#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 1.42 -0.07 0.03 1.70 -1.26 -1.50 118.95 119.27 2kyz s ARG 2 Ca 0.00 -1.53 -0.03 0.00 -0.47 0.00 0.00 55.73 53.70 2kyz s ARG 2 Cb 0.00 -1.53 0.04 0.00 -0.57 0.00 0.00 34.95 32.89 2kyz s ARG 2 CO 0.00 0.31 0.15 0.71 -1.08 0.00 0.00 175.30 175.39 2kyz s TYR 3 N -2.12 -0.17 -0.51 5.89 1.51 -0.59 -1.94 117.35 119.42 2kyz s TYR 3 Ca 0.20 0.55 -0.21 0.00 -1.01 0.00 0.00 57.07 56.60 2kyz s TYR 3 Cb -0.06 -0.17 0.04 0.00 -0.11 0.00 0.00 41.96 41.66 2kyz s TYR 3 CO 0.09 -0.22 0.74 0.54 -1.11 0.00 0.00 175.55 175.59 2kyz s VAL 4 N 1.74 4.69 0.73 0.71 0.11 0.82 -3.09 120.40 126.12 2kyz s VAL 4 Ca -0.03 -0.08 -0.11 0.00 -2.93 0.00 0.00 61.98 58.83 2kyz s VAL 4 Cb -0.12 -4.36 0.03 0.00 -1.53 0.00 0.00 36.38 30.40 2kyz s VAL 4 CO -0.06 -0.87 1.10 -0.76 -3.33 0.00 0.00 175.10 171.18 2kyz s LEU 5 N 3.14 2.81 -0.40 2.54 1.43 -0.27 -1.43 118.68 126.51 2kyz s LEU 5 Ca 0.22 1.20 0.02 0.00 -1.03 0.00 0.00 54.13 54.54 2kyz s LEU 5 Cb -0.16 -3.94 0.12 0.00 0.03 0.00 0.00 46.19 42.24 2kyz s LEU 5 CO 0.16 -1.54 0.18 -0.47 0.23 0.00 0.00 176.35 174.91 2kyz s TYR 6 N -3.29 2.14 -0.75 0.29 5.04 0.72 -3.71 117.35 117.79 2kyz s TYR 6 Ca 0.59 -2.33 -0.02 0.00 -2.44 0.00 0.00 57.07 52.87 2kyz s TYR 6 Cb -0.12 -1.99 0.19 0.00 0.35 0.00 0.00 41.96 40.38 2kyz s TYR 6 CO 0.53 -0.82 0.59 0.54 -1.34 0.00 0.00 175.55 175.05 2kyz s VAL 7 N 0.73 3.92 -0.40 3.14 0.11 -1.25 0.52 120.40 127.17 2kyz s VAL 7 Ca 0.15 -3.48 0.19 0.00 -2.93 0.00 0.00 61.98 55.91 2kyz s VAL 7 Cb -0.22 -3.50 0.19 0.00 -1.53 0.00 0.00 36.38 31.32 2kyz s VAL 7 CO -0.07 -0.98 1.57 -0.81 -3.33 0.00 0.00 175.10 171.48 2kyz n PRO 8 N 2.84 0.13 0.00 1.54 -0.04 -1.26 -2.17 135.00 136.03 2kyz n PRO 8 Ca 0.15 0.56 0.11 0.00 -0.04 0.00 0.00 63.50 64.28 2kyz n PRO 8 Cb 0.37 -1.86 0.53 0.00 -0.04 0.00 0.00 33.50 32.50 2kyz n PRO 8 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2kyz n ASP 9 N -2.12 0.00 -1.16 3.54 8.00 -1.26 -2.86 116.55 120.69 2kyz n ASP 9 Ca -0.00 0.35 -0.02 0.00 0.71 0.00 0.00 54.79 55.83 2kyz n ASP 9 Cb 0.07 -0.44 0.01 0.00 -0.02 0.00 0.00 41.12 40.74 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 -1.44 1.31 0.30 0.53 5.41 -0.92 -4.40 119.36 120.14 2kyz n ILE 10 Ca 0.07 -0.23 0.17 0.00 1.00 0.00 0.00 62.75 63.76 2kyz n ILE 10 Cb 0.25 -1.03 0.93 0.00 -0.71 0.00 0.00 39.64 39.08 2kyz n ILE 10 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 176.55 177.32 2kyz h SER 11 N 0.22 0.00 -2.97 4.38 4.64 -1.74 -3.41 113.55 114.66 2kyz h SER 11 Ca 0.05 0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 60.77 2kyz h SER 11 Cb 1.13 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 63.05 2kyz h SER 11 CO 0.09 0.04 -0.79 0.00 -0.87 0.00 0.00 176.83 175.30 2kyz h ASN 13 N 2.87 0.08 -0.20 0.00 -1.07 -1.95 -1.70 115.58 113.62 2kyz h ASN 13 Ca -0.43 -0.04 -0.11 0.00 0.07 0.00 0.00 56.30 55.79 2kyz h ASN 13 Cb 1.22 -0.02 -0.01 0.00 -2.07 0.00 0.00 38.32 37.44 2kyz h ASN 13 CO 0.53 0.54 -0.24 -0.74 0.07 0.00 0.00 177.43 177.59 2kyz h HIS 14 N 0.07 0.75 -0.95 4.14 2.76 -1.97 -3.16 115.15 116.79 2kyz h HIS 14 Ca 0.00 -0.17 0.11 0.00 -2.20 0.00 0.00 60.37 58.12 2kyz h HIS 14 Cb 0.85 -0.18 -0.08 0.00 1.55 0.00 0.00 27.41 29.55 2kyz h HIS 14 CO 0.01 0.85 0.58 0.00 -1.30 0.00 0.00 177.93 178.06 2kyz h LYS 16 N 0.92 -0.07 0.00 0.00 3.64 -1.49 -1.25 116.57 118.32 2kyz h LYS 16 Ca 0.47 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.84 2kyz h LYS 16 Cb 0.46 0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.30 2kyz h LYS 16 CO -0.27 -0.04 -0.04 0.52 -2.27 0.00 0.00 179.45 177.35 2kyz h MET 17 N -0.07 0.00 -0.14 1.90 2.86 -1.43 -0.22 114.93 117.84 2kyz h MET 17 Ca 0.22 0.00 0.03 0.00 -2.06 0.00 0.00 59.70 57.89 2kyz h MET 17 Cb 0.41 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.05 2kyz h MET 17 CO -0.51 0.04 -0.03 0.00 1.06 0.00 0.00 176.91 177.46 2kyz h ARG 18 N 0.00 0.00 0.42 1.72 3.08 -1.20 -1.82 114.38 116.58 2kyz h ARG 18 Ca -0.00 -0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.03 2kyz h ARG 18 Cb 0.10 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.15 2kyz h ARG 18 CO 0.01 0.00 -0.20 0.82 -1.07 0.00 0.00 179.97 179.52 2kyz h ILE 19 N 0.00 0.00 -0.82 2.04 5.03 -1.30 -3.25 117.51 119.21 2kyz h ILE 19 Ca 0.07 -0.12 0.04 0.00 -0.12 0.00 0.00 64.86 64.72 2kyz h ILE 19 Cb 0.10 0.00 -0.05 0.00 -3.03 0.00 0.00 36.82 33.84 2kyz h ILE 19 CO -0.14 0.00 0.54 0.28 -0.68 0.00 0.00 178.15 178.15 2kyz h SER 20 N -0.69 0.85 -0.06 1.72 0.02 -0.96 0.22 113.55 114.65 2kyz h SER 20 Ca -0.06 -0.01 0.03 0.00 -0.84 0.00 0.00 61.79 60.91 2kyz h SER 20 Cb 0.43 -0.19 -0.03 0.00 0.14 0.00 0.00 62.40 62.75 2kyz h SER 20 CO 0.09 0.58 -0.10 0.11 -1.14 0.00 0.00 176.83 176.37 2kyz h LYS 21 N 0.99 -0.14 0.00 3.45 1.79 -1.47 -0.58 116.57 120.59 2kyz h LYS 21 Ca 0.33 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.81 2kyz h LYS 21 Cb 0.08 0.03 0.00 0.00 -1.58 0.00 0.00 32.23 30.77 2kyz h LYS 21 CO -0.10 -0.10 0.00 0.00 -1.08 0.00 0.00 179.45 178.17 2kyz n ALA 22 N -2.41 1.38 -0.08 3.86 0.00 -0.05 -2.27 120.51 120.94 2kyz n ALA 22 Ca -0.04 0.02 -0.22 0.00 0.00 0.00 0.00 53.44 53.19 2kyz n ALA 22 Cb 0.16 -1.20 -0.12 0.00 0.00 0.00 0.00 19.45 18.29 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 -1.72 2.40 -0.23 0.00 4.77 -0.51 -3.61 117.00 118.11 2kyz n LEU 23 Ca 0.02 0.20 -0.01 0.00 -0.03 0.00 0.00 56.01 56.19 2kyz n LEU 23 Cb 0.11 -0.97 0.21 0.00 -2.33 0.00 0.00 43.42 40.44 2kyz n LEU 23 CO 0.10 0.68 1.19 -0.33 -1.33 0.00 0.00 177.39 177.70 2kyz h GLU 24 N -0.42 1.02 -0.40 3.23 5.08 -0.96 -1.92 114.58 120.21 2kyz h GLU 24 Ca -0.50 -0.09 -0.12 0.00 -1.00 0.00 0.00 59.36 57.65 2kyz h GLU 24 Cb 1.74 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 30.77 2kyz h GLU 24 CO -0.13 0.72 -0.23 1.05 -1.00 0.00 0.00 179.01 179.42 2kyz h GLU 25 N 1.03 0.79 0.00 2.33 4.11 -1.66 -3.18 114.58 118.00 2kyz h GLU 25 Ca 0.27 -0.33 0.00 0.00 0.07 0.00 0.00 59.36 59.37 2kyz h GLU 25 Cb -0.03 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.19 2kyz h GLU 25 CO -0.05 0.95 0.00 -0.11 0.07 0.00 0.00 179.01 179.87 2kyz n LEU 26 N -4.11 0.07 0.00 3.06 7.94 -0.73 -4.82 117.00 118.41 2kyz n LEU 26 Ca 0.00 0.52 0.00 0.00 -1.11 0.00 0.00 56.01 55.42 2kyz n LEU 26 Cb 0.44 -0.52 0.00 0.00 0.53 0.00 0.00 43.42 43.87 2kyz n LEU 26 CO 0.45 -0.39 0.00 0.61 -1.11 0.00 0.00 177.39 176.95 2kyz n GLY 27 N -0.59 0.50 3.60 -3.96 0.00 -1.18 -5.06 105.19 98.50 2kyz n GLY 27 Ca 0.02 -0.84 -0.30 0.00 0.00 0.00 0.00 46.02 44.90 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 2.19 0.00 1.61 0.11 -1.19 -5.01 120.40 116.11 2kyz s VAL 28 Ca 0.00 0.06 0.00 0.00 -2.93 0.00 0.00 61.98 59.11 2kyz s VAL 28 Cb 0.00 -2.21 0.00 0.00 -1.53 0.00 0.00 36.38 32.64 2kyz s VAL 28 CO 0.00 -0.08 0.03 0.29 -3.33 0.00 0.00 175.10 172.01 2kyz n LYS 29 N -4.45 0.39 -3.67 1.54 4.76 -1.26 -4.93 118.16 110.54 2kyz n LYS 29 Ca 0.07 -0.03 -0.11 0.00 -2.87 0.00 0.00 58.31 55.37 2kyz n LYS 29 Cb 0.54 -0.29 -0.11 0.00 -1.84 0.00 0.00 35.03 33.32 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 -0.06 -0.05 0.15 4.39 0.01 -1.26 -5.06 114.94 113.05 2kyz s ASN 30 Ca 0.00 0.78 -0.24 0.00 -0.71 0.00 0.00 52.86 52.69 2kyz s ASN 30 Cb 0.00 0.94 0.07 0.00 0.41 0.00 0.00 41.25 42.66 2kyz s ASN 30 CO 0.00 -0.22 0.67 -0.72 -1.51 0.00 0.00 177.10 175.32 2kyz s TYR 31 N 2.26 -0.46 -0.01 2.20 1.13 -1.26 -0.55 117.35 120.66 2kyz s TYR 31 Ca -0.02 0.23 -0.11 0.00 -1.41 0.00 0.00 57.07 55.75 2kyz s TYR 31 Cb -0.11 0.57 0.01 0.00 -1.10 0.00 0.00 41.96 41.34 2kyz s TYR 31 CO -0.11 -0.84 0.24 -1.21 -2.51 0.00 0.00 175.55 171.12 2kyz s GLU 32 N -3.65 0.58 -0.08 -3.49 2.02 0.16 -4.99 118.70 109.25 2kyz s GLU 32 Ca 0.03 -0.25 0.01 0.00 0.02 0.00 0.00 54.97 54.78 2kyz s GLU 32 Cb -0.02 0.25 0.02 0.00 0.10 0.00 0.00 34.13 34.48 2kyz s GLU 32 CO -0.10 -0.15 -0.10 0.08 0.02 0.00 0.00 175.26 175.01 2kyz s VAL 33 N -1.28 1.04 -0.38 2.63 1.01 -1.26 -0.78 120.40 121.38 2kyz s VAL 33 Ca -0.13 -0.39 0.03 0.00 0.00 0.00 0.00 61.98 61.49 2kyz s VAL 33 Cb -0.06 -0.99 0.11 0.00 0.00 0.00 0.00 36.38 35.44 2kyz s VAL 33 CO 0.03 0.34 0.12 -0.55 0.00 0.00 0.00 175.10 175.05 2kyz s SER 34 N 0.98 4.44 0.08 3.32 0.15 0.20 -5.01 113.70 117.86 2kyz s SER 34 Ca -0.09 -2.29 -0.19 0.00 0.70 0.00 0.00 55.95 54.08 2kyz s SER 34 Cb -0.15 -1.44 -0.09 0.00 -1.71 0.00 0.00 66.02 62.63 2kyz s SER 34 CO 0.00 -0.34 1.54 0.58 1.20 0.00 0.00 173.24 176.22 2kyz h VAL 35 N 6.22 1.24 -0.21 4.45 2.07 -1.82 0.36 116.25 128.57 2kyz h VAL 35 Ca -0.06 -0.81 0.03 0.00 0.82 0.00 0.00 66.70 66.68 2kyz h VAL 35 Cb 0.98 1.32 -0.03 0.00 -1.52 0.00 0.00 31.29 32.05 2kyz h VAL 35 CO 0.54 0.25 0.02 -0.33 0.02 0.00 0.00 177.57 178.08 2kyz h GLU 36 N 0.18 0.09 0.00 1.57 5.08 -1.87 -1.40 114.58 118.24 2kyz h GLU 36 Ca 0.07 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.42 2kyz h GLU 36 Cb 0.36 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.58 2kyz h GLU 36 CO 0.01 0.06 0.00 0.39 -1.00 0.00 0.00 179.01 178.47 2kyz n GLU 37 N -5.11 0.06 -0.21 2.33 -0.58 -1.10 -4.90 120.64 111.13 2kyz n GLU 37 Ca -0.02 0.22 0.00 0.00 -0.42 0.00 0.00 57.16 56.94 2kyz n GLU 37 Cb 0.10 -1.59 0.00 0.00 -0.57 0.00 0.00 31.44 29.38 2kyz n GLU 37 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 2kyz n LYS 38 N -1.70 0.00 -2.36 3.49 5.02 0.12 -4.96 118.16 117.77 2kyz n LYS 38 Ca 0.04 0.00 -0.28 0.00 -2.02 0.00 0.00 58.31 56.05 2kyz n LYS 38 Cb 0.24 -3.90 0.01 0.00 -0.02 0.00 0.00 35.03 31.37 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 -0.41 3.35 0.10 1.97 1.02 -0.86 -3.88 119.74 121.03 2kyz s LYS 39 Ca 0.00 0.28 0.08 0.00 0.02 0.00 0.00 55.97 56.35 2kyz s LYS 39 Cb 0.00 -2.26 -0.03 0.00 -0.52 0.00 0.00 37.83 35.01 2kyz s LYS 39 CO 0.00 -0.46 -0.21 0.08 -0.92 0.00 0.00 175.35 173.84 2kyz s VAL 40 N -2.94 1.69 -0.02 3.17 1.01 -1.24 -0.63 120.40 121.44 2kyz s VAL 40 Ca 0.51 -1.54 0.07 0.00 0.00 0.00 0.00 61.98 61.02 2kyz s VAL 40 Cb -0.11 -1.55 -0.02 0.00 0.00 0.00 0.00 36.38 34.71 2kyz s VAL 40 CO 0.47 -0.07 -0.24 -0.69 0.00 0.00 0.00 175.10 174.57 2kyz s VAL 41 N -1.19 1.93 0.07 2.92 1.01 0.04 -1.11 120.40 124.07 2kyz s VAL 41 Ca 0.06 -1.04 0.07 0.00 0.00 0.00 0.00 61.98 61.07 2kyz s VAL 41 Cb -0.10 -1.60 -0.03 0.00 0.00 0.00 0.00 36.38 34.65 2kyz s VAL 41 CO 0.04 0.55 -0.20 0.68 0.00 0.00 0.00 175.10 176.17 2kyz s VAL 42 N -0.56 1.61 -0.57 2.92 -7.23 -1.18 -0.66 120.40 114.73 2kyz s VAL 42 Ca 0.09 -1.34 -0.08 0.00 -1.81 0.00 0.00 61.98 58.85 2kyz s VAL 42 Cb -0.10 -1.44 0.15 0.00 0.56 0.00 0.00 36.38 35.56 2kyz s VAL 42 CO -0.01 0.05 0.43 -0.70 -0.31 0.00 0.00 175.10 174.56 2kyz s GLU 43 N -1.52 2.64 0.28 4.82 2.12 0.29 -1.54 118.70 125.80 2kyz s GLU 43 Ca 0.06 -2.11 0.02 0.00 0.36 0.00 0.00 54.97 53.30 2kyz s GLU 43 Cb -0.09 -3.92 -0.05 0.00 0.26 0.00 0.00 34.13 30.33 2kyz s GLU 43 CO 0.03 -1.19 0.11 -0.08 -0.54 0.00 0.00 175.26 173.58 2kyz s THR 44 N 0.74 0.57 -1.76 -1.70 -1.32 -0.56 -4.35 115.64 107.25 2kyz s THR 44 Ca 0.11 -2.00 0.18 0.00 -1.21 0.00 0.00 61.69 58.78 2kyz s THR 44 Cb -0.22 -2.61 0.02 0.00 -1.51 0.00 0.00 72.50 68.18 2kyz s THR 44 CO -0.03 0.00 0.96 -0.62 -2.21 0.00 0.00 174.62 172.71 2kyz n GLU 45 N -0.54 1.55 -3.45 7.08 -0.58 -1.26 -0.29 120.64 123.15 2kyz n GLU 45 Ca -0.00 -0.98 -0.27 0.00 -0.42 0.00 0.00 57.16 55.49 2kyz n GLU 45 Cb 0.66 -1.35 -0.10 0.00 -0.57 0.00 0.00 31.44 30.08 2kyz n GLU 45 CO 0.00 0.00 0.00 -1.71 -0.48 0.00 0.00 177.13 174.94 2kyz n ASN 46 N 0.07 0.03 -0.28 1.62 4.05 -1.26 -4.95 115.26 114.55 2kyz n ASN 46 Ca 0.08 -2.50 0.16 0.00 0.45 0.00 0.00 54.58 52.76 2kyz n ASN 46 Cb 0.40 -0.58 0.43 0.00 1.23 0.00 0.00 39.78 41.25 2kyz n ASN 46 CO 0.00 0.00 0.00 0.25 -3.05 0.00 0.00 177.26 174.46 2kyz h LEU 47 N 5.51 0.57 -1.02 1.20 5.85 -1.99 -2.71 115.31 122.73 2kyz h LEU 47 Ca 0.24 0.05 0.06 0.00 0.84 0.00 0.00 57.88 59.08 2kyz h LEU 47 Cb 0.89 -0.05 -0.07 0.00 0.37 0.00 0.00 40.66 41.80 2kyz h LEU 47 CO 0.42 0.24 0.65 -0.78 -0.34 0.00 0.00 178.44 178.63 2kyz h ASP 48 N 0.58 1.04 -0.82 1.25 3.58 -1.99 -0.04 116.42 120.02 2kyz h ASP 48 Ca 0.49 0.01 0.03 0.00 0.42 0.00 0.00 57.03 57.98 2kyz h ASP 48 Cb 0.98 -0.21 -0.05 0.00 1.72 0.00 0.00 39.33 41.77 2kyz h ASP 48 CO -0.24 0.67 0.53 -1.28 -2.88 0.00 0.00 179.24 176.04 2kyz h SER 49 N 1.18 0.89 0.04 2.28 0.87 -1.91 0.74 113.55 117.63 2kyz h SER 49 Ca 0.43 -0.01 -0.00 0.00 -1.23 0.00 0.00 61.79 60.98 2kyz h SER 49 Cb 0.16 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 61.92 2kyz h SER 49 CO -0.17 0.62 -0.02 0.58 -0.53 0.00 0.00 176.83 177.31 2kyz h VAL 50 N 1.05 1.20 -0.85 2.23 2.07 -1.17 -0.83 116.25 119.94 2kyz h VAL 50 Ca 0.32 -0.76 -0.00 0.00 0.82 0.00 0.00 66.70 67.08 2kyz h VAL 50 Cb -0.03 1.71 -0.04 0.00 -1.52 0.00 0.00 31.29 31.41 2kyz h VAL 50 CO -0.10 0.19 0.53 -0.07 0.02 0.00 0.00 177.57 178.14 2kyz h LEU 51 N -0.38 1.01 0.51 2.57 3.38 -0.58 0.18 115.31 121.99 2kyz h LEU 51 Ca -0.01 -0.05 -0.02 0.00 0.09 0.00 0.00 57.88 57.90 2kyz h LEU 51 Cb 0.35 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 2kyz h LEU 51 CO 0.01 0.76 -0.33 0.11 0.09 0.00 0.00 178.44 179.08 2kyz h LYS 52 N 1.17 -0.77 -0.81 1.13 6.56 -0.87 -2.85 116.57 120.13 2kyz h LYS 52 Ca 0.31 0.05 0.10 0.00 -1.06 0.00 0.00 60.65 60.05 2kyz h LYS 52 Cb -0.08 0.18 -0.06 0.00 -0.57 0.00 0.00 32.23 31.70 2kyz h LYS 52 CO -0.06 -0.51 0.53 -0.22 -2.06 0.00 0.00 179.45 177.12 2kyz h LYS 53 N -0.80 0.72 -0.37 3.15 1.63 0.05 -0.44 116.57 120.52 2kyz h LYS 53 Ca -0.06 -0.04 -0.02 0.00 -0.85 0.00 0.00 60.65 59.68 2kyz h LYS 53 Cb 0.66 -0.16 -0.02 0.00 -0.60 0.00 0.00 32.23 32.11 2kyz h LYS 53 CO 0.05 0.48 0.15 -0.07 -3.45 0.00 0.00 179.45 176.62 2kyz h LEU 54 N 0.75 0.50 -0.77 5.20 -0.00 -0.58 -2.71 115.31 117.70 2kyz h LEU 54 Ca 0.37 -0.16 -0.10 0.00 -0.00 0.00 0.00 57.88 58.00 2kyz h LEU 54 Cb 0.46 -0.13 -0.02 0.00 -0.00 0.00 0.00 40.66 40.97 2kyz h LEU 54 CO -0.15 0.53 -0.13 -0.08 -0.00 0.00 0.00 178.44 178.61 2kyz h GLU 55 N 0.45 0.79 0.00 1.13 4.81 -1.00 -1.26 114.58 119.50 2kyz h GLU 55 Ca 0.12 -0.27 0.00 0.00 -0.13 0.00 0.00 59.36 59.08 2kyz h GLU 55 Cb 0.18 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.50 2kyz h GLU 55 CO -0.01 0.88 0.00 0.39 -0.73 0.00 0.00 179.01 179.54 2kyz n GLU 56 N -4.15 0.19 -0.10 1.92 -0.58 -0.29 -0.68 120.64 116.95 2kyz n GLU 56 Ca 0.01 0.08 0.03 0.00 -0.42 0.00 0.00 57.16 56.87 2kyz n GLU 56 Cb 0.38 -1.50 0.09 0.00 -0.57 0.00 0.00 31.44 29.84 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 -1.11 1.13 -1.13 -3.67 -5.35 -1.05 -4.98 119.36 103.21 2kyz n ILE 57 Ca 0.05 -1.13 -0.03 0.00 -0.27 0.00 0.00 62.75 61.36 2kyz n ILE 57 Cb 0.04 0.41 -0.01 0.00 -1.74 0.00 0.00 39.64 38.34 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 -0.14 -3.37 -4.02 7.28 2.03 0.14 -5.02 116.55 113.44 2kyz n ASP 58 Ca 0.07 0.08 -0.33 0.00 0.52 0.00 0.00 54.79 55.14 2kyz n ASP 58 Cb 0.38 -1.23 -0.09 0.00 -0.72 0.00 0.00 41.12 39.47 2kyz n ASP 58 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 2kyz s TYR 59 N -2.13 3.71 -0.38 -0.67 1.51 -0.50 -5.00 117.35 113.89 2kyz s TYR 59 Ca 0.00 -3.13 -0.28 0.00 -1.01 0.00 0.00 57.07 52.65 2kyz s TYR 59 Cb 0.00 -3.02 -0.02 0.00 -0.11 0.00 0.00 41.96 38.81 2kyz s TYR 59 CO 0.00 -0.67 1.81 -1.25 -1.11 0.00 0.00 175.55 174.32 2kyz s PRO 60 N -1.24 3.21 0.63 -1.71 0.04 -1.26 -3.44 135.00 131.22 2kyz s PRO 60 Ca 0.25 1.29 -0.19 0.00 0.04 0.00 0.00 61.00 62.39 2kyz s PRO 60 Cb -0.08 -4.23 -0.02 0.00 0.04 0.00 0.00 34.50 30.21 2kyz s PRO 60 CO -0.13 -2.01 1.27 1.55 0.04 0.00 0.00 177.00 177.73 2kyz n VAL 61 N 7.38 4.67 0.00 -0.36 3.14 -1.26 -4.77 118.33 127.13 2kyz n VAL 61 Ca 0.23 -0.50 0.00 0.00 -2.96 0.00 0.00 64.34 61.11 2kyz n VAL 61 Cb 0.48 -1.49 0.00 0.00 -1.06 0.00 0.00 33.84 31.77 2kyz n VAL 61 CO 0.00 0.00 0.00 1.21 -6.46 0.00 0.00 176.83 171.58 2kyz n GLU 62 N -1.68 0.00 -4.54 1.45 2.13 0.18 -4.96 120.64 113.23 2kyz n GLU 62 Ca 0.15 0.00 -0.31 0.00 0.66 0.00 0.00 57.16 57.66 2kyz n GLU 62 Cb 0.47 -0.36 -0.07 0.00 0.27 0.00 0.00 31.44 31.76 2kyz n GLU 62 CO 0.00 0.00 0.00 -1.12 -0.41 0.00 0.00 177.13 175.60 2kyz s SER 63 N -1.00 4.22 0.23 4.31 0.01 -1.16 -4.93 113.70 115.39 2kyz s SER 63 Ca 0.00 -1.51 -0.15 0.00 1.31 0.00 0.00 55.95 55.60 2kyz s SER 63 Cb 0.00 0.35 0.01 0.00 0.21 0.00 0.00 66.02 66.58 2kyz s SER 63 CO 0.00 -0.84 0.52 -0.72 0.41 0.00 0.00 173.24 172.61 2kyz s TYR 64 N -2.82 0.12 -0.19 2.43 -0.85 -1.26 -0.20 117.35 114.58 2kyz s TYR 64 Ca 0.16 -0.50 -0.16 0.00 -0.52 0.00 0.00 57.07 56.05 2kyz s TYR 64 Cb 0.02 0.33 0.05 0.00 0.38 0.00 0.00 41.96 42.74 2kyz s TYR 64 CO 0.09 -1.00 0.49 -0.65 -1.52 0.00 0.00 175.55 172.97 2kyz s GLN 65 N -3.95 0.56 0.48 -3.49 -1.52 -0.51 -4.96 119.66 106.26 2kyz s GLN 65 Ca 0.16 0.72 -0.23 0.00 -1.95 0.00 0.00 55.36 54.06 2kyz s GLN 65 Cb -0.01 0.24 -0.08 0.00 -0.22 0.00 0.00 33.01 32.94 2kyz s GLN 65 CO 0.05 -0.08 1.19 -1.91 -0.25 0.00 0.00 175.29 174.29 2kyz n GLU 66 N 3.03 1.61 0.00 2.91 2.13 -1.26 -0.13 120.64 128.93 2kyz n GLU 66 Ca -0.15 0.58 0.00 0.00 0.66 0.00 0.00 57.16 58.25 2kyz n GLU 66 Cb 0.57 -2.33 0.00 0.00 0.27 0.00 0.00 31.44 29.95 2kyz n GLU 66 CO 0.00 0.00 0.00 1.33 -0.41 0.00 0.00 177.13 178.05