GLU 25 N 0.88 0.67 -0.10 2.33 4.39 -1.35 -2.68 114.58 118.72 2kyz h GLU 25 Ca 0.25 -0.44 -0.01 0.00 0.34 0.00 0.00 59.36 59.50 2kyz h GLU 25 Cb -0.08 0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.62 2kyz h GLU 25 CO -0.06 1.05 0.03 1.25 -1.16 0.00 0.00 179.01 180.13 2kyz h LEU 26 N 0.51 0.12 -0.15 1.33 5.85 -0.48 -3.47 115.31 119.02 2kyz h LEU 26 Ca 0.00 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2kyz h LEU 26 Cb 1.15 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.15 2kyz h LEU 26 CO 0.11 0.12 0.00 0.61 -0.34 0.00 0.00 178.44 178.95 2kyz n GLY 27 N -1.41 1.25 3.26 3.75 0.00 -0.38 -5.08 105.19 106.57 2kyz n GLY 27 Ca -0.01 -0.20 -0.36 0.00 0.00 0.00 0.00 46.02 45.45 2kyz n GLY 27 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2kyz n VAL 28 N -1.12 0.43 0.00 1.61 0.31 -0.75 -4.99 118.33 113.82 2kyz n VAL 28 Ca 0.00 -0.39 0.00 0.00 -0.01 0.00 0.00 64.34 63.94 2kyz n VAL 28 Cb 0.13 -0.36 0.00 0.00 -0.91 0.00 0.00 33.84 32.70 2kyz n VAL 28 CO 0.00 0.00 0.00 2.29 -1.32 0.00 0.00 176.83 177.80 2kyz n LYS 29 N 0.39 2.61 -3.81 5.55 2.85 -1.26 -4.84 118.16 119.65 2kyz n LYS 29 Ca 0.05 0.00 -0.13 0.00 -1.05 0.00 0.00 58.31 57.18 2kyz n LYS 29 Cb 0.53 -0.85 -0.13 0.00 -0.65 0.00 0.00 35.03 33.92 2kyz n LYS 29 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 177.40 176.55 2kyz s ASN 30 N -2.21 -0.10 0.01 -5.58 0.01 -1.26 -5.07 114.94 100.73 2kyz s ASN 30 Ca 0.00 0.23 -0.30 0.00 -0.71 0.00 0.00 52.86 52.09 2kyz s ASN 30 Cb 0.00 0.20 0.11 0.00 0.41 0.00 0.00 41.25 41.97 2kyz s ASN 30 CO 0.00 -0.07 1.20 -0.72 -1.51 0.00 0.00 177.10 176.00 2kyz s TYR 31 N 0.40 -0.07 0.01 2.20 1.13 -1.26 -0.46 117.35 119.30 2kyz s TYR 31 Ca -0.03 -0.07 -0.19 0.00 -1.41 0.00 0.00 57.07 55.38 2kyz s TYR 31 Cb -0.04 0.56 0.04 0.00 -1.10 0.00 0.00 41.96 41.42 2kyz s TYR 31 CO -0.02 -0.39 0.41 -1.21 -2.51 0.00 0.00 175.55 171.83 2kyz s GLU 32 N -2.63 0.86 0.03 -3.49 2.02 0.15 -4.95 118.70 110.69 2kyz s GLU 32 Ca 0.13 -0.23 0.02 0.00 0.02 0.00 0.00 54.97 54.91 2kyz s GLU 32 Cb 0.03 0.39 -0.02 0.00 0.10 0.00 0.00 34.13 34.63 2kyz s GLU 32 CO -0.03 -0.28 -0.07 0.08 0.02 0.00 0.00 175.26 174.99 2kyz s VAL 33 N -1.96 0.50 -0.01 2.63 1.01 -1.26 -1.06 120.40 120.25 2kyz s VAL 33 Ca -0.09 -0.87 0.00 0.00 0.00 0.00 0.00 61.98 61.02 2kyz s VAL 33 Cb -0.02 -0.54 0.02 0.00 0.00 0.00 0.00 36.38 35.84 2kyz s VAL 33 CO 0.01 -0.27 0.01 -0.55 0.00 0.00 0.00 175.10 174.31 2kyz s SER 34 N -1.23 0.13 -0.11 3.32 0.15 -0.09 -4.98 113.70 110.88 2kyz s SER 34 Ca -0.07 0.01 -0.23 0.00 0.70 0.00 0.00 55.95 56.36 2kyz s SER 34 Cb -0.08 -0.07 -0.20 0.00 -1.71 0.00 0.00 66.02 63.96 2kyz s SER 34 CO 0.00 -0.07 0.70 0.58 1.20 0.00 0.00 173.24 175.65 2kyz h VAL 35 N 5.83 1.34 -0.79 4.45 2.07 -1.87 -2.04 116.25 125.24 2kyz h VAL 35 Ca -0.37 -1.87 -0.04 0.00 0.82 0.00 0.00 66.70 65.24 2kyz h VAL 35 Cb 1.16 2.47 -0.03 0.00 -1.52 0.00 0.00 31.29 33.37 2kyz h VAL 35 CO 0.49 0.43 0.32 -0.33 0.02 0.00 0.00 177.57 178.50 2kyz h GLU 36 N -0.94 1.18 0.00 1.57 5.08 -1.91 -2.75 114.58 116.80 2kyz h GLU 36 Ca -0.00 -0.21 0.00 0.00 -1.00 0.00 0.00 59.36 58.15 2kyz h GLU 36 Cb 0.73 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.79 2kyz h GLU 36 CO 0.00 0.95 -0.42 0.39 -1.00 0.00 0.00 179.01 178.93 2kyz n GLU 37 N -4.29 0.27 -2.94 2.33 1.02 -1.26 -4.94 120.64 110.84 2kyz n GLU 37 Ca 0.07 0.12 -0.20 0.00 -0.02 0.00 0.00 57.16 57.14 2kyz n GLU 37 Cb 0.18 -1.72 0.01 0.00 -0.02 0.00 0.00 31.44 29.89 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 -2.14 -3.31 -4.28 3.49 5.02 -0.78 -4.98 118.16 111.18 2kyz n LYS 38 Ca 0.04 0.66 -0.16 0.00 -2.02 0.00 0.00 58.31 56.83 2kyz n LYS 38 Cb 0.43 -5.38 -0.10 0.00 -0.02 0.00 0.00 35.03 29.97 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 -5.57 1.15 0.04 1.97 1.02 -1.14 -2.13 119.74 115.07 2kyz s LYS 39 Ca 0.23 -1.47 -0.00 0.00 0.02 0.00 0.00 55.97 54.74 2kyz s LYS 39 Cb -0.11 -0.83 -0.03 0.00 -0.52 0.00 0.00 37.83 36.33 2kyz s LYS 39 CO 0.28 0.13 -0.03 0.08 -0.92 0.00 0.00 175.35 174.88 2kyz s VAL 40 N -3.06 0.23 -0.02 3.17 1.01 -1.18 -0.91 120.40 119.62 2kyz s VAL 40 Ca 0.18 -1.47 0.03 0.00 0.00 0.00 0.00 61.98 60.72 2kyz s VAL 40 Cb 0.00 -1.05 -0.00 0.00 0.00 0.00 0.00 36.38 35.33 2kyz s VAL 40 CO 0.03 -0.79 -0.12 -0.69 0.00 0.00 0.00 175.10 173.53 2kyz s VAL 41 N -2.94 0.98 0.16 2.92 1.01 -0.22 -1.84 120.40 120.47 2kyz s VAL 41 Ca -0.01 -0.49 0.07 0.00 0.00 0.00 0.00 61.98 61.55 2kyz s VAL 41 Cb 0.01 -0.85 -0.04 0.00 0.00 0.00 0.00 36.38 35.50 2kyz s VAL 41 CO -0.06 0.29 -0.02 0.68 0.00 0.00 0.00 175.10 175.99 2kyz s VAL 42 N 0.02 3.69 -0.64 2.92 -7.23 -1.25 -0.68 120.40 117.24 2kyz s VAL 42 Ca -0.01 -1.37 0.03 0.00 -1.81 0.00 0.00 61.98 58.83 2kyz s VAL 42 Cb -0.08 -2.83 0.16 0.00 0.56 0.00 0.00 36.38 34.19 2kyz s VAL 42 CO 0.01 -0.06 0.42 -0.70 -0.31 0.00 0.00 175.10 174.46 2kyz s GLU 43 N -2.78 2.35 -0.28 4.82 2.12 0.39 -2.66 118.70 122.66 2kyz s GLU 43 Ca 0.26 -2.98 -0.19 0.00 0.36 0.00 0.00 54.97 52.43 2kyz s GLU 43 Cb -0.10 -3.46 0.10 0.00 0.26 0.00 0.00 34.13 30.94 2kyz s GLU 43 CO 0.18 -1.20 0.83 -0.08 -0.54 0.00 0.00 175.26 174.45 2kyz s THR 44 N -0.85 0.00 0.44 -1.70 -1.32 -0.74 -4.28 115.64 107.19 2kyz s THR 44 Ca 0.21 0.00 0.22 0.00 -1.21 0.00 0.00 61.69 60.92 2kyz s THR 44 Cb -0.15 -1.00 0.25 0.00 -1.51 0.00 0.00 72.50 70.09 2kyz s THR 44 CO -0.08 0.00 2.05 1.05 -2.21 0.00 0.00 174.62 175.43 2kyz h GLU 45 N 5.98 0.00 -1.96 7.08 4.11 -1.96 -3.32 114.58 124.50 2kyz h GLU 45 Ca -0.29 0.00 -0.43 0.00 0.07 0.00 0.00 59.36 58.71 2kyz h GLU 45 Cb 1.20 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 30.29 2kyz h GLU 45 CO 0.14 0.14 0.26 -1.71 0.07 0.00 0.00 179.01 177.91 2kyz n ASN 46 N -3.92 6.26 -0.29 3.06 5.15 -1.26 -4.65 115.26 119.60 2kyz n ASN 46 Ca -0.02 -3.07 0.13 0.00 -0.60 0.00 0.00 54.58 51.02 2kyz n ASN 46 Cb 0.23 -1.25 0.38 0.00 -0.53 0.00 0.00 39.78 38.61 2kyz n ASN 46 CO 0.00 0.00 0.00 0.25 1.40 0.00 0.00 177.26 178.91 2kyz h LEU 47 N 3.99 0.66 -0.67 1.20 5.85 -2.00 -0.72 115.31 123.61 2kyz h LEU 47 Ca 0.35 0.06 0.10 0.00 0.84 0.00 0.00 57.88 59.23 2kyz h LEU 47 Cb 0.87 -0.07 -0.08 0.00 0.37 0.00 0.00 40.66 41.75 2kyz h LEU 47 CO 0.75 0.29 0.28 -0.78 -0.34 0.00 0.00 178.44 178.65 2kyz h ASP 48 N 0.67 0.31 -0.17 1.25 3.58 -1.95 0.83 116.42 120.95 2kyz h ASP 48 Ca 0.49 0.08 -0.07 0.00 0.42 0.00 0.00 57.03 57.95 2kyz h ASP 48 Cb 0.85 0.04 -0.02 0.00 1.72 0.00 0.00 39.33 41.93 2kyz h ASP 48 CO -0.25 0.17 -0.12 -1.28 -2.88 0.00 0.00 179.24 174.88 2kyz h SER 49 N 0.48 0.52 0.01 2.28 0.87 -1.53 -0.86 113.55 115.32 2kyz h SER 49 Ca 0.35 -0.14 -0.00 0.00 -1.23 0.00 0.00 61.79 60.77 2kyz h SER 49 Cb 0.43 -0.14 0.00 0.00 -0.44 0.00 0.00 62.40 62.25 2kyz h SER 49 CO -0.32 0.68 -0.00 0.58 -0.53 0.00 0.00 176.83 177.24 2kyz h VAL 50 N 0.50 1.24 -0.66 2.23 2.07 -0.97 -0.02 116.25 120.64 2kyz h VAL 50 Ca 0.09 -0.73 -0.00 0.00 0.82 0.00 0.00 66.70 66.87 2kyz h VAL 50 Cb 0.51 1.73 -0.03 0.00 -1.52 0.00 0.00 31.29 31.98 2kyz h VAL 50 CO 0.03 0.19 0.39 -0.07 0.02 0.00 0.00 177.57 178.13 2kyz h LEU 51 N -0.33 0.78 0.58 2.57 3.38 -0.63 0.57 115.31 122.24 2kyz h LEU 51 Ca -0.00 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.91 2kyz h LEU 51 Cb 0.32 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 2kyz h LEU 51 CO 0.00 0.61 -0.48 0.11 0.09 0.00 0.00 178.44 178.77 2kyz h LYS 52 N 0.90 -1.00 -0.74 1.13 1.79 -1.10 -1.65 116.57 115.92 2kyz h LYS 52 Ca 0.24 0.07 0.08 0.00 -2.18 0.00 0.00 60.65 58.85 2kyz h LYS 52 Cb -0.03 0.23 -0.05 0.00 -1.58 0.00 0.00 32.23 30.80 2kyz h LYS 52 CO -0.04 -0.66 0.48 -0.22 -1.08 0.00 0.00 179.45 177.92 2kyz h LYS 53 N -1.03 0.69 0.38 3.15 1.63 0.14 0.47 116.57 122.00 2kyz h LYS 53 Ca -0.07 -0.04 -0.02 0.00 -0.85 0.00 0.00 60.65 59.67 2kyz h LYS 53 Cb 0.87 -0.16 0.00 0.00 -0.60 0.00 0.00 32.23 32.35 2kyz h LYS 53 CO -0.00 0.46 -0.18 -0.07 -3.45 0.00 0.00 179.45 176.20 2kyz h LEU 54 N 0.72 -0.43 -1.30 5.20 -0.00 -0.82 -2.78 115.31 115.89 2kyz h LEU 54 Ca 0.33 -0.08 -0.07 0.00 -0.00 0.00 0.00 57.88 58.06 2kyz h LEU 54 Cb 0.34 0.11 -0.01 0.00 -0.00 0.00 0.00 40.66 41.11 2kyz h LEU 54 CO -0.11 -0.18 -0.30 -0.08 -0.00 0.00 0.00 178.44 177.77 2kyz h GLU 55 N -0.68 0.08 0.00 1.13 4.81 -0.30 -1.66 114.58 117.95 2kyz h GLU 55 Ca -0.05 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.14 2kyz h GLU 55 Cb 0.49 -0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.86 2kyz h GLU 55 CO 0.09 0.38 -0.06 0.93 -0.73 0.00 0.00 179.01 179.61 2kyz h GLU 56 N 0.07 0.00 -0.66 1.92 4.39 -0.96 -0.22 114.58 119.13 2kyz h GLU 56 Ca 0.01 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.71 2kyz h GLU 56 Cb 0.57 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.22 2kyz h GLU 56 CO 0.04 0.06 0.00 0.44 -1.16 0.00 0.00 179.01 178.39 2kyz n ILE 57 N -3.19 1.21 -1.17 3.13 -5.35 -0.96 -4.90 119.36 108.13 2kyz n ILE 57 Ca 0.00 -0.70 -0.05 0.00 -0.27 0.00 0.00 62.75 61.73 2kyz n ILE 57 Cb 0.32 -0.17 -0.02 0.00 -1.74 0.00 0.00 39.64 38.03 2kyz n ILE 57 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 2kyz n ASP 58 N 0.46 -3.53 -4.00 7.28 8.00 -0.10 -4.99 116.55 119.67 2kyz n ASP 58 Ca 0.15 0.12 -0.32 0.00 0.71 0.00 0.00 54.79 55.44 2kyz n ASP 58 Cb 0.64 -1.51 -0.11 0.00 -0.02 0.00 0.00 41.12 40.13 2kyz n ASP 58 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2kyz s TYR 59 N -2.18 3.54 -0.22 1.24 1.51 -0.67 -4.99 117.35 115.58 2kyz s TYR 59 Ca 0.00 -3.11 -0.29 0.00 -1.01 0.00 0.00 57.07 52.66 2kyz s TYR 59 Cb 0.00 -2.96 -0.02 0.00 -0.11 0.00 0.00 41.96 38.86 2kyz s TYR 59 CO 0.00 -0.69 1.60 -1.25 -1.11 0.00 0.00 175.55 174.10 2kyz s PRO 60 N -0.93 3.80 0.29 -1.71 0.04 -1.26 -3.08 135.00 132.14 2kyz s PRO 60 Ca 0.22 1.64 -0.30 0.00 0.04 0.00 0.00 61.00 62.61 2kyz s PRO 60 Cb -0.13 -4.03 -0.11 0.00 0.04 0.00 0.00 34.50 30.28 2kyz s PRO 60 CO -0.10 -1.29 1.48 0.54 0.04 0.00 0.00 177.00 177.68 2kyz s VAL 61 N 5.16 2.40 0.04 -0.36 0.11 -1.26 -4.73 120.40 121.75 2kyz s VAL 61 Ca 0.71 0.35 -0.28 0.00 -2.93 0.00 0.00 61.98 59.82 2kyz s VAL 61 Cb -0.24 -3.22 -0.17 0.00 -1.53 0.00 0.00 36.38 31.21 2kyz s VAL 61 CO 0.29 0.06 1.37 -0.08 -3.33 0.00 0.00 175.10 173.41 2kyz h GLU 62 N 4.58 -0.69 0.00 1.54 4.81 -0.96 -3.49 114.58 120.37 2kyz h GLU 62 Ca -0.47 0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.81 2kyz h GLU 62 Cb 1.22 0.16 0.00 0.00 0.63 0.00 0.00 28.75 30.76 2kyz h GLU 62 CO 0.75 -0.39 0.21 -1.13 -0.73 0.00 0.00 179.01 177.72 2kyz n SER 63 N -5.33 -1.41 -3.25 1.04 3.41 -1.25 -5.00 113.62 101.84 2kyz n SER 63 Ca -0.12 -1.94 -0.19 0.00 -0.26 0.00 0.00 58.87 56.36 2kyz n SER 63 Cb 0.32 2.34 -0.06 0.00 -0.26 0.00 0.00 64.21 66.55 2kyz n SER 63 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2kyz n TYR 64 N -0.36 -0.06 -3.59 7.33 4.11 -1.26 -0.25 117.16 123.07 2kyz n TYR 64 Ca -0.05 -2.12 -0.16 0.00 -0.00 0.00 0.00 57.90 55.57 2kyz n TYR 64 Cb 0.38 0.05 -0.07 0.00 -0.00 0.00 0.00 39.34 39.70 2kyz n TYR 64 CO 0.00 0.00 0.00 1.14 -0.00 0.00 0.00 176.86 178.00 2kyz s GLN 65 N -3.20 0.92 0.34 -3.48 -2.07 -0.60 -4.95 119.66 106.61 2kyz s GLN 65 Ca 0.20 0.67 -0.28 0.00 -1.82 0.00 0.00 55.36 54.13 2kyz s GLN 65 Cb 0.01 0.44 -0.10 0.00 -1.09 0.00 0.00 33.01 32.27 2kyz s GLN 65 CO 0.14 -0.19 1.26 -2.00 -1.32 0.00 0.00 175.29 173.18 2kyz s GLU 66 N -0.29 4.32 0.00 9.60 2.12 -1.26 -0.80 118.70 132.39 2kyz s GLU 66 Ca -0.05 2.11 0.00 0.00 0.36 0.00 0.00 54.97 57.40 2kyz s GLU 66 Cb -0.03 -3.01 0.00 0.00 0.26 0.00 0.00 34.13 31.35 2kyz s GLU 66 CO 0.05 -0.18 0.00 1.33 -0.54 0.00 0.00 175.26 175.92