#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2krs s GLN 2 N 0.00 2.15 0.27 2.12 -1.52 -1.26 -4.06 119.66 117.36 2krs s GLN 2 Ca 0.00 -0.52 -0.16 0.00 -1.95 0.00 0.00 55.36 52.73 2krs s GLN 2 Cb 0.00 -1.90 -0.08 0.00 -0.22 0.00 0.00 33.01 30.80 2krs s GLN 2 CO 0.00 -0.13 0.69 0.20 -0.25 0.00 0.00 175.29 175.80 2krs s GLY 3 N 1.19 2.41 -0.08 3.09 0.00 -0.02 -4.19 107.32 109.73 2krs s GLY 3 Ca -0.02 0.02 0.03 0.00 0.00 0.00 0.00 44.72 44.75 2krs s GLY 3 CO -0.05 0.27 -0.17 0.14 0.00 0.00 0.00 173.10 173.29 2krs s VAL 4 N -1.80 1.53 -0.15 1.40 1.01 -1.09 -2.13 120.40 119.18 2krs s VAL 4 Ca 0.49 -0.72 -0.17 0.00 0.00 0.00 0.00 61.98 61.58 2krs s VAL 4 Cb -0.12 -1.36 -0.04 0.00 0.00 0.00 0.00 36.38 34.86 2krs s VAL 4 CO 0.19 0.44 0.45 -0.69 0.00 0.00 0.00 175.10 175.50 2krs s VAL 5 N 0.50 5.19 -0.29 2.92 1.01 -1.17 -1.87 120.40 126.69 2krs s VAL 5 Ca -0.16 0.88 0.03 0.00 0.00 0.00 0.00 61.98 62.73 2krs s VAL 5 Cb -0.17 -3.79 0.08 0.00 0.00 0.00 0.00 36.38 32.50 2krs s VAL 5 CO 0.06 0.30 -0.02 -0.54 0.00 0.00 0.00 175.10 174.90 2krs s LYS 6 N 0.85 1.72 0.06 2.72 -0.14 -1.17 -1.83 119.74 121.94 2krs s LYS 6 Ca 0.24 -1.48 -0.01 0.00 -1.36 0.00 0.00 55.97 53.37 2krs s LYS 6 Cb -0.15 -2.90 -0.04 0.00 -1.68 0.00 0.00 37.83 33.06 2krs s LYS 6 CO 0.09 -0.75 -0.04 0.14 -0.76 0.00 0.00 175.35 174.03 2krs s VAL 7 N 1.11 0.29 -0.78 3.17 -7.23 -1.26 -4.81 120.40 110.90 2krs s VAL 7 Ca 0.01 -1.80 0.26 0.00 -1.81 0.00 0.00 61.98 58.64 2krs s VAL 7 Cb -0.19 -1.50 0.25 0.00 0.56 0.00 0.00 36.38 35.49 2krs s VAL 7 CO -0.08 -0.96 1.74 -3.20 -0.31 0.00 0.00 175.10 172.29 2krs n ASN 8 N 0.14 0.65 -0.62 4.85 2.85 -1.26 -4.69 115.26 117.18 2krs n ASN 8 Ca -0.14 0.49 0.00 0.00 -0.11 0.00 0.00 54.58 54.82 2krs n ASN 8 Cb 0.61 -0.61 0.00 0.00 1.24 0.00 0.00 39.78 41.02 2krs n ASN 8 CO 0.00 0.00 0.00 -0.24 -2.11 0.00 0.00 177.26 174.91 2krs n SER 9 N -2.09 0.00 -4.77 1.20 2.88 -1.26 -5.04 113.62 104.54 2krs n SER 9 Ca 0.06 -0.62 -0.39 0.00 -1.33 0.00 0.00 58.87 56.59 2krs n SER 9 Cb 0.41 0.00 -0.00 0.00 -0.75 0.00 0.00 64.21 63.87 2krs n SER 9 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2krs s ALA 10 N -1.04 3.20 -0.07 -1.46 0.00 -1.26 -4.35 121.76 116.77 2krs s ALA 10 Ca 0.00 1.23 0.04 0.00 0.00 0.00 0.00 51.96 53.22 2krs s ALA 10 Cb 0.00 -3.49 0.00 0.00 0.00 0.00 0.00 23.12 19.63 2krs s ALA 10 CO 0.00 -0.87 -0.19 -1.17 0.00 0.00 0.00 175.76 173.53 2krs s LEU 11 N -2.58 1.91 0.33 0.00 2.96 -0.49 -4.94 118.68 115.87 2krs s LEU 11 Ca 0.59 -0.42 -0.27 0.00 -0.22 0.00 0.00 54.13 53.81 2krs s LEU 11 Cb -0.38 -1.12 -0.09 0.00 0.50 0.00 0.00 46.19 45.10 2krs s LEU 11 CO 0.48 0.13 1.06 0.20 -1.32 0.00 0.00 176.35 176.90 2krs s ASN 12 N 0.28 7.07 0.09 3.68 0.02 -1.26 0.32 114.94 125.14 2krs s ASN 12 Ca -0.11 2.13 0.04 0.00 -1.02 0.00 0.00 52.86 53.90 2krs s ASN 12 Cb -0.15 -2.61 -0.04 0.00 0.02 0.00 0.00 41.25 38.47 2krs s ASN 12 CO 0.05 -0.28 0.05 -0.32 0.02 0.00 0.00 177.10 176.62 2krs s MET 13 N -1.91 2.73 0.21 -0.60 -2.45 -0.67 -4.88 119.30 111.74 2krs s MET 13 Ca 0.50 -0.77 0.10 0.00 -1.25 0.00 0.00 55.69 54.28 2krs s MET 13 Cb -0.27 -2.64 -0.05 0.00 1.25 0.00 0.00 34.83 33.13 2krs s MET 13 CO 0.34 0.55 -0.20 1.03 1.05 0.00 0.00 175.02 177.79 2krs s ARG 14 N -2.40 1.47 0.00 4.11 0.52 -1.07 -2.58 118.95 119.00 2krs s ARG 14 Ca 0.28 -1.57 0.30 0.00 -0.52 0.00 0.00 55.73 54.22 2krs s ARG 14 Cb -0.12 -1.58 1.41 0.00 0.52 0.00 0.00 34.95 35.19 2krs s ARG 14 CO 0.20 0.31 2.00 -1.13 0.02 0.00 0.00 175.30 176.70 2krs n SER 15 N -0.05 0.07 -0.89 0.23 3.41 -1.26 -0.08 113.62 115.04 2krs n SER 15 Ca -0.10 -0.09 0.00 0.00 -0.26 0.00 0.00 58.87 58.42 2krs n SER 15 Cb 0.58 -0.28 0.00 0.00 -0.26 0.00 0.00 64.21 64.25 2krs n SER 15 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2krs n GLY 16 N 1.33 2.35 0.25 5.00 0.00 -1.26 -4.56 105.19 108.30 2krs n GLY 16 Ca 0.13 -1.06 0.03 0.00 0.00 0.00 0.00 46.02 45.12 2krs n GLY 16 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2krs n PRO 17 N 0.00 1.31 -3.57 1.61 -0.04 -1.26 -4.54 135.00 128.51 2krs n PRO 17 Ca 0.00 -0.49 -0.37 0.00 -0.04 0.00 0.00 63.50 62.61 2krs n PRO 17 Cb 0.00 -1.13 -0.08 0.00 -0.04 0.00 0.00 33.50 32.25 2krs n PRO 17 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2krs s GLY 18 N -1.06 2.08 0.04 0.55 0.00 -1.26 -4.94 107.32 102.72 2krs s GLY 18 Ca 0.11 -0.65 0.17 0.00 0.00 0.00 0.00 44.72 44.36 2krs s GLY 18 CO 0.08 0.47 1.54 -1.14 0.00 0.00 0.00 173.10 174.05 2krs n SER 19 N 4.01 0.10 -1.35 1.64 3.41 -1.26 -2.02 113.62 118.15 2krs n SER 19 Ca -0.13 0.52 0.08 0.00 -0.26 0.00 0.00 58.87 59.09 2krs n SER 19 Cb 0.52 -0.55 0.33 0.00 -0.26 0.00 0.00 64.21 64.25 2krs n SER 19 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 2krs n ASN 20 N -1.61 4.73 -0.21 4.04 0.23 -1.26 -4.40 115.26 116.78 2krs n ASN 20 Ca 0.04 -2.97 0.14 0.00 -0.53 0.00 0.00 54.58 51.26 2krs n ASN 20 Cb 0.20 -0.61 0.59 0.00 -2.08 0.00 0.00 39.78 37.88 2krs n ASN 20 CO 0.00 0.00 0.00 -1.22 -0.93 0.00 0.00 177.26 175.11 2krs n TYR 21 N 0.03 0.00 0.00 -2.53 4.02 -0.86 -5.04 117.16 112.78 2krs n TYR 21 Ca 0.24 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.13 2krs n TYR 21 Cb 1.03 -0.11 0.00 0.00 -0.02 0.00 0.00 39.34 40.24 2krs n TYR 21 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2krs n GLY 22 N 1.23 -1.84 3.60 2.72 0.00 -1.26 -4.69 105.19 104.95 2krs n GLY 22 Ca 0.16 -1.52 -0.36 0.00 0.00 0.00 0.00 46.02 44.30 2krs n GLY 22 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2krs s VAL 23 N -2.14 4.99 -1.96 1.61 0.11 -1.26 -4.41 120.40 117.34 2krs s VAL 23 Ca 0.00 0.05 0.16 0.00 -2.93 0.00 0.00 61.98 59.26 2krs s VAL 23 Cb 0.00 -3.31 0.12 0.00 -1.53 0.00 0.00 36.38 31.66 2krs s VAL 23 CO 0.00 0.36 0.99 2.30 -3.33 0.00 0.00 175.10 175.43 2krs n ILE 24 N 4.31 0.00 -3.61 7.04 -5.35 -1.06 -5.01 119.36 115.68 2krs n ILE 24 Ca -0.16 -0.49 0.00 0.00 -0.27 0.00 0.00 62.75 61.84 2krs n ILE 24 Cb 0.52 1.32 -0.01 0.00 -1.74 0.00 0.00 39.64 39.74 2krs n ILE 24 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 2krs s GLY 25 N -1.34 -0.39 -0.08 3.28 0.00 -1.26 -5.03 107.32 102.50 2krs s GLY 25 Ca 0.18 0.92 0.04 0.00 0.00 0.00 0.00 44.72 45.85 2krs s GLY 25 CO 0.21 0.22 -0.19 -1.59 0.00 0.00 0.00 173.10 171.75 2krs s THR 26 N -2.39 1.63 0.27 0.90 2.01 -1.26 -1.66 115.64 115.13 2krs s THR 26 Ca 0.13 -0.78 0.06 0.00 0.31 0.00 0.00 61.69 61.41 2krs s THR 26 Cb 0.04 -1.43 -0.03 0.00 0.01 0.00 0.00 72.50 71.09 2krs s THR 26 CO -0.04 0.46 0.34 -0.76 -0.69 0.00 0.00 174.62 173.94 2krs s LEU 27 N 0.38 4.09 0.17 4.42 1.43 0.15 -4.93 118.68 124.38 2krs s LEU 27 Ca -0.14 -0.09 0.07 0.00 -1.03 0.00 0.00 54.13 52.94 2krs s LEU 27 Cb -0.16 -2.68 -0.04 0.00 0.03 0.00 0.00 46.19 43.33 2krs s LEU 27 CO 0.06 -0.16 -0.14 -0.13 0.23 0.00 0.00 176.35 176.20 2krs s ARG 28 N -3.99 1.21 0.65 1.70 0.52 -1.26 -1.39 118.95 116.38 2krs s ARG 28 Ca 0.37 -1.45 -0.18 0.00 -0.52 0.00 0.00 55.73 53.95 2krs s ARG 28 Cb -0.09 -1.04 -0.02 0.00 0.52 0.00 0.00 34.95 34.33 2krs s ARG 28 CO 0.28 0.18 1.09 0.27 0.02 0.00 0.00 175.30 177.15 2krs n ASN 29 N -0.00 1.19 -3.08 0.23 0.23 -1.26 -2.65 115.26 109.91 2krs n ASN 29 Ca -0.11 0.78 -0.23 0.00 -0.53 0.00 0.00 54.58 54.49 2krs n ASN 29 Cb 0.59 -1.46 0.03 0.00 -2.08 0.00 0.00 39.78 36.86 2krs n ASN 29 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 2krs n ASN 30 N -1.43 -5.84 -4.58 0.53 2.85 -0.76 -4.94 115.26 101.09 2krs n ASN 30 Ca 0.15 -0.31 -0.42 0.00 -0.11 0.00 0.00 54.58 53.89 2krs n ASN 30 Cb 0.48 -4.72 -0.06 0.00 1.24 0.00 0.00 39.78 36.72 2krs n ASN 30 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 177.26 174.53 2krs s ASP 31 N -2.72 6.49 -0.15 1.20 2.15 -1.09 -4.91 116.67 117.63 2krs s ASP 31 Ca 0.33 0.24 -0.26 0.00 0.43 0.00 0.00 52.55 53.29 2krs s ASP 31 Cb -0.15 -2.36 -0.02 0.00 -0.30 0.00 0.00 42.92 40.09 2krs s ASP 31 CO 0.40 -0.67 0.84 -0.54 -0.17 0.00 0.00 175.17 175.04 2krs s LYS 32 N 2.91 4.33 0.11 4.34 1.02 -1.26 -3.04 119.74 128.14 2krs s LYS 32 Ca 0.28 1.05 0.00 0.00 0.02 0.00 0.00 55.97 57.32 2krs s LYS 32 Cb -0.14 -3.56 -0.04 0.00 -0.52 0.00 0.00 37.83 33.57 2krs s LYS 32 CO 0.16 -0.29 -0.01 0.14 -0.92 0.00 0.00 175.35 174.44 2krs s VAL 33 N 2.00 0.36 -0.04 3.17 -7.23 -0.91 -5.03 120.40 112.72 2krs s VAL 33 Ca 0.40 -1.90 -0.12 0.00 -1.81 0.00 0.00 61.98 58.55 2krs s VAL 33 Cb -0.17 -1.82 -0.05 0.00 0.56 0.00 0.00 36.38 34.90 2krs s VAL 33 CO 0.14 -0.72 0.30 -0.70 -0.31 0.00 0.00 175.10 173.81 2krs s GLU 34 N -3.94 3.73 -0.21 4.82 2.12 -1.26 -0.84 118.70 123.11 2krs s GLU 34 Ca 0.16 0.20 -0.08 0.00 0.36 0.00 0.00 54.97 55.61 2krs s GLU 34 Cb 0.07 -3.20 -0.04 0.00 0.26 0.00 0.00 34.13 31.22 2krs s GLU 34 CO -0.03 0.72 0.08 0.42 -0.54 0.00 0.00 175.26 175.91 2krs s ILE 35 N -1.07 4.67 -0.23 -3.70 1.01 -1.26 -2.09 121.20 118.53 2krs s ILE 35 Ca 0.21 -0.07 -0.19 0.00 0.00 0.00 0.00 60.65 60.60 2krs s ILE 35 Cb -0.15 -3.14 -0.17 0.00 0.01 0.00 0.00 42.46 39.01 2krs s ILE 35 CO 0.10 0.40 0.04 -0.38 0.00 0.00 0.00 174.94 175.10 2krs n ILE 36 N 4.17 1.54 -3.58 2.92 5.41 -1.23 -4.98 119.36 123.61 2krs n ILE 36 Ca -0.16 -0.16 -0.06 0.00 1.00 0.00 0.00 62.75 63.37 2krs n ILE 36 Cb 0.52 -1.98 -0.03 0.00 -0.71 0.00 0.00 39.64 37.45 2krs n ILE 36 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 2krs s LYS 37 N -2.42 0.44 -0.01 0.38 2.20 -1.26 -5.04 119.74 114.04 2krs s LYS 37 Ca -0.32 -0.11 0.02 0.00 -0.36 0.00 0.00 55.97 55.21 2krs s LYS 37 Cb 0.09 0.21 -0.03 0.00 -1.51 0.00 0.00 37.83 36.58 2krs s LYS 37 CO 0.57 -0.18 -0.05 -1.83 -0.36 0.00 0.00 175.35 173.50 2krs s GLU 38 N -2.27 2.65 -0.08 4.03 1.03 -1.26 -1.45 118.70 121.35 2krs s GLU 38 Ca 0.07 -0.66 0.01 0.00 0.03 0.00 0.00 54.97 54.42 2krs s GLU 38 Cb -0.01 -2.56 0.02 0.00 -0.80 0.00 0.00 34.13 30.78 2krs s GLU 38 CO -0.05 0.62 -0.09 0.08 -1.33 0.00 0.00 175.26 174.49 2krs s VAL 39 N -0.99 1.00 -0.99 1.83 1.01 -0.25 -4.78 120.40 117.23 2krs s VAL 39 Ca 0.17 -0.35 -0.00 0.00 0.00 0.00 0.00 61.98 61.79 2krs s VAL 39 Cb -0.11 -0.96 0.00 0.00 0.00 0.00 0.00 36.38 35.31 2krs s VAL 39 CO 0.07 0.34 0.02 0.47 0.00 0.00 0.00 175.10 176.00 2krs n ASP 40 N 4.26 -3.69 0.00 3.32 8.00 -1.26 -0.17 116.55 127.01 2krs n ASP 40 Ca -0.19 0.19 0.00 0.00 0.71 0.00 0.00 54.79 55.50 2krs n ASP 40 Cb 0.51 -3.14 0.00 0.00 -0.02 0.00 0.00 41.12 38.47 2krs n ASP 40 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2krs n GLY 41 N -0.80 0.71 2.95 0.44 0.00 -1.26 -5.05 105.19 102.18 2krs n GLY 41 Ca -0.13 -0.70 -0.31 0.00 0.00 0.00 0.00 46.02 44.88 2krs n GLY 41 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2krs s TRP 42 N -2.00 2.76 0.21 1.61 0.52 0.76 -3.94 118.94 118.85 2krs s TRP 42 Ca 0.00 -2.14 -0.30 0.00 0.02 0.00 0.00 56.10 53.68 2krs s TRP 42 Cb 0.00 -1.97 -0.09 0.00 -1.15 0.00 0.00 33.47 30.26 2krs s TRP 42 CO 0.00 -0.85 1.25 0.71 0.02 0.00 0.00 176.95 178.09 2krs s TYR 43 N 1.26 3.33 0.12 -1.98 2.02 -1.13 -1.09 117.35 119.89 2krs s TYR 43 Ca -0.00 1.34 -0.19 0.00 -0.37 0.00 0.00 57.07 57.85 2krs s TYR 43 Cb -0.19 -3.52 -0.07 0.00 -0.40 0.00 0.00 41.96 37.78 2krs s TYR 43 CO -0.09 -1.53 0.61 -1.21 -1.57 0.00 0.00 175.55 171.76 2krs s GLU 44 N -0.34 4.19 0.07 -0.62 2.02 -0.53 -2.07 118.70 121.43 2krs s GLU 44 Ca 0.54 0.74 0.02 0.00 0.02 0.00 0.00 54.97 56.30 2krs s GLU 44 Cb -0.35 -3.11 -0.03 0.00 0.10 0.00 0.00 34.13 30.74 2krs s GLU 44 CO 0.39 0.56 -0.08 0.96 0.02 0.00 0.00 175.26 177.10 2krs s ILE 45 N -1.26 0.67 -0.19 -1.63 -4.36 -1.00 -3.57 121.20 109.84 2krs s ILE 45 Ca 0.34 -1.48 -0.03 0.00 -0.26 0.00 0.00 60.65 59.21 2krs s ILE 45 Cb -0.18 -1.12 -0.01 0.00 1.25 0.00 0.00 42.46 42.39 2krs s ILE 45 CO 0.20 -0.59 -0.05 -0.60 0.24 0.00 0.00 174.94 174.15 2krs s ARG 46 N -2.59 3.45 -0.17 0.37 3.52 -0.89 -2.02 118.95 120.63 2krs s ARG 46 Ca 0.00 -0.61 -0.12 0.00 -0.13 0.00 0.00 55.73 54.88 2krs s ARG 46 Cb -0.03 -2.95 0.05 0.00 -1.56 0.00 0.00 34.95 30.46 2krs s ARG 46 CO -0.02 -0.05 0.42 0.12 -0.81 0.00 0.00 175.30 174.97 2krs s PHE 47 N 1.09 -0.54 -1.51 5.12 5.36 0.90 -4.11 117.98 124.28 2krs s PHE 47 Ca 0.01 1.22 -0.05 0.00 -0.96 0.00 0.00 56.93 57.15 2krs s PHE 47 Cb -0.15 0.22 0.02 0.00 -0.34 0.00 0.00 43.02 42.77 2krs s PHE 47 CO -0.00 -0.29 0.58 -1.71 -1.46 0.00 0.00 175.22 172.34 2krs n ASN 48 N 3.57 -5.70 -1.19 6.13 2.85 -1.26 -0.62 115.26 119.04 2krs n ASN 48 Ca -0.18 -0.30 -0.14 0.00 -0.11 0.00 0.00 54.58 53.85 2krs n ASN 48 Cb 0.56 -4.62 -0.05 0.00 1.24 0.00 0.00 39.78 36.91 2krs n ASN 48 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2krs n GLY 49 N -1.46 1.03 3.18 8.20 0.00 -1.26 -4.99 105.19 109.89 2krs n GLY 49 Ca -0.10 -0.36 -0.21 0.00 0.00 0.00 0.00 46.02 45.35 2krs n GLY 49 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2krs s LYS 50 N -3.55 1.00 -0.12 1.61 1.02 0.21 -5.14 119.74 114.76 2krs s LYS 50 Ca 0.00 -0.86 0.00 0.00 0.02 0.00 0.00 55.97 55.14 2krs s LYS 50 Cb 0.00 -1.05 -0.02 0.00 -0.52 0.00 0.00 37.83 36.25 2krs s LYS 50 CO 0.00 0.25 -0.12 0.08 -0.92 0.00 0.00 175.35 174.64 2krs s VAL 51 N -0.94 3.15 0.00 3.17 1.01 -1.26 -0.07 120.40 125.46 2krs s VAL 51 Ca 0.02 -0.64 0.00 0.00 0.00 0.00 0.00 61.98 61.37 2krs s VAL 51 Cb -0.09 -2.32 0.00 0.00 0.00 0.00 0.00 36.38 33.98 2krs s VAL 51 CO 0.02 0.53 0.00 0.61 0.00 0.00 0.00 175.10 176.26 2krs n GLY 52 N 3.30 4.37 3.26 4.51 0.00 -0.85 -4.95 105.19 114.84 2krs n GLY 52 Ca -0.18 -1.37 -0.20 0.00 0.00 0.00 0.00 46.02 44.27 2krs n GLY 52 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2krs s TYR 53 N -2.06 1.55 0.01 1.61 1.51 0.89 -2.38 117.35 118.47 2krs s TYR 53 Ca 0.00 -0.49 -0.10 0.00 -1.01 0.00 0.00 57.07 55.47 2krs s TYR 53 Cb 0.00 -0.82 0.01 0.00 -0.11 0.00 0.00 41.96 41.04 2krs s TYR 53 CO 0.00 0.19 0.20 0.00 -1.11 0.00 0.00 175.55 174.83 2krs s ALA 54 N -1.78 -0.47 0.44 3.71 0.00 -0.88 -2.60 121.76 120.18 2krs s ALA 54 Ca 0.08 -0.04 -0.25 0.00 0.00 0.00 0.00 51.96 51.75 2krs s ALA 54 Cb -0.07 0.15 -0.08 0.00 0.00 0.00 0.00 23.12 23.12 2krs s ALA 54 CO 0.04 -0.27 1.30 0.45 0.00 0.00 0.00 175.76 177.29 2krs s SER 55 N -1.57 6.11 0.44 0.00 0.15 -1.26 -2.84 113.70 114.73 2krs s SER 55 Ca -0.12 2.64 0.31 0.00 0.70 0.00 0.00 55.95 59.48 2krs s SER 55 Cb -0.05 -2.63 1.37 0.00 -1.71 0.00 0.00 66.02 62.99 2krs s SER 55 CO 0.01 -0.99 1.91 0.07 1.20 0.00 0.00 173.24 175.44 2krs h LYS 56 N 2.39 0.00 -0.45 5.44 2.10 -1.89 -2.75 116.57 121.40 2krs h LYS 56 Ca -0.50 0.00 -0.06 0.00 -2.00 0.00 0.00 60.65 58.09 2krs h LYS 56 Cb 1.26 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.56 2krs h LYS 56 CO 0.61 0.00 0.04 0.77 -2.00 0.00 0.00 179.45 178.87 2krs h SER 57 N 0.00 0.66 -0.58 7.07 0.02 -1.92 -2.84 113.55 115.97 2krs h SER 57 Ca 0.00 -0.13 0.00 0.00 -0.84 0.00 0.00 61.79 60.82 2krs h SER 57 Cb 0.33 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 62.70 2krs h SER 57 CO 0.00 0.71 0.00 -1.22 -1.14 0.00 0.00 176.83 175.18 2krs n TYR 58 N -4.26 0.99 -5.08 3.45 4.01 -1.04 -4.92 117.16 110.30 2krs n TYR 58 Ca 0.03 -0.56 -0.31 0.00 -0.16 0.00 0.00 57.90 56.90 2krs n TYR 58 Cb 0.26 -0.10 -0.17 0.00 -0.31 0.00 0.00 39.34 39.02 2krs n TYR 58 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 2krs s ILE 59 N -1.37 1.91 -0.10 -0.72 -1.09 -1.07 -3.02 121.20 115.74 2krs s ILE 59 Ca 0.42 -0.93 0.03 0.00 -2.23 0.00 0.00 60.65 57.94 2krs s ILE 59 Cb 0.25 -1.66 -0.01 0.00 -1.58 0.00 0.00 42.46 39.46 2krs s ILE 59 CO 0.25 0.53 -0.19 0.42 -1.23 0.00 0.00 174.94 174.72 2krs s THR 60 N 0.42 2.57 -0.05 2.92 -4.23 -0.78 -4.86 115.64 111.63 2krs s THR 60 Ca -0.18 -0.85 -0.26 0.00 -1.18 0.00 0.00 61.69 59.23 2krs s THR 60 Cb -0.17 -2.02 -0.03 0.00 1.34 0.00 0.00 72.50 71.61 2krs s THR 60 CO 0.07 0.55 0.79 -0.63 -0.54 0.00 0.00 174.62 174.87 2krs s ILE 61 N 0.15 4.98 0.01 2.99 1.01 -1.26 -2.68 121.20 126.40 2krs s ILE 61 Ca -0.10 1.65 -0.26 0.00 0.00 0.00 0.00 60.65 61.94 2krs s ILE 61 Cb -0.16 -4.13 -0.05 0.00 0.01 0.00 0.00 42.46 38.13 2krs s ILE 61 CO 0.06 0.21 0.80 -0.69 0.00 0.00 0.00 174.94 175.32 2krs s VAL 62 N 0.94 4.82 0.02 2.92 1.01 -1.26 -4.89 120.40 123.96 2krs s VAL 62 Ca 0.42 1.69 0.00 0.00 0.00 0.00 0.00 61.98 64.09 2krs s VAL 62 Cb -0.19 -4.14 0.00 0.00 0.00 0.00 0.00 36.38 32.05 2krs s VAL 62 CO 0.21 0.29 0.00 0.59 0.00 0.00 0.00 175.10 176.19 2krs n ASN 63 N 3.26 -4.73 -2.01 3.32 3.02 -1.26 -4.80 115.26 112.05 2krs n ASN 63 Ca -0.00 0.08 -0.16 0.00 -0.03 0.00 0.00 54.58 54.46 2krs n ASN 63 Cb 0.51 -0.23 -0.03 0.00 -0.61 0.00 0.00 39.78 39.41 2krs n ASN 63 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2krs n GLU 64 N -1.66 -1.71 0.00 3.52 -0.58 -1.26 -4.54 120.64 114.42 2krs n GLU 64 Ca 0.00 0.87 0.00 0.00 -0.42 0.00 0.00 57.16 57.61 2krs n GLU 64 Cb 0.03 -5.36 0.00 0.00 -0.57 0.00 0.00 31.44 25.54 2krs n GLU 64 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2krs n GLY 65 N -0.65 0.00 0.09 0.62 0.00 -1.26 -5.02 105.19 98.97 2krs n GLY 65 Ca -0.18 0.00 0.14 0.00 0.00 0.00 0.00 46.02 45.98 2krs n GLY 65 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2krs n SER 66 N 0.00 0.40 -4.72 1.61 2.88 -1.26 -4.84 113.62 107.69 2krs n SER 66 Ca 0.00 -0.41 -0.41 0.00 -1.33 0.00 0.00 58.87 56.71 2krs n SER 66 Cb 0.00 -0.10 -0.04 0.00 -0.75 0.00 0.00 64.21 63.32 2krs n SER 66 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2krs s LEU 67 N -2.58 4.44 -0.31 2.46 1.02 -1.26 -4.95 118.68 117.50 2krs s LEU 67 Ca 0.26 1.84 0.19 0.00 0.02 0.00 0.00 54.13 56.43 2krs s LEU 67 Cb 0.20 -3.58 0.47 0.00 0.02 0.00 0.00 46.19 43.29 2krs s LEU 67 CO 0.50 -0.20 0.98 -0.62 0.02 0.00 0.00 176.35 177.03 2krs n GLU 68 N 3.17 1.25 -3.25 1.70 1.02 -1.26 -4.95 120.64 118.32 2krs n GLU 68 Ca 0.04 -3.29 -0.18 0.00 -0.02 0.00 0.00 57.16 53.72 2krs n GLU 68 Cb 0.49 -1.30 -0.02 0.00 -0.02 0.00 0.00 31.44 30.58 2krs n GLU 68 CO 0.00 0.00 0.00 1.58 1.18 0.00 0.00 177.13 179.89 2krs n HIS 69 N -0.16 -1.68 -0.28 -0.32 -0.00 -1.26 -4.77 115.22 106.75 2krs n HIS 69 Ca 0.09 0.29 -0.04 0.00 -0.00 0.00 0.00 57.72 58.05 2krs n HIS 69 Cb 0.82 -1.73 0.07 0.00 -0.00 0.00 0.00 29.99 29.15 2krs n HIS 69 CO 0.00 0.00 0.00 1.25 -0.00 0.00 0.00 176.34 177.59 2krs h HIS 70 N -0.43 0.95 -2.94 1.57 2.76 -1.96 -3.40 115.15 111.70 2krs h HIS 70 Ca -0.27 0.02 -0.55 0.00 -2.20 0.00 0.00 60.37 57.37 2krs h HIS 70 Cb 1.18 -0.32 -0.01 0.00 1.55 0.00 0.00 27.41 29.81 2krs h HIS 70 CO 0.79 0.58 0.82 -3.38 -1.30 0.00 0.00 177.93 175.44 2krs s HIS 71 N -6.13 2.88 -0.12 5.26 -3.43 -1.26 -5.00 115.29 107.49 2krs s HIS 71 Ca -0.13 0.91 -0.09 0.00 -0.80 0.00 0.00 55.06 54.95 2krs s HIS 71 Cb 0.15 -3.59 0.04 0.00 -1.43 0.00 0.00 32.58 27.75 2krs s HIS 71 CO 0.78 -2.11 0.31 -1.58 -2.00 0.00 0.00 174.74 170.14 2krs s HIS 72 N 2.64 -0.37 -0.15 0.38 5.04 -1.26 -5.15 115.29 116.41 2krs s HIS 72 Ca 0.61 0.88 -0.07 0.00 -1.54 0.00 0.00 55.06 54.94 2krs s HIS 72 Cb -0.28 0.12 0.07 0.00 0.04 0.00 0.00 32.58 32.53 2krs s HIS 72 CO 0.24 -0.20 0.34 -1.01 -2.34 0.00 0.00 174.74 171.77 2krs s HIS 73 N 0.55 -0.56 0.00 3.88 3.76 -1.26 -5.29 115.29 116.37 2krs s HIS 73 Ca -0.03 1.17 0.00 0.00 -0.15 0.00 0.00 55.06 56.05 2krs s HIS 73 Cb -0.05 0.15 0.00 0.00 1.11 0.00 0.00 32.58 33.79 2krs s HIS 73 CO -0.03 -0.37 0.00 0.72 -0.85 0.00 0.00 174.74 174.21