#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 0.64 -0.02 0.03 1.70 -1.26 -2.35 118.95 117.68 2kyz s ARG 2 Ca 0.00 -1.23 -0.04 0.00 -0.47 0.00 0.00 55.73 53.99 2kyz s ARG 2 Cb 0.00 0.16 0.00 0.00 -0.57 0.00 0.00 34.95 34.54 2kyz s ARG 2 CO 0.00 -0.10 0.09 0.71 -1.08 0.00 0.00 175.30 174.92 2kyz s TYR 3 N -3.88 -0.02 -0.26 5.89 2.02 -0.36 -2.62 117.35 118.12 2kyz s TYR 3 Ca 0.08 0.06 -0.08 0.00 -0.37 0.00 0.00 57.07 56.76 2kyz s TYR 3 Cb 0.08 -0.02 -0.02 0.00 -0.40 0.00 0.00 41.96 41.60 2kyz s TYR 3 CO -0.09 -0.13 0.08 0.54 -1.57 0.00 0.00 175.55 174.38 2kyz s VAL 4 N -0.52 4.33 -0.03 0.71 0.11 0.34 -2.37 120.40 122.97 2kyz s VAL 4 Ca -0.06 -0.26 0.03 0.00 -2.93 0.00 0.00 61.98 58.76 2kyz s VAL 4 Cb -0.04 -3.07 -0.03 0.00 -1.53 0.00 0.00 36.38 31.71 2kyz s VAL 4 CO 0.00 0.27 -0.10 -0.76 -3.33 0.00 0.00 175.10 171.18 2kyz s LEU 5 N 1.60 2.97 -0.45 2.54 1.02 -0.67 -1.97 118.68 123.72 2kyz s LEU 5 Ca 0.06 -0.15 -0.10 0.00 0.02 0.00 0.00 54.13 53.95 2kyz s LEU 5 Cb -0.16 -1.66 0.10 0.00 0.02 0.00 0.00 46.19 44.49 2kyz s LEU 5 CO 0.04 0.33 0.32 -0.47 0.02 0.00 0.00 176.35 176.59 2kyz s TYR 6 N -0.85 3.36 -0.77 0.29 5.04 0.58 -0.65 117.35 124.35 2kyz s TYR 6 Ca 0.14 -1.60 -0.03 0.00 -2.44 0.00 0.00 57.07 53.14 2kyz s TYR 6 Cb -0.11 -3.24 0.19 0.00 0.35 0.00 0.00 41.96 39.15 2kyz s TYR 6 CO 0.03 -0.91 0.63 0.08 -1.34 0.00 0.00 175.55 174.04 2kyz s VAL 7 N 1.43 4.17 0.63 3.14 1.01 -0.16 -0.52 120.40 130.10 2kyz s VAL 7 Ca 0.04 -3.36 0.43 0.00 0.00 0.00 0.00 61.98 59.10 2kyz s VAL 7 Cb -0.25 -3.64 0.44 0.00 0.00 0.00 0.00 36.38 32.93 2kyz s VAL 7 CO 0.01 -0.99 2.35 1.55 0.00 0.00 0.00 175.10 178.02 2kyz h PRO 8 N 6.60 0.00 0.00 2.72 0.13 -1.86 -2.32 132.00 137.27 2kyz h PRO 8 Ca 0.08 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 2kyz h PRO 8 Cb 0.89 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.02 2kyz h PRO 8 CO 0.78 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.30 2kyz n ASP 9 N -3.12 0.00 0.00 1.44 8.00 -1.26 -1.93 116.55 119.68 2kyz n ASP 9 Ca -0.03 0.50 0.03 0.00 0.71 0.00 0.00 54.79 56.00 2kyz n ASP 9 Cb 0.09 -0.50 0.18 0.00 -0.02 0.00 0.00 41.12 40.87 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 -1.50 0.00 0.05 0.53 5.41 -0.87 -4.14 119.36 118.85 2kyz n ILE 10 Ca 0.01 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.77 2kyz n ILE 10 Cb 0.07 -0.40 0.02 0.00 -0.71 0.00 0.00 39.64 38.61 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 -0.67 0.00 -4.21 4.38 7.64 -0.81 -4.42 113.62 115.53 2kyz n SER 11 Ca 0.05 -0.03 -0.17 0.00 1.01 0.00 0.00 58.87 59.72 2kyz n SER 11 Cb 0.02 0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.11 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 3.75 0.67 0.03 0.00 -0.26 -1.97 -0.11 115.58 117.69 2kyz h ASN 13 Ca -0.39 0.06 -0.00 0.00 -0.56 0.00 0.00 56.30 55.40 2kyz h ASN 13 Cb 1.19 -0.07 -0.00 0.00 -1.06 0.00 0.00 38.32 38.38 2kyz h ASN 13 CO 0.48 0.36 -0.01 -0.74 -1.06 0.00 0.00 177.43 176.46 2kyz h HIS 14 N 0.78 0.00 -0.01 1.19 2.76 -1.97 -1.67 115.15 116.23 2kyz h HIS 14 Ca 0.42 0.00 -0.16 0.00 -2.20 0.00 0.00 60.37 58.43 2kyz h HIS 14 Cb 0.43 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.37 2kyz h HIS 14 CO -0.06 0.01 -0.73 0.00 -1.30 0.00 0.00 177.93 175.85 2kyz h LYS 16 N 0.06 0.16 -0.22 0.00 3.64 -1.27 -2.33 116.57 116.61 2kyz h LYS 16 Ca -0.02 -0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.41 2kyz h LYS 16 Cb 1.29 -0.04 -0.06 0.00 -0.41 0.00 0.00 32.23 33.01 2kyz h LYS 16 CO 0.10 0.11 -0.17 0.52 -2.27 0.00 0.00 179.45 177.74 2kyz h MET 17 N 0.16 -0.17 -0.38 1.90 2.86 -1.55 -2.99 114.93 114.77 2kyz h MET 17 Ca 0.11 0.01 0.07 0.00 -2.06 0.00 0.00 59.70 57.83 2kyz h MET 17 Cb 0.09 0.04 -0.06 0.00 0.06 0.00 0.00 31.60 31.73 2kyz h MET 17 CO -0.13 -0.11 -0.01 0.00 1.06 0.00 0.00 176.91 177.72 2kyz h ARG 18 N -0.17 0.09 0.57 1.72 3.08 -0.91 0.12 114.38 118.87 2kyz h ARG 18 Ca 0.13 -0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.15 2kyz h ARG 18 Cb 0.36 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.39 2kyz h ARG 18 CO -0.32 0.06 -0.40 0.82 -1.07 0.00 0.00 179.97 179.06 2kyz h ILE 19 N 0.09 0.00 -0.84 2.04 2.04 -1.53 -3.15 117.51 116.17 2kyz h ILE 19 Ca 0.19 0.00 0.03 0.00 1.00 0.00 0.00 64.86 66.08 2kyz h ILE 19 Cb 0.27 0.00 -0.05 0.00 -0.74 0.00 0.00 36.82 36.30 2kyz h ILE 19 CO -0.32 0.00 0.55 -1.28 0.00 0.00 0.00 178.15 177.10 2kyz h SER 20 N -0.92 0.90 -0.83 1.72 0.87 -1.24 -0.07 113.55 113.98 2kyz h SER 20 Ca -0.08 -0.01 0.06 0.00 -1.23 0.00 0.00 61.79 60.53 2kyz h SER 20 Cb 0.75 -0.21 -0.06 0.00 -0.44 0.00 0.00 62.40 62.44 2kyz h SER 20 CO 0.05 0.62 0.51 0.50 -0.53 0.00 0.00 176.83 177.98 2kyz h LYS 21 N 1.05 0.91 0.05 2.24 3.64 -0.76 0.14 116.57 123.84 2kyz h LYS 21 Ca 0.33 -0.05 -0.23 0.00 -1.27 0.00 0.00 60.65 59.42 2kyz h LYS 21 Cb 0.01 -0.20 -0.01 0.00 -0.41 0.00 0.00 32.23 31.62 2kyz h LYS 21 CO -0.09 0.60 -1.04 0.00 -2.27 0.00 0.00 179.45 176.64 2kyz h ALA 22 N 1.40 0.32 -0.16 5.00 0.00 -1.32 -3.23 119.26 121.26 2kyz h ALA 22 Ca 0.37 -0.82 -0.00 0.00 0.00 0.00 0.00 54.91 54.45 2kyz h ALA 22 Cb 0.18 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2kyz h ALA 22 CO -0.18 0.99 0.08 -0.07 0.00 0.00 0.00 179.25 180.08 2kyz h LEU 23 N 0.08 0.21 -0.35 0.00 3.38 -0.04 -1.92 115.31 116.67 2kyz h LEU 23 Ca -0.07 -0.10 0.05 0.00 0.09 0.00 0.00 57.88 57.85 2kyz h LEU 23 Cb 1.74 -0.05 -0.05 0.00 0.09 0.00 0.00 40.66 42.38 2kyz h LEU 23 CO 0.16 0.25 0.06 -0.33 0.09 0.00 0.00 178.44 178.66 2kyz h GLU 24 N 0.15 0.17 0.00 1.13 4.39 -0.87 -1.04 114.58 118.51 2kyz h GLU 24 Ca 0.06 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.75 2kyz h GLU 24 Cb 0.09 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 28.70 2kyz h GLU 24 CO -0.01 0.11 0.00 0.93 -1.16 0.00 0.00 179.01 178.88 2kyz h GLU 25 N 0.17 0.00 0.00 2.33 5.08 -1.56 -1.44 114.58 119.17 2kyz h GLU 25 Ca 0.17 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 2kyz h GLU 25 Cb 0.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.45 2kyz h GLU 25 CO -0.23 0.00 0.00 -0.11 -1.00 0.00 0.00 179.01 177.67 2kyz n LEU 26 N -2.84 0.00 -1.15 1.33 0.00 -0.41 -4.83 117.00 109.10 2kyz n LEU 26 Ca 0.01 0.35 -0.10 0.00 0.00 0.00 0.00 56.01 56.27 2kyz n LEU 26 Cb 0.31 -0.35 -0.01 0.00 0.00 0.00 0.00 43.42 43.37 2kyz n LEU 26 CO 0.26 -0.27 -0.13 0.61 0.00 0.00 0.00 177.39 177.86 2kyz n GLY 27 N -0.74 0.05 3.76 -3.96 0.00 -0.54 -5.02 105.19 98.74 2kyz n GLY 27 Ca 0.03 -0.46 -0.36 0.00 0.00 0.00 0.00 46.02 45.22 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 -2.51 2.65 -0.02 1.61 0.11 -1.15 -4.96 120.40 116.14 2kyz s VAL 28 Ca 0.00 0.42 0.09 0.00 -2.93 0.00 0.00 61.98 59.56 2kyz s VAL 28 Cb 0.00 -3.18 -0.13 0.00 -1.53 0.00 0.00 36.38 31.54 2kyz s VAL 28 CO 0.00 -0.07 0.17 0.29 -3.33 0.00 0.00 175.10 172.16 2kyz n LYS 29 N -1.38 0.60 -3.58 1.54 5.02 -1.26 -4.82 118.16 114.28 2kyz n LYS 29 Ca 0.12 -0.07 -0.16 0.00 -2.02 0.00 0.00 58.31 56.19 2kyz n LYS 29 Cb 0.49 -1.21 -0.13 0.00 -0.02 0.00 0.00 35.03 34.16 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 -3.15 0.80 0.32 4.39 -0.87 -1.26 -5.09 114.94 110.09 2kyz s ASN 30 Ca -0.03 0.22 -0.19 0.00 -1.57 0.00 0.00 52.86 51.28 2kyz s ASN 30 Cb 0.05 0.54 0.04 0.00 -0.02 0.00 0.00 41.25 41.85 2kyz s ASN 30 CO 0.36 -0.28 0.76 -0.72 -2.57 0.00 0.00 177.10 174.65 2kyz s TYR 31 N 2.37 -0.06 -0.03 2.20 1.13 -1.26 -0.62 117.35 121.08 2kyz s TYR 31 Ca 0.04 -0.48 -0.25 0.00 -1.41 0.00 0.00 57.07 54.97 2kyz s TYR 31 Cb -0.14 0.76 0.05 0.00 -1.10 0.00 0.00 41.96 41.54 2kyz s TYR 31 CO -0.10 -1.36 0.54 -2.00 -2.51 0.00 0.00 175.55 170.12 2kyz s GLU 32 N -3.23 0.93 -0.10 -3.49 -6.30 -0.45 -4.91 118.70 101.14 2kyz s GLU 32 Ca 0.13 0.05 -0.09 0.00 -2.50 0.00 0.00 54.97 52.56 2kyz s GLU 32 Cb -0.05 0.43 0.03 0.00 0.00 0.00 0.00 34.13 34.53 2kyz s GLU 32 CO 0.09 -0.29 0.27 0.08 0.02 0.00 0.00 175.26 175.43 2kyz s VAL 33 N -1.40 -0.00 -0.02 3.70 1.01 -1.26 -1.30 120.40 121.13 2kyz s VAL 33 Ca -0.11 0.01 -0.00 0.00 0.00 0.00 0.00 61.98 61.87 2kyz s VAL 33 Cb -0.02 -0.39 0.03 0.00 0.00 0.00 0.00 36.38 36.00 2kyz s VAL 33 CO 0.07 0.00 0.03 -0.44 0.00 0.00 0.00 175.10 174.76 2kyz s SER 34 N 0.19 0.06 0.05 3.32 0.01 -0.67 -5.01 113.70 111.65 2kyz s SER 34 Ca -0.00 0.04 -0.18 0.00 1.31 0.00 0.00 55.95 57.11 2kyz s SER 34 Cb -0.02 -0.06 -0.16 0.00 0.21 0.00 0.00 66.02 65.99 2kyz s SER 34 CO -0.00 -0.11 1.26 0.58 0.41 0.00 0.00 173.24 175.38 2kyz h VAL 35 N 6.14 1.36 0.13 3.43 2.07 -1.89 -0.46 116.25 127.03 2kyz h VAL 35 Ca -0.43 -1.72 0.02 0.00 0.82 0.00 0.00 66.70 65.39 2kyz h VAL 35 Cb 1.13 2.09 -0.04 0.00 -1.52 0.00 0.00 31.29 32.96 2kyz h VAL 35 CO 0.48 0.52 -0.29 -0.33 0.02 0.00 0.00 177.57 177.98 2kyz h GLU 36 N 0.13 -0.49 0.00 1.57 4.39 -1.96 -3.20 114.58 115.01 2kyz h GLU 36 Ca -0.02 0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.72 2kyz h GLU 36 Cb 1.05 0.11 0.00 0.00 -0.10 0.00 0.00 28.75 29.81 2kyz h GLU 36 CO 0.09 -0.33 -0.46 0.39 -1.16 0.00 0.00 179.01 177.55 2kyz n GLU 37 N -5.40 0.12 -2.53 2.33 1.02 -1.24 -4.94 120.64 110.01 2kyz n GLU 37 Ca -0.07 0.04 -0.17 0.00 -0.02 0.00 0.00 57.16 56.94 2kyz n GLU 37 Cb 0.31 -1.58 -0.00 0.00 -0.02 0.00 0.00 31.44 30.14 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 -1.76 -2.33 -4.39 3.49 5.02 -0.19 -4.98 118.16 113.02 2kyz n LYS 38 Ca 0.05 0.78 -0.22 0.00 -2.02 0.00 0.00 58.31 56.90 2kyz n LYS 38 Cb 0.38 -5.44 -0.10 0.00 -0.02 0.00 0.00 35.03 29.84 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 -5.16 1.45 0.20 1.97 1.02 -1.17 -0.99 119.74 117.06 2kyz s LYS 39 Ca 0.05 -1.60 0.06 0.00 0.02 0.00 0.00 55.97 54.51 2kyz s LYS 39 Cb -0.02 -1.47 -0.05 0.00 -0.52 0.00 0.00 37.83 35.77 2kyz s LYS 39 CO 0.06 0.28 -0.11 0.08 -0.92 0.00 0.00 175.35 174.74 2kyz s VAL 40 N -2.44 1.51 0.02 3.17 1.01 0.18 -1.66 120.40 122.19 2kyz s VAL 40 Ca 0.23 -2.15 0.06 0.00 0.00 0.00 0.00 61.98 60.13 2kyz s VAL 40 Cb -0.04 -2.07 -0.02 0.00 0.00 0.00 0.00 36.38 34.25 2kyz s VAL 40 CO 0.10 -0.58 -0.19 -0.69 0.00 0.00 0.00 175.10 173.74 2kyz s VAL 41 N -3.11 1.52 0.14 2.92 1.01 -0.42 -1.66 120.40 120.80 2kyz s VAL 41 Ca 0.22 -1.03 0.10 0.00 0.00 0.00 0.00 61.98 61.27 2kyz s VAL 41 Cb 0.01 -1.31 -0.04 0.00 0.00 0.00 0.00 36.38 35.04 2kyz s VAL 41 CO 0.06 0.25 -0.20 0.68 0.00 0.00 0.00 175.10 175.90 2kyz s VAL 42 N -0.68 2.70 -0.46 2.92 -7.23 -1.00 -1.34 120.40 115.31 2kyz s VAL 42 Ca 0.07 -1.67 0.00 0.00 -1.81 0.00 0.00 61.98 58.57 2kyz s VAL 42 Cb -0.08 -2.26 0.12 0.00 0.56 0.00 0.00 36.38 34.72 2kyz s VAL 42 CO 0.01 0.03 0.23 -0.70 -0.31 0.00 0.00 175.10 174.35 2kyz s GLU 43 N -2.32 1.98 0.17 4.82 2.12 0.21 -1.22 118.70 124.46 2kyz s GLU 43 Ca 0.19 -2.15 -0.14 0.00 0.36 0.00 0.00 54.97 53.22 2kyz s GLU 43 Cb -0.10 -3.46 0.02 0.00 0.26 0.00 0.00 34.13 30.85 2kyz s GLU 43 CO 0.10 -1.07 0.42 -0.08 -0.54 0.00 0.00 175.26 174.09 2kyz s THR 44 N 0.52 0.05 0.18 -1.70 -1.32 -0.99 -4.43 115.64 107.96 2kyz s THR 44 Ca 0.13 -0.96 -0.06 0.00 -1.21 0.00 0.00 61.69 59.59 2kyz s THR 44 Cb -0.22 -1.60 -0.03 0.00 -1.51 0.00 0.00 72.50 69.15 2kyz s THR 44 CO -0.04 -0.22 1.53 1.05 -2.21 0.00 0.00 174.62 174.73 2kyz h GLU 45 N 2.35 0.73 -2.15 7.08 4.11 -1.98 -3.41 114.58 121.31 2kyz h GLU 45 Ca -0.30 -0.39 -0.70 0.00 0.07 0.00 0.00 59.36 58.03 2kyz h GLU 45 Cb 1.25 0.02 -0.22 0.00 0.50 0.00 0.00 28.75 30.29 2kyz h GLU 45 CO 0.43 1.01 1.08 -1.71 0.07 0.00 0.00 179.01 179.89 2kyz n ASN 46 N -4.03 7.29 -0.29 3.06 5.15 -1.26 -4.73 115.26 120.45 2kyz n ASN 46 Ca -0.02 -3.53 0.13 0.00 -0.60 0.00 0.00 54.58 50.56 2kyz n ASN 46 Cb 0.54 -1.18 0.38 0.00 -0.53 0.00 0.00 39.78 38.99 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 3.90 0.65 -1.35 1.20 5.85 -2.01 -1.77 115.31 121.77 2kyz h LEU 47 Ca 0.54 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 59.31 2kyz h LEU 47 Cb 0.31 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.24 2kyz h LEU 47 CO 1.24 0.30 0.36 -0.78 -0.34 0.00 0.00 178.44 179.22 2kyz h ASP 48 N 0.68 0.70 -0.58 1.25 3.58 -1.99 0.86 116.42 120.92 2kyz h ASP 48 Ca 0.48 -0.03 -0.02 0.00 0.42 0.00 0.00 57.03 57.88 2kyz h ASP 48 Cb 0.82 -0.18 -0.03 0.00 1.72 0.00 0.00 39.33 41.66 2kyz h ASP 48 CO -0.24 0.54 0.30 -1.28 -2.88 0.00 0.00 179.24 175.68 2kyz h SER 49 N 0.82 0.76 0.16 2.28 0.87 -1.73 0.51 113.55 117.22 2kyz h SER 49 Ca 0.22 -0.07 -0.01 0.00 -1.23 0.00 0.00 61.79 60.70 2kyz h SER 49 Cb -0.04 -0.19 0.00 0.00 -0.44 0.00 0.00 62.40 61.73 2kyz h SER 49 CO -0.04 0.64 -0.07 0.58 -0.53 0.00 0.00 176.83 177.40 2kyz h VAL 50 N 0.85 0.98 -0.76 2.23 2.07 -0.91 -0.90 116.25 119.81 2kyz h VAL 50 Ca 0.21 -0.85 0.05 0.00 0.82 0.00 0.00 66.70 66.93 2kyz h VAL 50 Cb 0.07 1.48 -0.05 0.00 -1.52 0.00 0.00 31.29 31.27 2kyz h VAL 50 CO -0.03 0.19 0.47 -0.07 0.02 0.00 0.00 177.57 178.15 2kyz h LEU 51 N -0.64 0.74 0.14 2.57 3.38 -0.80 0.65 115.31 121.34 2kyz h LEU 51 Ca -0.02 0.01 0.02 0.00 0.09 0.00 0.00 57.88 57.98 2kyz h LEU 51 Cb 0.47 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.04 2kyz h LEU 51 CO 0.04 0.49 -0.40 0.11 0.09 0.00 0.00 178.44 178.76 2kyz h LYS 52 N 0.87 -0.62 -0.80 1.13 1.79 -0.94 -0.28 116.57 117.73 2kyz h LYS 52 Ca 0.33 0.04 0.07 0.00 -2.18 0.00 0.00 60.65 58.91 2kyz h LYS 52 Cb 0.12 0.14 -0.06 0.00 -1.58 0.00 0.00 32.23 30.85 2kyz h LYS 52 CO -0.15 -0.42 0.47 -0.22 -1.08 0.00 0.00 179.45 178.05 2kyz h LYS 53 N -0.65 0.80 -0.18 3.15 1.63 -0.03 0.21 116.57 121.51 2kyz h LYS 53 Ca 0.02 -0.05 -0.01 0.00 -0.85 0.00 0.00 60.65 59.76 2kyz h LYS 53 Cb 0.67 -0.18 -0.01 0.00 -0.60 0.00 0.00 32.23 32.11 2kyz h LYS 53 CO -0.22 0.53 0.06 -0.07 -3.45 0.00 0.00 179.45 176.30 2kyz h LEU 54 N 0.83 0.26 -0.55 5.20 -0.00 -0.35 -1.72 115.31 118.98 2kyz h LEU 54 Ca 0.36 -0.19 -0.11 0.00 -0.00 0.00 0.00 57.88 57.94 2kyz h LEU 54 Cb 0.25 -0.07 -0.02 0.00 -0.00 0.00 0.00 40.66 40.82 2kyz h LEU 54 CO -0.20 0.38 -0.08 -0.33 -0.00 0.00 0.00 178.44 178.20 2kyz h GLU 55 N 0.13 1.03 0.00 1.13 5.08 -0.75 -2.02 114.58 119.18 2kyz h GLU 55 Ca 0.06 -0.37 0.00 0.00 -1.00 0.00 0.00 59.36 58.05 2kyz h GLU 55 Cb 0.21 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.39 2kyz h GLU 55 CO -0.00 1.06 0.00 0.39 -1.00 0.00 0.00 179.01 179.46 2kyz n GLU 56 N -4.17 0.00 -0.77 2.33 -0.58 0.04 -1.29 120.64 116.20 2kyz n GLU 56 Ca 0.02 0.31 0.02 0.00 -0.42 0.00 0.00 57.16 57.09 2kyz n GLU 56 Cb 0.39 -1.50 0.30 0.00 -0.57 0.00 0.00 31.44 30.06 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 -1.50 2.64 -0.99 -3.67 -5.35 -0.66 -4.95 119.36 104.88 2kyz n ILE 57 Ca 0.03 -1.79 0.00 0.00 -0.27 0.00 0.00 62.75 60.72 2kyz n ILE 57 Cb 0.13 -0.30 0.00 0.00 -1.74 0.00 0.00 39.64 37.73 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 -0.21 -3.50 -4.03 7.28 2.03 -0.41 -4.97 116.55 112.75 2kyz n ASP 58 Ca 0.30 0.00 -0.33 0.00 0.52 0.00 0.00 54.79 55.28 2kyz n ASP 58 Cb 1.14 -1.16 -0.10 0.00 -0.72 0.00 0.00 41.12 40.29 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 -1.85 3.58 -0.15 -0.67 1.51 -0.84 -5.02 117.35 113.91 2kyz s TYR 59 Ca 0.00 -3.05 -0.29 0.00 -1.01 0.00 0.00 57.07 52.72 2kyz s TYR 59 Cb 0.00 -3.04 -0.03 0.00 -0.11 0.00 0.00 41.96 38.78 2kyz s TYR 59 CO 0.00 -0.72 1.54 -1.25 -1.11 0.00 0.00 175.55 174.01 2kyz s PRO 60 N -0.88 4.04 0.35 -1.71 0.04 -1.26 -3.55 135.00 132.03 2kyz s PRO 60 Ca 0.22 1.85 -0.29 0.00 0.04 0.00 0.00 61.00 62.82 2kyz s PRO 60 Cb -0.13 -3.95 -0.11 0.00 0.04 0.00 0.00 34.50 30.35 2kyz s PRO 60 CO -0.09 -0.99 1.54 0.54 0.04 0.00 0.00 177.00 178.04 2kyz s VAL 61 N 4.36 2.01 -0.02 -0.36 0.11 -1.26 -4.78 120.40 120.47 2kyz s VAL 61 Ca 0.68 0.01 -0.21 0.00 -2.93 0.00 0.00 61.98 59.53 2kyz s VAL 61 Cb -0.27 -3.00 -0.13 0.00 -1.53 0.00 0.00 36.38 31.44 2kyz s VAL 61 CO 0.26 0.00 0.92 -0.08 -3.33 0.00 0.00 175.10 172.87 2kyz h GLU 62 N 3.70 -0.50 -3.73 1.54 4.81 -1.19 -3.48 114.58 115.73 2kyz h GLU 62 Ca -0.49 0.03 -0.08 0.00 -0.13 0.00 0.00 59.36 58.69 2kyz h GLU 62 Cb 1.23 0.11 -0.14 0.00 0.63 0.00 0.00 28.75 30.59 2kyz h GLU 62 CO 0.70 -0.21 -0.32 -1.54 -0.73 0.00 0.00 179.01 176.91 2kyz s SER 63 N -4.99 0.06 0.36 1.04 1.04 -1.25 -5.01 113.70 104.94 2kyz s SER 63 Ca -0.12 -0.58 0.04 0.00 0.48 0.00 0.00 55.95 55.77 2kyz s SER 63 Cb 0.01 0.36 -0.03 0.00 0.10 0.00 0.00 66.02 66.46 2kyz s SER 63 CO 0.40 -0.74 0.13 -0.72 0.98 0.00 0.00 173.24 173.29 2kyz s TYR 64 N -3.80 1.76 -0.13 5.02 1.13 -1.26 -0.31 117.35 119.75 2kyz s TYR 64 Ca 0.04 -1.27 -0.33 0.00 -1.41 0.00 0.00 57.07 54.10 2kyz s TYR 64 Cb 0.04 -1.07 0.13 0.00 -1.10 0.00 0.00 41.96 39.96 2kyz s TYR 64 CO -0.11 -0.34 1.12 1.14 -2.51 0.00 0.00 175.55 174.85 2kyz s GLN 65 N -3.76 0.46 0.78 -3.49 -2.07 -0.83 -4.98 119.66 105.76 2kyz s GLN 65 Ca 0.30 -0.17 -0.13 0.00 -1.82 0.00 0.00 55.36 53.54 2kyz s GLN 65 Cb 0.04 0.21 0.07 0.00 -1.09 0.00 0.00 33.01 32.24 2kyz s GLN 65 CO 0.16 -0.20 1.17 -2.00 -1.32 0.00 0.00 175.29 173.10 2kyz s GLU 66 N -2.62 1.90 0.00 9.60 2.12 -1.26 -0.50 118.70 127.93 2kyz s GLU 66 Ca 0.08 1.60 0.00 0.00 0.36 0.00 0.00 54.97 57.01 2kyz s GLU 66 Cb -0.01 -1.82 0.00 0.00 0.26 0.00 0.00 34.13 32.56 2kyz s GLU 66 CO -0.06 -1.99 0.00 1.33 -0.54 0.00 0.00 175.26 174.00