#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 0.15 0.59 2.12 1.11 -1.26 -2.78 119.66 119.58 2krs s GLN 2 Ca 0.00 -0.16 -0.07 0.00 0.01 0.00 0.00 55.36 55.15 2krs s GLN 2 Cb 0.00 -1.84 -0.00 0.00 -1.01 0.00 0.00 33.01 30.16 2krs s GLN 2 CO 0.00 -0.69 0.91 0.20 0.01 0.00 0.00 175.29 175.73 2krs s GLY 3 N 2.10 1.59 -0.05 3.09 0.00 0.37 -3.68 107.32 110.74 2krs s GLY 3 Ca 0.02 -0.59 0.04 0.00 0.00 0.00 0.00 44.72 44.19 2krs s GLY 3 CO -0.10 -0.32 -0.15 0.14 0.00 0.00 0.00 173.10 172.66 2krs s VAL 4 N -3.01 1.31 -0.06 1.40 1.01 -0.59 -0.84 120.40 119.63 2krs s VAL 4 Ca 0.53 -0.64 -0.27 0.00 0.00 0.00 0.00 61.98 61.61 2krs s VAL 4 Cb -0.11 -1.15 -0.03 0.00 0.00 0.00 0.00 36.38 35.10 2krs s VAL 4 CO 0.46 0.39 0.86 -0.69 0.00 0.00 0.00 175.10 176.11 2krs s VAL 5 N 0.19 4.93 -0.29 2.92 1.01 -0.94 -2.58 120.40 125.64 2krs s VAL 5 Ca -0.06 1.76 0.02 0.00 0.00 0.00 0.00 61.98 63.70 2krs s VAL 5 Cb -0.12 -4.19 0.08 0.00 0.00 0.00 0.00 36.38 32.15 2krs s VAL 5 CO 0.03 0.15 -0.02 -0.54 0.00 0.00 0.00 175.10 174.72 2krs s LYS 6 N 1.24 1.63 0.08 2.72 -0.14 -0.96 -1.58 119.74 122.72 2krs s LYS 6 Ca 0.44 -1.39 -0.11 0.00 -1.36 0.00 0.00 55.97 53.55 2krs s LYS 6 Cb -0.19 -2.81 0.01 0.00 -1.68 0.00 0.00 37.83 33.17 2krs s LYS 6 CO 0.21 -0.75 0.25 0.14 -0.76 0.00 0.00 175.35 174.44 2krs s VAL 7 N 1.18 0.11 -1.03 3.17 -7.23 -1.26 -4.72 120.40 110.62 2krs s VAL 7 Ca 0.01 -0.91 0.27 0.00 -1.81 0.00 0.00 61.98 59.54 2krs s VAL 7 Cb -0.19 -1.14 0.16 0.00 0.56 0.00 0.00 36.38 35.77 2krs s VAL 7 CO -0.09 -0.50 1.73 -0.46 -0.31 0.00 0.00 175.10 175.47 2krs n ASN 8 N 0.19 0.21 -0.53 4.85 0.23 -1.26 -4.62 115.26 114.32 2krs n ASN 8 Ca -0.17 0.17 0.00 0.00 -0.53 0.00 0.00 54.58 54.05 2krs n ASN 8 Cb 0.61 -0.20 0.00 0.00 -2.08 0.00 0.00 39.78 38.11 2krs n ASN 8 CO 0.00 0.00 0.00 -0.24 -0.93 0.00 0.00 177.26 176.09 2krs n SER 9 N -1.48 0.00 -4.77 0.53 2.88 -1.26 -5.09 113.62 104.43 2krs n SER 9 Ca 0.07 -0.53 -0.39 0.00 -1.33 0.00 0.00 58.87 56.69 2krs n SER 9 Cb 0.34 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 63.80 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 -1.24 3.17 -0.07 -1.46 0.00 -1.26 -4.56 121.76 116.34 2krs s ALA 10 Ca 0.00 1.27 0.05 0.00 0.00 0.00 0.00 51.96 53.27 2krs s ALA 10 Cb 0.00 -3.51 -0.00 0.00 0.00 0.00 0.00 23.12 19.61 2krs s ALA 10 CO 0.00 -0.96 -0.23 -1.17 0.00 0.00 0.00 175.76 173.41 2krs s LEU 11 N -2.70 2.02 0.24 0.00 2.96 0.57 -4.97 118.68 116.81 2krs s LEU 11 Ca 0.60 -0.49 -0.25 0.00 -0.22 0.00 0.00 54.13 53.78 2krs s LEU 11 Cb -0.39 -1.28 -0.09 0.00 0.50 0.00 0.00 46.19 44.93 2krs s LEU 11 CO 0.49 0.19 0.83 0.20 -1.32 0.00 0.00 176.35 176.74 2krs s ASN 12 N 0.10 7.33 0.08 3.68 0.01 -1.26 0.36 114.94 125.24 2krs s ASN 12 Ca -0.10 1.69 0.07 0.00 -0.71 0.00 0.00 52.86 53.81 2krs s ASN 12 Cb -0.15 -2.52 -0.04 0.00 0.41 0.00 0.00 41.25 38.95 2krs s ASN 12 CO 0.05 0.08 -0.12 -0.32 -1.51 0.00 0.00 177.10 175.28 2krs s MET 13 N -1.64 2.13 0.18 -0.60 -2.45 -0.95 -4.89 119.30 111.09 2krs s MET 13 Ca 0.43 -1.00 0.11 0.00 -1.25 0.00 0.00 55.69 53.97 2krs s MET 13 Cb -0.20 -2.29 -0.04 0.00 1.25 0.00 0.00 34.83 33.54 2krs s MET 13 CO 0.25 0.52 -0.23 1.03 1.05 0.00 0.00 175.02 177.64 2krs s ARG 14 N -2.00 1.43 0.19 4.11 0.52 -1.05 -1.23 118.95 120.92 2krs s ARG 14 Ca 0.20 -1.47 -0.10 0.00 -0.52 0.00 0.00 55.73 53.84 2krs s ARG 14 Cb -0.11 -1.71 0.11 0.00 0.52 0.00 0.00 34.95 33.76 2krs s ARG 14 CO 0.11 0.37 1.77 1.03 0.02 0.00 0.00 175.30 178.60 2krs h SER 15 N 3.31 0.91 -0.97 0.23 0.87 -1.82 0.58 113.55 116.67 2krs h SER 15 Ca -0.46 -0.15 0.00 0.00 -1.23 0.00 0.00 61.79 59.95 2krs h SER 15 Cb 1.20 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 62.93 2krs h SER 15 CO 0.47 0.81 0.00 0.61 -0.53 0.00 0.00 176.83 178.19 2krs n GLY 16 N -0.91 4.50 2.90 5.77 0.00 -1.26 -4.38 105.19 111.81 2krs n GLY 16 Ca 0.05 -1.51 -0.42 0.00 0.00 0.00 0.00 46.02 44.14 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 3.27 -3.46 1.61 -0.04 -1.26 -4.66 135.00 130.46 2krs n PRO 17 Ca 0.00 -3.16 0.01 0.00 -0.04 0.00 0.00 63.50 60.31 2krs n PRO 17 Cb 0.00 -3.12 -0.04 0.00 -0.04 0.00 0.00 33.50 30.30 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 2.16 -0.31 0.00 0.55 0.00 -1.26 -5.00 107.32 103.46 2krs s GLY 18 Ca 0.44 2.89 0.01 0.00 0.00 0.00 0.00 44.72 48.07 2krs s GLY 18 CO -0.03 3.19 1.00 -1.26 0.00 0.00 0.00 173.10 176.00 2krs n SER 19 N 5.05 0.00 -0.58 1.64 2.88 -1.26 -0.57 113.62 120.78 2krs n SER 19 Ca -0.10 0.45 0.10 0.00 -1.33 0.00 0.00 58.87 57.98 2krs n SER 19 Cb 0.52 -0.45 0.33 0.00 -0.75 0.00 0.00 64.21 63.86 2krs n SER 19 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 175.04 174.40 2krs n ASN 20 N -1.45 1.74 -0.08 -3.46 5.03 -1.26 -3.69 115.26 112.09 2krs n ASN 20 Ca 0.00 -1.77 0.13 0.00 0.87 0.00 0.00 54.58 53.81 2krs n ASN 20 Cb 0.02 -0.14 0.37 0.00 -1.02 0.00 0.00 39.78 39.01 2krs n ASN 20 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 2krs n TYR 21 N 0.38 0.00 -0.91 3.10 4.01 0.26 -5.05 117.16 118.96 2krs n TYR 21 Ca 0.15 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 58.02 2krs n TYR 21 Cb 0.33 -0.23 -0.03 0.00 -0.31 0.00 0.00 39.34 39.09 2krs n TYR 21 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2krs n GLY 22 N 1.43 -1.73 3.66 2.72 0.00 -1.24 -4.61 105.19 105.42 2krs n GLY 22 Ca 0.09 -1.29 -0.39 0.00 0.00 0.00 0.00 46.02 44.42 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 -1.86 5.12 -1.48 1.61 0.11 -1.26 -4.39 120.40 118.25 2krs s VAL 23 Ca 0.00 0.91 0.17 0.00 -2.93 0.00 0.00 61.98 60.13 2krs s VAL 23 Cb 0.00 -3.82 -0.03 0.00 -1.53 0.00 0.00 36.38 31.00 2krs s VAL 23 CO 0.00 0.19 0.88 2.30 -3.33 0.00 0.00 175.10 175.14 2krs n ILE 24 N 4.53 0.00 -3.88 7.04 -5.35 -0.36 -4.99 119.36 116.35 2krs n ILE 24 Ca -0.05 -0.28 0.02 0.00 -0.27 0.00 0.00 62.75 62.16 2krs n ILE 24 Cb 0.50 1.18 0.01 0.00 -1.74 0.00 0.00 39.64 39.59 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 -2.12 -0.18 -0.07 3.28 0.00 -1.25 -5.02 107.32 101.96 2krs s GLY 25 Ca 0.13 0.17 0.03 0.00 0.00 0.00 0.00 44.72 45.05 2krs s GLY 25 CO 0.48 3.93 -0.15 -1.59 0.00 0.00 0.00 173.10 175.77 2krs s THR 26 N -2.14 1.37 0.04 0.90 2.01 -1.26 -2.23 115.64 114.33 2krs s THR 26 Ca 0.25 -0.62 0.05 0.00 0.31 0.00 0.00 61.69 61.68 2krs s THR 26 Cb 0.01 -1.22 -0.04 0.00 0.01 0.00 0.00 72.50 71.26 2krs s THR 26 CO -0.01 0.41 -0.09 -0.76 -0.69 0.00 0.00 174.62 173.47 2krs s LEU 27 N 0.54 3.04 0.29 4.42 1.43 0.16 -4.94 118.68 123.62 2krs s LEU 27 Ca -0.15 -0.27 0.10 0.00 -1.03 0.00 0.00 54.13 52.78 2krs s LEU 27 Cb -0.16 -1.79 -0.05 0.00 0.03 0.00 0.00 46.19 44.23 2krs s LEU 27 CO 0.05 0.24 -0.04 -0.13 0.23 0.00 0.00 176.35 176.70 2krs s ARG 28 N -1.69 2.09 0.95 1.70 0.52 -1.26 -0.31 118.95 120.95 2krs s ARG 28 Ca 0.18 -1.59 -0.12 0.00 -0.52 0.00 0.00 55.73 53.68 2krs s ARG 28 Cb -0.11 -2.01 0.16 0.00 0.52 0.00 0.00 34.95 33.51 2krs s ARG 28 CO 0.09 0.28 1.09 0.54 0.02 0.00 0.00 175.30 177.33 2krs s ASN 29 N -3.65 3.01 0.00 0.23 2.20 -1.26 -3.34 114.94 112.12 2krs s ASN 29 Ca 0.32 1.39 0.00 0.00 -0.94 0.00 0.00 52.86 53.64 2krs s ASN 29 Cb -0.04 -2.07 0.00 0.00 -2.00 0.00 0.00 41.25 37.14 2krs s ASN 29 CO 0.19 -2.91 0.00 -3.20 -2.94 0.00 0.00 177.10 168.23 2krs n ASN 30 N -4.05 0.00 -4.76 3.54 5.15 -0.62 -4.93 115.26 109.59 2krs n ASN 30 Ca 0.06 0.00 -0.41 0.00 -0.60 0.00 0.00 54.58 53.63 2krs n ASN 30 Cb 0.56 -0.05 -0.02 0.00 -0.53 0.00 0.00 39.78 39.74 2krs n ASN 30 CO 0.00 0.00 0.00 -1.81 1.40 0.00 0.00 177.26 176.85 2krs s ASP 31 N -0.22 6.80 0.00 1.20 1.11 -1.21 -4.81 116.67 119.54 2krs s ASP 31 Ca 0.00 2.60 -0.00 0.00 0.18 0.00 0.00 52.55 55.33 2krs s ASP 31 Cb 0.00 -2.63 -0.04 0.00 1.07 0.00 0.00 42.92 41.32 2krs s ASP 31 CO 0.00 -0.55 0.09 -1.59 1.18 0.00 0.00 175.17 174.30 2krs s LYS 32 N -1.08 3.09 0.14 8.23 -2.85 -1.26 -2.23 119.74 123.79 2krs s LYS 32 Ca 0.53 -0.49 0.03 0.00 -1.00 0.00 0.00 55.97 55.04 2krs s LYS 32 Cb -0.39 -2.87 -0.04 0.00 -2.06 0.00 0.00 37.83 32.46 2krs s LYS 32 CO 0.47 0.64 -0.05 0.14 0.10 0.00 0.00 175.35 176.65 2krs s VAL 33 N -1.22 0.86 -0.08 1.79 -7.23 -0.02 -4.99 120.40 109.51 2krs s VAL 33 Ca 0.24 -1.99 -0.17 0.00 -1.81 0.00 0.00 61.98 58.24 2krs s VAL 33 Cb -0.12 -1.91 -0.05 0.00 0.56 0.00 0.00 36.38 34.86 2krs s VAL 33 CO 0.15 -0.68 0.46 -1.61 -0.31 0.00 0.00 175.10 173.11 2krs s GLU 34 N -3.83 4.23 -0.23 4.82 2.02 -1.24 -0.48 118.70 123.99 2krs s GLU 34 Ca 0.18 0.44 -0.11 0.00 0.02 0.00 0.00 54.97 55.49 2krs s GLU 34 Cb 0.05 -3.37 -0.05 0.00 0.10 0.00 0.00 34.13 30.86 2krs s GLU 34 CO 0.00 0.32 0.20 0.42 0.02 0.00 0.00 175.26 176.22 2krs s ILE 35 N 0.11 5.34 -0.21 -1.63 -1.09 -1.12 -2.24 121.20 120.36 2krs s ILE 35 Ca 0.25 0.28 -0.14 0.00 -2.23 0.00 0.00 60.65 58.81 2krs s ILE 35 Cb -0.16 -3.54 -0.19 0.00 -1.58 0.00 0.00 42.46 36.99 2krs s ILE 35 CO 0.11 0.34 0.08 -0.38 -1.23 0.00 0.00 174.94 173.86 2krs n ILE 36 N 4.19 1.59 -3.59 2.92 5.41 -1.08 -4.71 119.36 124.08 2krs n ILE 36 Ca -0.14 -0.30 -0.04 0.00 1.00 0.00 0.00 62.75 63.28 2krs n ILE 36 Cb 0.52 -1.88 -0.02 0.00 -0.71 0.00 0.00 39.64 37.55 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 -2.45 0.49 -0.19 0.38 2.20 -1.26 -5.02 119.74 113.88 2krs s LYS 37 Ca -0.30 -0.21 -0.04 0.00 -0.36 0.00 0.00 55.97 55.06 2krs s LYS 37 Cb 0.08 0.21 -0.02 0.00 -1.51 0.00 0.00 37.83 36.59 2krs s LYS 37 CO 0.61 -0.22 -0.04 -2.00 -0.36 0.00 0.00 175.35 173.34 2krs s GLU 38 N -2.63 3.50 -0.06 4.03 2.12 -1.26 -0.39 118.70 124.02 2krs s GLU 38 Ca 0.10 -0.58 0.03 0.00 0.36 0.00 0.00 54.97 54.87 2krs s GLU 38 Cb 0.00 -2.98 0.01 0.00 0.26 0.00 0.00 34.13 31.42 2krs s GLU 38 CO -0.05 -0.02 -0.14 0.08 -0.54 0.00 0.00 175.26 174.60 2krs s VAL 39 N 1.04 1.21 -1.30 3.70 1.01 0.13 -4.76 120.40 121.43 2krs s VAL 39 Ca 0.01 -0.54 0.00 0.00 0.00 0.00 0.00 61.98 61.45 2krs s VAL 39 Cb -0.15 -1.08 0.00 0.00 0.00 0.00 0.00 36.38 35.15 2krs s VAL 39 CO 0.01 0.37 0.00 0.47 0.00 0.00 0.00 175.10 175.94 2krs n ASP 40 N 3.61 -4.57 0.00 3.32 8.00 -1.26 0.19 116.55 125.84 2krs n ASP 40 Ca -0.21 0.13 0.00 0.00 0.71 0.00 0.00 54.79 55.41 2krs n ASP 40 Cb 0.52 -3.85 0.00 0.00 -0.02 0.00 0.00 41.12 37.77 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 -0.87 2.14 3.83 0.44 0.00 -1.26 -5.02 105.19 104.45 2krs n GLY 41 Ca -0.18 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.48 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 -2.54 3.68 -0.19 1.61 0.52 0.13 -4.44 118.94 117.70 2krs s TRP 42 Ca 0.00 1.17 -0.09 0.00 0.02 0.00 0.00 56.10 57.20 2krs s TRP 42 Cb 0.00 -2.44 -0.05 0.00 -1.15 0.00 0.00 33.47 29.83 2krs s TRP 42 CO 0.00 0.47 0.11 0.71 0.02 0.00 0.00 176.95 178.26 2krs s TYR 43 N -1.35 3.38 0.03 -1.98 2.02 -1.22 0.18 117.35 118.41 2krs s TYR 43 Ca 0.35 0.28 -0.27 0.00 -0.37 0.00 0.00 57.07 57.06 2krs s TYR 43 Cb -0.17 -2.13 -0.05 0.00 -0.40 0.00 0.00 41.96 39.22 2krs s TYR 43 CO 0.19 0.28 0.86 -2.00 -1.57 0.00 0.00 175.55 173.32 2krs s GLU 44 N 0.29 4.56 0.08 -0.62 2.12 0.48 -2.51 118.70 123.10 2krs s GLU 44 Ca 0.07 1.23 0.04 0.00 0.36 0.00 0.00 54.97 56.67 2krs s GLU 44 Cb -0.11 -3.41 -0.03 0.00 0.26 0.00 0.00 34.13 30.84 2krs s GLU 44 CO -0.01 0.14 -0.11 0.96 -0.54 0.00 0.00 175.26 175.70 2krs s ILE 45 N 0.39 0.94 -0.10 -3.70 -4.36 0.29 -2.62 121.20 112.04 2krs s ILE 45 Ca 0.44 -1.47 0.01 0.00 -0.26 0.00 0.00 60.65 59.38 2krs s ILE 45 Cb -0.21 -1.17 0.02 0.00 1.25 0.00 0.00 42.46 42.35 2krs s ILE 45 CO 0.25 -0.43 -0.12 -0.60 0.24 0.00 0.00 174.94 174.28 2krs s ARG 46 N -2.31 1.85 -0.07 0.37 3.52 -0.95 -1.00 118.95 120.36 2krs s ARG 46 Ca 0.01 -0.43 -0.16 0.00 -0.13 0.00 0.00 55.73 55.02 2krs s ARG 46 Cb -0.06 -1.64 0.03 0.00 -1.56 0.00 0.00 34.95 31.72 2krs s ARG 46 CO 0.01 -0.09 0.39 0.12 -0.81 0.00 0.00 175.30 174.91 2krs s PHE 47 N 1.09 -0.34 -1.51 5.12 5.36 0.14 -3.72 117.98 124.12 2krs s PHE 47 Ca -0.06 0.68 -0.15 0.00 -0.96 0.00 0.00 56.93 56.44 2krs s PHE 47 Cb -0.14 0.15 0.13 0.00 -0.34 0.00 0.00 43.02 42.82 2krs s PHE 47 CO -0.02 -0.35 0.67 0.27 -1.46 0.00 0.00 175.22 174.33 2krs n ASN 48 N 1.85 -3.35 -1.15 6.13 6.94 -1.26 0.10 115.26 124.52 2krs n ASN 48 Ca -0.18 -0.76 -0.13 0.00 -0.02 0.00 0.00 54.58 53.49 2krs n ASN 48 Cb 0.57 -2.76 -0.04 0.00 -2.36 0.00 0.00 39.78 35.18 2krs n ASN 48 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2krs n GLY 49 N -1.28 0.90 3.16 4.83 0.00 -1.26 -5.00 105.19 106.55 2krs n GLY 49 Ca 0.05 -0.39 -0.22 0.00 0.00 0.00 0.00 46.02 45.45 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 -3.58 1.11 -0.10 1.61 -0.14 0.29 -5.14 119.74 113.78 2krs s LYS 50 Ca 0.00 -0.75 0.01 0.00 -1.36 0.00 0.00 55.97 53.87 2krs s LYS 50 Cb 0.00 -1.14 -0.02 0.00 -1.68 0.00 0.00 37.83 34.99 2krs s LYS 50 CO 0.00 0.29 -0.13 0.08 -0.76 0.00 0.00 175.35 174.83 2krs s VAL 51 N -0.72 3.10 0.00 3.17 1.01 -1.26 0.25 120.40 125.95 2krs s VAL 51 Ca 0.04 -0.66 0.00 0.00 0.00 0.00 0.00 61.98 61.36 2krs s VAL 51 Cb -0.08 -2.28 0.00 0.00 0.00 0.00 0.00 36.38 34.03 2krs s VAL 51 CO 0.01 0.55 0.00 0.61 0.00 0.00 0.00 175.10 176.27 2krs n GLY 52 N 3.12 3.07 3.12 4.51 0.00 -0.17 -4.69 105.19 114.14 2krs n GLY 52 Ca -0.18 -1.13 -0.11 0.00 0.00 0.00 0.00 46.02 44.59 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 -5.04 0.77 0.06 1.61 1.51 0.20 -0.55 117.35 115.91 2krs s TYR 53 Ca 0.00 -0.75 0.01 0.00 -1.01 0.00 0.00 57.07 55.32 2krs s TYR 53 Cb 0.00 -0.46 -0.03 0.00 -0.11 0.00 0.00 41.96 41.36 2krs s TYR 53 CO 0.00 -0.14 -0.06 0.00 -1.11 0.00 0.00 175.55 174.24 2krs s ALA 54 N -2.72 0.63 0.43 3.71 0.00 -1.04 -2.53 121.76 120.23 2krs s ALA 54 Ca 0.02 -1.01 -0.26 0.00 0.00 0.00 0.00 51.96 50.72 2krs s ALA 54 Cb -0.01 0.14 -0.09 0.00 0.00 0.00 0.00 23.12 23.16 2krs s ALA 54 CO -0.03 -0.17 1.41 0.45 0.00 0.00 0.00 175.76 177.42 2krs s SER 55 N -2.27 6.04 0.32 0.00 0.15 -1.26 -3.39 113.70 113.29 2krs s SER 55 Ca -0.01 2.88 0.09 0.00 0.70 0.00 0.00 55.95 59.60 2krs s SER 55 Cb -0.02 -2.65 0.55 0.00 -1.71 0.00 0.00 66.02 62.19 2krs s SER 55 CO -0.03 -1.06 1.75 0.07 1.20 0.00 0.00 173.24 175.17 2krs h LYS 56 N 2.50 0.17 -0.83 5.44 2.10 -1.88 -2.77 116.57 121.29 2krs h LYS 56 Ca -0.51 -0.07 -0.01 0.00 -2.00 0.00 0.00 60.65 58.07 2krs h LYS 56 Cb 1.26 -0.01 -0.04 0.00 -0.90 0.00 0.00 32.23 32.54 2krs h LYS 56 CO 0.62 0.53 0.50 0.77 -2.00 0.00 0.00 179.45 179.86 2krs h SER 57 N 0.14 0.99 -0.58 7.07 0.02 -1.94 -2.45 113.55 116.81 2krs h SER 57 Ca 0.01 -0.07 0.00 0.00 -0.84 0.00 0.00 61.79 60.90 2krs h SER 57 Cb 0.74 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 63.03 2krs h SER 57 CO 0.06 0.77 0.00 -1.22 -1.14 0.00 0.00 176.83 175.30 2krs n TYR 58 N -4.44 0.98 -5.05 3.45 4.01 -1.16 -4.87 117.16 110.07 2krs n TYR 58 Ca 0.08 -0.44 -0.31 0.00 -0.16 0.00 0.00 57.90 57.07 2krs n TYR 58 Cb 0.06 -0.08 -0.17 0.00 -0.31 0.00 0.00 39.34 38.84 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 -1.43 1.92 -0.11 -0.72 -1.09 -0.92 -2.28 121.20 116.58 2krs s ILE 59 Ca 0.41 -0.93 0.03 0.00 -2.23 0.00 0.00 60.65 57.93 2krs s ILE 59 Cb 0.24 -1.67 0.01 0.00 -1.58 0.00 0.00 42.46 39.45 2krs s ILE 59 CO 0.25 0.53 -0.19 -0.89 -1.23 0.00 0.00 174.94 173.40 2krs s THR 60 N 0.45 1.77 -0.01 2.92 2.01 -1.06 -4.84 115.64 116.89 2krs s THR 60 Ca -0.17 -0.83 -0.27 0.00 0.31 0.00 0.00 61.69 60.74 2krs s THR 60 Cb -0.17 -1.57 -0.04 0.00 0.01 0.00 0.00 72.50 70.73 2krs s THR 60 CO 0.07 0.50 0.84 -0.63 -0.69 0.00 0.00 174.62 174.70 2krs s ILE 61 N 0.68 4.88 0.15 1.82 1.01 -1.26 -1.54 121.20 126.94 2krs s ILE 61 Ca -0.12 1.76 -0.30 0.00 0.00 0.00 0.00 60.65 61.99 2krs s ILE 61 Cb -0.16 -4.18 -0.08 0.00 0.01 0.00 0.00 42.46 38.05 2krs s ILE 61 CO 0.03 0.24 1.27 -0.69 0.00 0.00 0.00 174.94 175.79 2krs s VAL 62 N 0.67 3.51 0.00 2.92 1.01 -1.24 -4.80 120.40 122.47 2krs s VAL 62 Ca 0.44 1.18 0.00 0.00 0.00 0.00 0.00 61.98 63.60 2krs s VAL 62 Cb -0.20 -3.76 0.00 0.00 0.00 0.00 0.00 36.38 32.43 2krs s VAL 62 CO 0.24 0.15 0.00 -3.20 0.00 0.00 0.00 175.10 172.28 2krs n ASN 63 N 3.13 -2.92 -2.60 3.32 2.85 -1.26 -4.87 115.26 112.91 2krs n ASN 63 Ca 0.07 0.00 -0.03 0.00 -0.11 0.00 0.00 54.58 54.51 2krs n ASN 63 Cb 0.44 0.00 -0.03 0.00 1.24 0.00 0.00 39.78 41.43 2krs n ASN 63 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 177.26 174.53 2krs n GLU 64 N -0.63 -3.83 0.00 1.20 -0.58 -1.26 -4.66 120.64 110.89 2krs n GLU 64 Ca 0.00 2.89 0.00 0.00 -0.42 0.00 0.00 57.16 59.63 2krs n GLU 64 Cb 0.00 -3.91 0.00 0.00 -0.57 0.00 0.00 31.44 26.96 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 1.93 2.56 5.00 0.62 0.00 -1.26 -4.84 105.19 109.20 2krs n GLY 65 Ca -0.24 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.45 2krs n GLY 65 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2krs n SER 66 N 4.77 0.00 -0.70 1.61 7.64 -1.26 -4.89 113.62 120.79 2krs n SER 66 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2krs n SER 66 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2krs n SER 66 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 2krs n LEU 67 N 0.00 0.00 -2.82 -3.43 4.77 -1.26 -4.97 117.00 109.29 2krs n LEU 67 Ca 0.00 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 55.97 2krs n LEU 67 Cb 0.00 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.08 2krs n LEU 67 CO 0.00 -1.10 -0.50 1.21 -1.33 0.00 0.00 177.39 175.67 2krs n GLU 68 N -1.39 -2.93 -4.02 3.23 4.07 -1.26 -5.06 120.64 113.29 2krs n GLU 68 Ca 0.00 2.42 -0.09 0.00 -0.06 0.00 0.00 57.16 59.43 2krs n GLU 68 Cb 0.00 -4.23 -0.06 0.00 -0.06 0.00 0.00 31.44 27.10 2krs n GLU 68 CO 0.00 0.00 0.00 -3.38 -0.06 0.00 0.00 177.13 173.69 2krs s HIS 69 N -1.28 0.44 -1.80 4.31 -3.43 -1.26 -4.88 115.29 107.39 2krs s HIS 69 Ca -0.05 -0.79 0.00 0.00 -0.80 0.00 0.00 55.06 53.43 2krs s HIS 69 Cb 0.00 0.11 0.00 0.00 -1.43 0.00 0.00 32.58 31.26 2krs s HIS 69 CO 0.59 -0.95 0.00 0.72 -2.00 0.00 0.00 174.74 173.10 2krs n HIS 70 N -0.37 -0.39 -0.16 0.38 8.25 -1.26 -4.83 115.22 116.84 2krs n HIS 70 Ca -0.01 0.00 -0.07 0.00 -0.26 0.00 0.00 57.72 57.37 2krs n HIS 70 Cb 0.62 -3.22 0.08 0.00 1.12 0.00 0.00 29.99 28.60 2krs n HIS 70 CO 0.00 0.00 0.00 1.12 0.64 0.00 0.00 176.34 178.10 2krs h HIS 71 N 0.00 1.01 0.00 4.41 -0.00 -2.02 -2.04 115.15 116.52 2krs h HIS 71 Ca -0.38 -0.17 0.00 0.00 -0.00 0.00 0.00 60.37 59.82 2krs h HIS 71 Cb 1.20 -0.26 0.00 0.00 -0.00 0.00 0.00 27.41 28.34 2krs h HIS 71 CO 0.53 0.93 0.00 1.58 -0.00 0.00 0.00 177.93 180.97 2krs n HIS 72 N -4.18 0.00 0.00 6.12 -0.00 -1.26 -4.83 115.22 111.07 2krs n HIS 72 Ca 0.02 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.20 2krs n HIS 72 Cb 0.35 -0.23 0.00 0.00 -0.12 0.00 0.00 29.99 29.99 2krs n HIS 72 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52 2krs n HIS 73 N -1.23 0.00 -1.86 1.57 8.25 -0.77 -5.30 115.22 115.88 2krs n HIS 73 Ca 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.47 2krs n HIS 73 Cb 0.01 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.12 2krs n HIS 73 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70