#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 1.35 -0.11 0.03 3.03 -1.17 -1.95 118.95 120.12 2kyz s ARG 2 Ca 0.00 -1.66 -0.03 0.00 2.03 0.00 0.00 55.73 56.07 2kyz s ARG 2 Cb 0.00 -0.81 0.05 0.00 -1.03 0.00 0.00 34.95 33.16 2kyz s ARG 2 CO 0.00 -0.00 0.12 0.71 -1.13 0.00 0.00 175.30 175.00 2kyz s TYR 3 N -3.25 -0.03 -1.08 5.89 2.02 -0.33 -1.28 117.35 119.28 2kyz s TYR 3 Ca 0.26 0.22 -0.22 0.00 -0.37 0.00 0.00 57.07 56.96 2kyz s TYR 3 Cb 0.04 -0.45 0.04 0.00 -0.40 0.00 0.00 41.96 41.19 2kyz s TYR 3 CO 0.08 -0.36 1.57 0.08 -1.57 0.00 0.00 175.55 175.35 2kyz s VAL 4 N 2.22 3.93 -0.09 0.71 1.01 0.63 -2.89 120.40 125.92 2kyz s VAL 4 Ca 0.04 -1.01 -0.30 0.00 0.00 0.00 0.00 61.98 60.71 2kyz s VAL 4 Cb -0.14 -5.01 -0.02 0.00 0.00 0.00 0.00 36.38 31.22 2kyz s VAL 4 CO -0.07 -1.87 1.06 -0.76 0.00 0.00 0.00 175.10 173.46 2kyz s LEU 5 N 5.30 4.25 -0.52 3.92 1.43 0.49 -2.58 118.68 130.97 2kyz s LEU 5 Ca 0.50 1.60 -0.28 0.00 -1.03 0.00 0.00 54.13 54.92 2kyz s LEU 5 Cb 0.00 -3.56 0.03 0.00 0.03 0.00 0.00 46.19 42.70 2kyz s LEU 5 CO -0.05 -0.49 1.12 -0.47 0.23 0.00 0.00 176.35 176.70 2kyz s TYR 6 N 2.09 2.74 -0.61 0.29 5.04 0.60 -1.16 117.35 126.33 2kyz s TYR 6 Ca 0.50 0.50 0.04 0.00 -2.44 0.00 0.00 57.07 55.68 2kyz s TYR 6 Cb -0.20 -4.40 0.15 0.00 0.35 0.00 0.00 41.96 37.86 2kyz s TYR 6 CO 0.19 -1.39 0.38 0.08 -1.34 0.00 0.00 175.55 173.46 2kyz s VAL 7 N 4.56 2.77 0.53 3.14 1.01 -0.77 -1.08 120.40 130.56 2kyz s VAL 7 Ca 0.43 -3.79 0.18 0.00 0.00 0.00 0.00 61.98 58.80 2kyz s VAL 7 Cb -0.08 -2.87 0.29 0.00 0.00 0.00 0.00 36.38 33.72 2kyz s VAL 7 CO 0.28 -0.90 2.15 1.55 0.00 0.00 0.00 175.10 178.17 2kyz h PRO 8 N 5.96 0.00 0.00 2.72 0.13 -1.87 -2.00 132.00 136.95 2kyz h PRO 8 Ca 0.03 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.16 2kyz h PRO 8 Cb 0.82 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.95 2kyz h PRO 8 CO 0.71 0.00 0.06 -0.25 -0.23 0.00 0.00 178.00 178.28 2kyz n ASP 9 N -4.45 0.30 0.00 1.44 8.00 -1.26 -2.18 116.55 118.39 2kyz n ASP 9 Ca -0.02 0.61 0.05 0.00 0.71 0.00 0.00 54.79 56.14 2kyz n ASP 9 Cb 0.13 -0.63 0.29 0.00 -0.02 0.00 0.00 41.12 40.89 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 -1.90 0.00 0.20 0.53 5.41 -0.75 -4.13 119.36 118.72 2kyz n ILE 10 Ca -0.01 0.00 0.02 0.00 1.00 0.00 0.00 62.75 63.76 2kyz n ILE 10 Cb 0.07 -0.32 0.10 0.00 -0.71 0.00 0.00 39.64 38.78 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 -0.70 0.00 -4.36 4.38 2.88 -0.93 -4.46 113.62 110.43 2kyz n SER 11 Ca 0.07 -0.01 -0.29 0.00 -1.33 0.00 0.00 58.87 57.31 2kyz n SER 11 Cb 0.03 -0.08 -0.13 0.00 -0.75 0.00 0.00 64.21 63.28 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 4.17 1.03 0.16 0.00 -0.73 -1.96 -1.22 115.58 117.03 2kyz h ASN 13 Ca -0.49 -0.14 -0.03 0.00 1.87 0.00 0.00 56.30 57.51 2kyz h ASN 13 Cb 1.16 -0.27 -0.00 0.00 0.27 0.00 0.00 38.32 39.48 2kyz h ASN 13 CO 0.40 0.90 -0.13 1.12 -0.37 0.00 0.00 177.43 179.35 2kyz h HIS 14 N 1.11 0.00 -0.26 0.67 2.07 -1.97 -2.37 115.15 114.40 2kyz h HIS 14 Ca 0.26 0.00 -0.03 0.00 -2.85 0.00 0.00 60.37 57.75 2kyz h HIS 14 Cb 0.17 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.14 2kyz h HIS 14 CO 0.02 0.13 0.03 0.00 -3.07 0.00 0.00 177.93 175.04 2kyz h LYS 16 N 0.37 -0.04 0.00 0.00 3.64 -1.42 -0.52 116.57 118.61 2kyz h LYS 16 Ca 0.09 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.47 2kyz h LYS 16 Cb 0.20 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.03 2kyz h LYS 16 CO 0.00 -0.03 -0.02 1.98 -2.27 0.00 0.00 179.45 179.12 2kyz h MET 17 N -0.05 0.00 -0.44 1.90 4.05 -1.59 -1.40 114.93 117.40 2kyz h MET 17 Ca 0.10 0.00 -0.04 0.00 -0.28 0.00 0.00 59.70 59.48 2kyz h MET 17 Cb 0.19 0.00 -0.02 0.00 -0.80 0.00 0.00 31.60 30.97 2kyz h MET 17 CO -0.22 0.02 0.11 0.00 0.23 0.00 0.00 176.91 177.04 2kyz h ARG 18 N 0.00 0.65 0.24 0.39 3.08 -0.98 -1.85 114.38 115.91 2kyz h ARG 18 Ca -0.00 -0.11 -0.01 0.00 0.07 0.00 0.00 59.98 59.92 2kyz h ARG 18 Cb 0.08 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.02 2kyz h ARG 18 CO 0.00 0.59 -0.12 0.82 -1.07 0.00 0.00 179.97 180.19 2kyz h ILE 19 N 0.63 0.00 -0.64 2.04 5.03 -1.22 -3.24 117.51 120.11 2kyz h ILE 19 Ca 0.15 -0.59 0.06 0.00 -0.12 0.00 0.00 64.86 64.35 2kyz h ILE 19 Cb 0.23 0.00 -0.06 0.00 -3.03 0.00 0.00 36.82 33.97 2kyz h ILE 19 CO -0.00 0.00 0.34 0.77 -0.68 0.00 0.00 178.15 178.57 2kyz h SER 20 N -0.92 0.49 -0.83 1.72 4.64 -1.34 0.15 113.55 117.47 2kyz h SER 20 Ca -0.03 0.04 0.01 0.00 -0.47 0.00 0.00 61.79 61.33 2kyz h SER 20 Cb 0.25 -0.06 -0.04 0.00 -0.31 0.00 0.00 62.40 62.24 2kyz h SER 20 CO 0.05 0.31 0.55 0.50 -0.87 0.00 0.00 176.83 177.37 2kyz h LYS 21 N 0.62 1.09 -0.10 4.77 3.64 -1.52 -0.45 116.57 124.63 2kyz h LYS 21 Ca 0.29 -0.07 -0.16 0.00 -1.27 0.00 0.00 60.65 59.44 2kyz h LYS 21 Cb 0.21 -0.25 -0.01 0.00 -0.41 0.00 0.00 32.23 31.77 2kyz h LYS 21 CO -0.19 0.72 -0.64 0.00 -2.27 0.00 0.00 179.45 177.06 2kyz h ALA 22 N 1.48 0.72 -0.25 5.00 0.00 -1.13 -3.26 119.26 121.82 2kyz h ALA 22 Ca 0.30 -0.56 -0.09 0.00 0.00 0.00 0.00 54.91 54.56 2kyz h ALA 22 Cb -0.13 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 2kyz h ALA 22 CO -0.07 0.74 -0.19 -0.07 0.00 0.00 0.00 179.25 179.66 2kyz h LEU 23 N 0.26 0.60 -1.13 0.00 3.38 0.25 -1.47 115.31 117.20 2kyz h LEU 23 Ca -0.01 -0.45 0.07 0.00 0.09 0.00 0.00 57.88 57.58 2kyz h LEU 23 Cb 1.18 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 41.70 2kyz h LEU 23 CO 0.11 0.92 0.60 -0.33 0.09 0.00 0.00 178.44 179.83 2kyz h GLU 24 N 0.28 0.99 -0.21 1.13 4.39 -1.22 -1.17 114.58 118.78 2kyz h GLU 24 Ca 0.05 -0.06 -0.06 0.00 0.34 0.00 0.00 59.36 59.63 2kyz h GLU 24 Cb 0.73 -0.22 -0.01 0.00 -0.10 0.00 0.00 28.75 29.15 2kyz h GLU 24 CO 0.05 0.66 -0.11 0.93 -1.16 0.00 0.00 179.01 179.38 2kyz h GLU 25 N 1.02 0.44 0.00 2.33 4.39 -1.57 -2.90 114.58 118.29 2kyz h GLU 25 Ca 0.40 -0.19 0.00 0.00 0.34 0.00 0.00 59.36 59.91 2kyz h GLU 25 Cb 0.24 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.88 2kyz h GLU 25 CO -0.16 0.73 0.08 1.25 -1.16 0.00 0.00 179.01 179.75 2kyz h LEU 26 N 0.13 0.00 -1.28 1.33 5.85 -0.52 -3.46 115.31 117.36 2kyz h LEU 26 Ca 0.04 0.00 -0.17 0.00 0.84 0.00 0.00 57.88 58.59 2kyz h LEU 26 Cb 0.60 0.00 0.07 0.00 0.37 0.00 0.00 40.66 41.70 2kyz h LEU 26 CO 0.03 0.00 -0.33 0.61 -0.34 0.00 0.00 178.44 178.41 2kyz n GLY 27 N -1.14 0.19 3.60 3.75 0.00 -0.51 -5.06 105.19 106.03 2kyz n GLY 27 Ca -0.03 -0.23 -0.29 0.00 0.00 0.00 0.00 46.02 45.47 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 -3.16 2.21 0.00 1.61 0.11 -1.07 -5.02 120.40 115.08 2kyz s VAL 28 Ca 0.17 0.07 0.00 0.00 -2.93 0.00 0.00 61.98 59.28 2kyz s VAL 28 Cb -0.07 -2.25 0.00 0.00 -1.53 0.00 0.00 36.38 32.52 2kyz s VAL 28 CO 0.34 -0.09 0.05 0.29 -3.33 0.00 0.00 175.10 172.36 2kyz n LYS 29 N -4.44 0.24 -3.66 1.54 5.02 -1.26 -4.83 118.16 110.76 2kyz n LYS 29 Ca 0.06 -0.05 -0.20 0.00 -2.02 0.00 0.00 58.31 56.10 2kyz n LYS 29 Cb 0.54 -0.42 -0.18 0.00 -0.02 0.00 0.00 35.03 34.95 2kyz n LYS 29 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 2kyz s ASN 30 N -0.05 1.20 0.13 4.39 -0.87 -1.26 -5.06 114.94 113.42 2kyz s ASN 30 Ca 0.00 0.05 -0.10 0.00 -1.57 0.00 0.00 52.86 51.24 2kyz s ASN 30 Cb 0.00 -0.11 0.00 0.00 -0.02 0.00 0.00 41.25 41.13 2kyz s ASN 30 CO 0.00 -0.26 0.28 -0.72 -2.57 0.00 0.00 177.10 173.83 2kyz s TYR 31 N 2.18 0.19 -0.40 2.20 -0.85 -1.26 -0.37 117.35 119.04 2kyz s TYR 31 Ca 0.05 -0.57 0.06 0.00 -0.52 0.00 0.00 57.07 56.09 2kyz s TYR 31 Cb -0.12 0.01 0.17 0.00 0.38 0.00 0.00 41.96 42.40 2kyz s TYR 31 CO -0.04 -0.66 0.53 -2.00 -1.52 0.00 0.00 175.55 171.86 2kyz s GLU 32 N -3.90 0.77 0.06 -3.49 2.12 -0.18 -4.97 118.70 109.11 2kyz s GLU 32 Ca 0.10 -0.58 -0.09 0.00 0.36 0.00 0.00 54.97 54.76 2kyz s GLU 32 Cb 0.03 -0.25 -0.05 0.00 0.26 0.00 0.00 34.13 34.12 2kyz s GLU 32 CO -0.06 -1.21 0.36 0.54 -0.54 0.00 0.00 175.26 174.36 2kyz s VAL 33 N 1.59 5.15 -0.04 3.70 0.11 -1.26 -0.64 120.40 129.00 2kyz s VAL 33 Ca 0.17 0.38 -0.02 0.00 -2.93 0.00 0.00 61.98 59.59 2kyz s VAL 33 Cb -0.08 -3.63 0.03 0.00 -1.53 0.00 0.00 36.38 31.18 2kyz s VAL 33 CO -0.05 0.32 0.07 -0.55 -3.33 0.00 0.00 175.10 171.56 2kyz s SER 34 N -1.73 0.84 -0.04 3.54 0.15 -0.14 -4.99 113.70 111.33 2kyz s SER 34 Ca 0.31 0.12 0.01 0.00 0.70 0.00 0.00 55.95 57.09 2kyz s SER 34 Cb -0.14 -0.05 -0.26 0.00 -1.71 0.00 0.00 66.02 63.86 2kyz s SER 34 CO 0.17 -0.22 0.68 0.58 1.20 0.00 0.00 173.24 175.65 2kyz h VAL 35 N 6.39 0.93 -0.08 4.45 2.07 -1.85 -0.84 116.25 127.33 2kyz h VAL 35 Ca -0.19 -2.66 -0.01 0.00 0.82 0.00 0.00 66.70 64.66 2kyz h VAL 35 Cb 1.12 2.59 -0.00 0.00 -1.52 0.00 0.00 31.29 33.48 2kyz h VAL 35 CO 0.22 0.75 0.02 -0.33 0.02 0.00 0.00 177.57 178.25 2kyz h GLU 36 N 0.05 0.13 0.00 1.57 5.08 -1.95 -3.09 114.58 116.37 2kyz h GLU 36 Ca -0.30 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.03 2kyz h GLU 36 Cb 2.01 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 31.24 2kyz h GLU 36 CO 0.12 0.30 0.00 0.39 -1.00 0.00 0.00 179.01 178.81 2kyz n GLU 37 N -4.91 0.10 -4.06 2.33 -0.58 -1.25 -4.92 120.64 107.35 2kyz n GLU 37 Ca -0.06 0.15 -0.29 0.00 -0.42 0.00 0.00 57.16 56.54 2kyz n GLU 37 Cb 0.14 -1.63 -0.03 0.00 -0.57 0.00 0.00 31.44 29.35 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 -1.81 -3.08 -4.21 3.49 5.02 -0.43 -4.94 118.16 112.20 2kyz n LYS 38 Ca 0.06 0.37 -0.17 0.00 -2.02 0.00 0.00 58.31 56.54 2kyz n LYS 38 Cb 0.33 -4.62 -0.11 0.00 -0.02 0.00 0.00 35.03 30.61 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 -6.74 0.93 -0.23 1.97 1.02 -0.57 -1.85 119.74 114.28 2kyz s LYS 39 Ca 0.22 -1.16 -0.02 0.00 0.02 0.00 0.00 55.97 55.03 2kyz s LYS 39 Cb -0.12 -0.79 0.07 0.00 -0.52 0.00 0.00 37.83 36.47 2kyz s LYS 39 CO 0.91 0.15 0.05 0.08 -0.92 0.00 0.00 175.35 175.62 2kyz s VAL 40 N -2.03 0.69 0.24 3.17 1.01 -0.31 -0.97 120.40 122.20 2kyz s VAL 40 Ca 0.06 -0.85 -0.27 0.00 0.00 0.00 0.00 61.98 60.91 2kyz s VAL 40 Cb -0.05 -1.27 -0.09 0.00 0.00 0.00 0.00 36.38 34.97 2kyz s VAL 40 CO 0.02 -0.34 0.89 -0.69 0.00 0.00 0.00 175.10 174.98 2kyz s VAL 41 N 1.76 4.20 0.08 2.92 1.01 0.19 -0.38 120.40 130.18 2kyz s VAL 41 Ca 0.02 1.89 0.04 0.00 0.00 0.00 0.00 61.98 63.93 2kyz s VAL 41 Cb -0.17 -4.19 -0.03 0.00 0.00 0.00 0.00 36.38 31.99 2kyz s VAL 41 CO -0.13 0.42 -0.11 0.68 0.00 0.00 0.00 175.10 175.95 2kyz s VAL 42 N -1.28 0.94 -0.29 2.92 -7.23 -1.14 -1.01 120.40 113.32 2kyz s VAL 42 Ca 0.42 -1.43 0.02 0.00 -1.81 0.00 0.00 61.98 59.18 2kyz s VAL 42 Cb -0.23 -1.13 0.08 0.00 0.56 0.00 0.00 36.38 35.66 2kyz s VAL 42 CO 0.28 -0.41 -0.01 -0.70 -0.31 0.00 0.00 175.10 173.96 2kyz s GLU 43 N -2.21 1.57 0.13 4.82 2.12 0.50 -1.19 118.70 124.44 2kyz s GLU 43 Ca 0.00 -1.40 -0.12 0.00 0.36 0.00 0.00 54.97 53.82 2kyz s GLU 43 Cb -0.07 -2.79 0.01 0.00 0.26 0.00 0.00 34.13 31.55 2kyz s GLU 43 CO 0.01 -0.77 0.31 -0.08 -0.54 0.00 0.00 175.26 174.19 2kyz s THR 44 N 1.19 0.09 0.28 -1.70 -1.32 -0.82 -4.17 115.64 109.18 2kyz s THR 44 Ca 0.02 -1.00 0.21 0.00 -1.21 0.00 0.00 61.69 59.71 2kyz s THR 44 Cb -0.19 -1.43 0.19 0.00 -1.51 0.00 0.00 72.50 69.57 2kyz s THR 44 CO -0.09 -0.41 1.87 -0.08 -2.21 0.00 0.00 174.62 173.70 2kyz h GLU 45 N 2.52 0.00 -2.81 7.08 4.57 -1.99 -3.30 114.58 120.65 2kyz h GLU 45 Ca -0.33 0.00 -0.60 0.00 -1.18 0.00 0.00 59.36 57.25 2kyz h GLU 45 Cb 1.23 0.00 -0.40 0.00 -0.16 0.00 0.00 28.75 29.42 2kyz h GLU 45 CO 0.49 0.27 -0.79 1.21 -1.18 0.00 0.00 179.01 179.02 2kyz s ASN 46 N -6.40 3.25 0.26 1.04 2.47 -1.26 -4.96 114.94 109.34 2kyz s ASN 46 Ca -0.01 -2.70 -0.04 0.00 0.42 0.00 0.00 52.86 50.53 2kyz s ASN 46 Cb 0.12 -0.85 0.35 0.00 -1.45 0.00 0.00 41.25 39.43 2kyz s ASN 46 CO 0.65 -0.25 1.91 0.25 -3.72 0.00 0.00 177.10 175.95 2kyz h LEU 47 N 6.51 1.08 -0.87 3.21 5.85 -1.99 -2.97 115.31 126.13 2kyz h LEU 47 Ca 0.06 -0.01 0.14 0.00 0.84 0.00 0.00 57.88 58.92 2kyz h LEU 47 Cb 0.92 -0.25 -0.09 0.00 0.37 0.00 0.00 40.66 41.61 2kyz h LEU 47 CO 0.44 0.74 0.46 -0.78 -0.34 0.00 0.00 178.44 178.96 2kyz h ASP 48 N 1.25 0.58 -0.89 1.25 3.58 -2.00 0.85 116.42 121.05 2kyz h ASP 48 Ca 0.39 0.09 0.03 0.00 0.42 0.00 0.00 57.03 57.96 2kyz h ASP 48 Cb 0.00 -0.01 -0.05 0.00 1.72 0.00 0.00 39.33 40.99 2kyz h ASP 48 CO -0.12 0.26 0.57 -1.28 -2.88 0.00 0.00 179.24 175.79 2kyz h SER 49 N 0.67 0.95 0.24 2.28 0.87 -1.97 -2.12 113.55 114.48 2kyz h SER 49 Ca 0.47 -0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 61.01 2kyz h SER 49 Cb 0.63 -0.21 0.00 0.00 -0.44 0.00 0.00 62.40 62.38 2kyz h SER 49 CO -0.35 0.65 -0.12 0.58 -0.53 0.00 0.00 176.83 177.07 2kyz h VAL 50 N 1.11 0.81 -0.61 2.23 2.07 -0.97 -2.10 116.25 118.79 2kyz h VAL 50 Ca 0.35 -0.34 0.02 0.00 0.82 0.00 0.00 66.70 67.55 2kyz h VAL 50 Cb 0.01 1.01 -0.03 0.00 -1.52 0.00 0.00 31.29 30.75 2kyz h VAL 50 CO -0.12 0.08 0.39 -0.07 0.02 0.00 0.00 177.57 177.87 2kyz h LEU 51 N -0.50 0.66 -0.06 2.57 3.38 -0.82 0.12 115.31 120.65 2kyz h LEU 51 Ca -0.03 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.94 2kyz h LEU 51 Cb 0.38 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 2kyz h LEU 51 CO 0.06 0.47 -0.02 0.11 0.09 0.00 0.00 178.44 179.14 2kyz h LYS 52 N 0.78 -0.00 0.00 1.13 6.56 -1.46 -1.86 116.57 121.72 2kyz h LYS 52 Ca 0.23 0.00 -0.04 0.00 -1.06 0.00 0.00 60.65 59.79 2kyz h LYS 52 Cb -0.04 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 31.62 2kyz h LYS 52 CO -0.07 -0.00 -0.17 -0.22 -2.06 0.00 0.00 179.45 176.92 2kyz h LYS 53 N -0.00 0.00 -0.11 3.15 1.63 -0.48 0.23 116.57 120.98 2kyz h LYS 53 Ca 0.03 0.00 -0.03 0.00 -0.85 0.00 0.00 60.65 59.80 2kyz h LYS 53 Cb 0.05 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 31.68 2kyz h LYS 53 CO -0.06 0.17 -0.05 -0.07 -3.45 0.00 0.00 179.45 175.99 2kyz h LEU 54 N 0.00 0.24 -1.24 5.20 -0.00 -0.45 -3.07 115.31 115.99 2kyz h LEU 54 Ca -0.00 -0.40 -0.02 0.00 -0.00 0.00 0.00 57.88 57.45 2kyz h LEU 54 Cb 0.36 -0.07 -0.03 0.00 -0.00 0.00 0.00 40.66 40.93 2kyz h LEU 54 CO 0.02 0.59 0.24 -0.33 -0.00 0.00 0.00 178.44 178.96 2kyz h GLU 55 N -0.11 0.76 0.00 1.13 5.08 -0.51 -0.96 114.58 119.97 2kyz h GLU 55 Ca 0.03 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.28 2kyz h GLU 55 Cb 0.49 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.60 2kyz h GLU 55 CO 0.02 0.61 0.00 -1.91 -1.00 0.00 0.00 179.01 176.73 2kyz n GLU 56 N -4.35 0.76 -0.44 2.33 0.00 -0.01 -0.86 120.64 118.06 2kyz n GLU 56 Ca 0.04 0.00 0.08 0.00 0.00 0.00 0.00 57.16 57.28 2kyz n GLU 56 Cb 0.14 -1.50 0.24 0.00 0.00 0.00 0.00 31.44 30.32 2kyz n GLU 56 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.13 177.57 2kyz n ILE 57 N -1.00 2.27 -1.08 6.31 -5.35 -0.42 -4.97 119.36 115.12 2kyz n ILE 57 Ca 0.18 -2.01 -0.03 0.00 -0.27 0.00 0.00 62.75 60.63 2kyz n ILE 57 Cb 0.08 -0.26 -0.01 0.00 -1.74 0.00 0.00 39.64 37.71 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 -0.68 -4.56 -3.82 7.28 -0.08 -0.04 -4.94 116.55 109.70 2kyz n ASP 58 Ca 0.22 0.07 -0.31 0.00 -1.51 0.00 0.00 54.79 53.26 2kyz n ASP 58 Cb 0.88 -2.30 -0.09 0.00 2.34 0.00 0.00 41.12 41.96 2kyz n ASP 58 CO 0.00 0.00 0.00 -1.22 0.12 0.00 0.00 177.20 176.10 2kyz n TYR 59 N -2.51 3.56 -2.16 -0.67 4.02 -0.85 -4.99 117.16 113.56 2kyz n TYR 59 Ca -0.03 -4.11 -0.41 0.00 -0.01 0.00 0.00 57.90 53.34 2kyz n TYR 59 Cb 0.29 -0.78 -0.03 0.00 -0.02 0.00 0.00 39.34 38.81 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 -1.84 4.36 0.05 -0.72 0.04 -1.26 -3.97 135.00 131.66 2kyz s PRO 60 Ca 0.30 2.12 -0.31 0.00 0.04 0.00 0.00 61.00 63.16 2kyz s PRO 60 Cb 0.01 -3.16 -0.07 0.00 0.04 0.00 0.00 34.50 31.32 2kyz s PRO 60 CO -0.09 -0.27 1.51 0.08 0.04 0.00 0.00 177.00 178.26 2kyz s VAL 61 N -0.07 3.31 -0.02 -0.36 1.01 -1.26 -4.78 120.40 118.23 2kyz s VAL 61 Ca 0.56 0.78 -0.21 0.00 0.00 0.00 0.00 61.98 63.12 2kyz s VAL 61 Cb -0.38 -3.50 -0.12 0.00 0.00 0.00 0.00 36.38 32.38 2kyz s VAL 61 CO 0.41 0.01 0.88 -0.08 0.00 0.00 0.00 175.10 176.31 2kyz h GLU 62 N 7.82 -0.61 -4.49 2.72 4.81 -1.47 -3.48 114.58 119.88 2kyz h GLU 62 Ca -0.41 0.04 -0.19 0.00 -0.13 0.00 0.00 59.36 58.67 2kyz h GLU 62 Cb 1.19 0.14 -0.15 0.00 0.63 0.00 0.00 28.75 30.56 2kyz h GLU 62 CO 0.91 -0.36 -0.67 -1.12 -0.73 0.00 0.00 179.01 177.05 2kyz s SER 63 N -4.84 0.68 0.28 1.04 0.01 -1.25 -5.01 113.70 104.61 2kyz s SER 63 Ca -0.11 -1.11 0.02 0.00 1.31 0.00 0.00 55.95 56.06 2kyz s SER 63 Cb 0.01 0.20 -0.05 0.00 0.21 0.00 0.00 66.02 66.39 2kyz s SER 63 CO 0.36 -0.62 0.12 -0.72 0.41 0.00 0.00 173.24 172.78 2kyz s TYR 64 N -3.86 1.56 -0.22 2.43 -0.85 -1.26 -0.29 117.35 114.86 2kyz s TYR 64 Ca 0.17 -1.24 -0.10 0.00 -0.52 0.00 0.00 57.07 55.39 2kyz s TYR 64 Cb 0.07 -0.89 0.09 0.00 0.38 0.00 0.00 41.96 41.60 2kyz s TYR 64 CO -0.02 -0.39 0.50 -0.65 -1.52 0.00 0.00 175.55 173.47 2kyz s GLN 65 N -3.96 0.45 0.26 -3.49 -0.21 -1.07 -4.93 119.66 106.71 2kyz s GLN 65 Ca 0.37 1.08 -0.30 0.00 0.02 0.00 0.00 55.36 56.53 2kyz s GLN 65 Cb 0.07 0.31 -0.10 0.00 1.00 0.00 0.00 33.01 34.28 2kyz s GLN 65 CO 0.15 -0.20 1.43 -2.00 -2.12 0.00 0.00 175.29 172.55 2kyz s GLU 66 N 2.18 4.27 0.00 2.91 2.12 -1.26 -0.27 118.70 128.65 2kyz s GLU 66 Ca -0.06 2.31 0.00 0.00 0.36 0.00 0.00 54.97 57.58 2kyz s GLU 66 Cb -0.10 -3.10 0.00 0.00 0.26 0.00 0.00 34.13 31.19 2kyz s GLU 66 CO -0.15 -0.41 0.00 1.55 -0.54 0.00 0.00 175.26 175.71