#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 0.51 0.62 2.12 -0.21 -1.26 -4.04 119.66 117.39 2krs s GLN 2 Ca 0.00 -0.02 -0.07 0.00 0.02 0.00 0.00 55.36 55.29 2krs s GLN 2 Cb 0.00 -1.30 0.01 0.00 1.00 0.00 0.00 33.01 32.72 2krs s GLN 2 CO 0.00 -0.43 0.95 0.20 -2.12 0.00 0.00 175.29 173.90 2krs s GLY 3 N 1.98 1.61 -0.06 3.09 0.00 -0.14 -4.65 107.32 109.15 2krs s GLY 3 Ca 0.03 -0.62 0.04 0.00 0.00 0.00 0.00 44.72 44.18 2krs s GLY 3 CO -0.06 -0.31 -0.20 0.14 0.00 0.00 0.00 173.10 172.67 2krs s VAL 4 N -3.09 1.65 -0.21 1.40 1.01 -1.09 -2.62 120.40 117.45 2krs s VAL 4 Ca 0.55 -0.82 -0.10 0.00 0.00 0.00 0.00 61.98 61.62 2krs s VAL 4 Cb -0.11 -1.42 -0.05 0.00 0.00 0.00 0.00 36.38 34.81 2krs s VAL 4 CO 0.47 0.47 0.13 -0.69 0.00 0.00 0.00 175.10 175.47 2krs s VAL 5 N 0.13 5.24 -0.29 2.92 1.01 -1.18 -1.91 120.40 126.32 2krs s VAL 5 Ca -0.08 0.13 0.03 0.00 0.00 0.00 0.00 61.98 62.06 2krs s VAL 5 Cb -0.14 -3.41 0.07 0.00 0.00 0.00 0.00 36.38 32.91 2krs s VAL 5 CO 0.04 0.41 -0.04 -0.54 0.00 0.00 0.00 175.10 174.96 2krs s LYS 6 N 0.66 1.99 0.15 2.72 -0.14 -1.04 -1.80 119.74 122.28 2krs s LYS 6 Ca 0.07 -1.53 0.05 0.00 -1.36 0.00 0.00 55.97 53.19 2krs s LYS 6 Cb -0.12 -3.03 -0.04 0.00 -1.68 0.00 0.00 37.83 32.95 2krs s LYS 6 CO 0.01 -0.71 -0.10 0.14 -0.76 0.00 0.00 175.35 173.93 2krs s VAL 7 N 1.04 1.19 0.18 3.17 -7.23 -1.26 -4.81 120.40 112.68 2krs s VAL 7 Ca -0.02 -2.07 -0.11 0.00 -1.81 0.00 0.00 61.98 57.98 2krs s VAL 7 Cb -0.20 -1.86 0.10 0.00 0.56 0.00 0.00 36.38 34.98 2krs s VAL 7 CO -0.06 -0.74 1.73 -1.13 -0.31 0.00 0.00 175.10 174.59 2krs h ASN 8 N 2.77 0.92 0.00 4.85 -0.73 -1.99 -3.44 115.58 117.97 2krs h ASN 8 Ca -0.37 -0.19 0.00 0.00 1.87 0.00 0.00 56.30 57.62 2krs h ASN 8 Cb 1.19 -0.24 0.00 0.00 0.27 0.00 0.00 38.32 39.54 2krs h ASN 8 CO 0.63 0.86 0.00 -0.24 -0.37 0.00 0.00 177.43 178.32 2krs n SER 9 N -4.39 -0.83 -3.63 1.15 2.88 -1.26 -5.02 113.62 102.52 2krs n SER 9 Ca 0.04 0.25 -0.15 0.00 -1.33 0.00 0.00 58.87 57.69 2krs n SER 9 Cb 0.19 0.98 -0.07 0.00 -0.75 0.00 0.00 64.21 64.56 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 -2.00 -1.56 -0.04 -1.46 0.00 -1.26 -4.17 121.76 111.26 2krs s ALA 10 Ca 0.00 1.59 0.05 0.00 0.00 0.00 0.00 51.96 53.60 2krs s ALA 10 Cb 0.00 -0.74 -0.00 0.00 0.00 0.00 0.00 23.12 22.38 2krs s ALA 10 CO 0.00 -0.31 -0.18 -1.17 0.00 0.00 0.00 175.76 174.10 2krs s LEU 11 N -0.11 1.94 0.23 0.00 2.96 -0.80 -4.95 118.68 117.94 2krs s LEU 11 Ca -0.03 -0.37 -0.30 0.00 -0.22 0.00 0.00 54.13 53.21 2krs s LEU 11 Cb -0.03 -1.00 -0.09 0.00 0.50 0.00 0.00 46.19 45.56 2krs s LEU 11 CO 0.03 0.17 1.00 0.20 -1.32 0.00 0.00 176.35 176.43 2krs s ASN 12 N -0.02 7.48 -0.10 3.68 0.02 -1.26 -0.47 114.94 124.28 2krs s ASN 12 Ca -0.03 2.03 -0.10 0.00 -1.02 0.00 0.00 52.86 53.75 2krs s ASN 12 Cb -0.11 -2.61 -0.05 0.00 0.02 0.00 0.00 41.25 38.50 2krs s ASN 12 CO 0.02 0.01 0.21 -0.32 0.02 0.00 0.00 177.10 177.04 2krs s MET 13 N -1.01 3.67 0.19 -0.60 -2.45 0.64 -4.92 119.30 114.83 2krs s MET 13 Ca 0.44 0.01 0.05 0.00 -1.25 0.00 0.00 55.69 54.94 2krs s MET 13 Cb -0.28 -3.23 -0.04 0.00 1.25 0.00 0.00 34.83 32.54 2krs s MET 13 CO 0.35 0.69 0.21 1.03 1.05 0.00 0.00 175.02 178.34 2krs s ARG 14 N -0.84 3.08 0.00 4.11 1.81 -0.88 -1.70 118.95 124.54 2krs s ARG 14 Ca 0.17 -0.85 0.28 0.00 -1.72 0.00 0.00 55.73 53.61 2krs s ARG 14 Cb -0.13 -2.72 1.16 0.00 -0.45 0.00 0.00 34.95 32.81 2krs s ARG 14 CO 0.06 0.46 1.84 0.43 -0.68 0.00 0.00 175.30 177.41 2krs n SER 15 N -0.75 0.22 -0.96 0.23 7.64 -1.26 0.46 113.62 119.20 2krs n SER 15 Ca -0.08 -0.06 0.00 0.00 1.01 0.00 0.00 58.87 59.74 2krs n SER 15 Cb 0.56 -0.21 0.00 0.00 -1.01 0.00 0.00 64.21 63.55 2krs n SER 15 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2krs n GLY 16 N 1.40 2.11 2.94 0.23 0.00 -1.26 -4.55 105.19 106.06 2krs n GLY 16 Ca 0.10 -1.03 -0.42 0.00 0.00 0.00 0.00 46.02 44.67 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 3.15 0.00 1.61 -0.04 -1.26 -4.54 135.00 133.92 2krs n PRO 17 Ca 0.00 -3.04 0.00 0.00 -0.04 0.00 0.00 63.50 60.42 2krs n PRO 17 Cb 0.00 -3.20 0.00 0.00 -0.04 0.00 0.00 33.50 30.26 2krs n PRO 17 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2krs n GLY 18 N 3.94 1.71 0.03 0.55 0.00 -1.26 -5.00 105.19 105.15 2krs n GLY 18 Ca 0.47 -0.27 0.13 0.00 0.00 0.00 0.00 46.02 46.35 2krs n GLY 18 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2krs n SER 19 N 0.00 0.32 -0.26 1.61 7.64 -1.26 -3.18 113.62 118.49 2krs n SER 19 Ca 0.00 0.43 0.06 0.00 1.01 0.00 0.00 58.87 60.37 2krs n SER 19 Cb 0.00 -0.47 0.28 0.00 -1.01 0.00 0.00 64.21 63.00 2krs n SER 19 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 2krs n ASN 20 N -1.75 0.77 -0.60 6.43 2.85 -1.26 -3.34 115.26 118.36 2krs n ASN 20 Ca 0.06 -1.77 0.13 0.00 -0.11 0.00 0.00 54.58 52.90 2krs n ASN 20 Cb 0.37 -0.07 0.40 0.00 1.24 0.00 0.00 39.78 41.72 2krs n ASN 20 CO 0.00 0.00 0.00 -1.22 -2.11 0.00 0.00 177.26 173.93 2krs n TYR 21 N -0.18 0.00 -0.32 1.20 4.02 -1.19 -5.06 117.16 115.62 2krs n TYR 21 Ca 0.10 0.00 0.04 0.00 -0.01 0.00 0.00 57.90 58.03 2krs n TYR 21 Cb 0.15 -0.00 -0.01 0.00 -0.02 0.00 0.00 39.34 39.46 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 -1.46 3.45 2.72 0.00 -1.21 -4.49 105.19 105.42 2krs n GLY 22 Ca 0.17 -1.45 -0.35 0.00 0.00 0.00 0.00 46.02 44.40 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 -1.35 3.90 -1.19 1.61 0.11 -1.26 -4.29 120.40 117.93 2krs s VAL 23 Ca 0.00 -0.33 0.13 0.00 -2.93 0.00 0.00 61.98 58.84 2krs s VAL 23 Cb 0.00 -2.76 0.00 0.00 -1.53 0.00 0.00 36.38 32.10 2krs s VAL 23 CO 0.00 0.44 0.74 2.30 -3.33 0.00 0.00 175.10 175.25 2krs n ILE 24 N 4.15 0.00 -3.68 7.04 -5.35 -0.69 -4.99 119.36 115.84 2krs n ILE 24 Ca -0.17 -0.37 0.00 0.00 -0.27 0.00 0.00 62.75 61.94 2krs n ILE 24 Cb 0.52 1.16 -0.01 0.00 -1.74 0.00 0.00 39.64 39.57 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 -1.58 -0.33 -0.02 3.28 0.00 -1.25 -5.01 107.32 102.40 2krs s GLY 25 Ca 0.11 0.47 0.04 0.00 0.00 0.00 0.00 44.72 45.34 2krs s GLY 25 CO 0.32 0.42 -0.14 -1.59 0.00 0.00 0.00 173.10 172.11 2krs s THR 26 N -2.63 1.16 -0.01 0.90 2.01 -1.26 -0.26 115.64 115.55 2krs s THR 26 Ca 0.15 -0.60 0.02 0.00 0.31 0.00 0.00 61.69 61.57 2krs s THR 26 Cb 0.03 -0.98 -0.03 0.00 0.01 0.00 0.00 72.50 71.52 2krs s THR 26 CO -0.02 0.33 -0.05 -0.76 -0.69 0.00 0.00 174.62 173.43 2krs s LEU 27 N -0.15 3.24 0.38 4.42 1.43 0.38 -4.95 118.68 123.44 2krs s LEU 27 Ca 0.02 -0.10 0.08 0.00 -1.03 0.00 0.00 54.13 53.09 2krs s LEU 27 Cb -0.08 -1.84 -0.02 0.00 0.03 0.00 0.00 46.19 44.29 2krs s LEU 27 CO 0.00 0.29 0.38 -0.13 0.23 0.00 0.00 176.35 177.12 2krs s ARG 28 N -1.36 2.69 0.51 1.70 0.52 -1.26 -1.90 118.95 119.84 2krs s ARG 28 Ca 0.17 -1.37 -0.22 0.00 -0.52 0.00 0.00 55.73 53.79 2krs s ARG 28 Cb -0.11 -2.50 -0.06 0.00 0.52 0.00 0.00 34.95 32.80 2krs s ARG 28 CO 0.07 -0.07 1.28 -0.80 0.02 0.00 0.00 175.30 175.80 2krs s ASN 29 N -4.11 5.66 -1.49 0.23 -0.87 -1.26 -2.41 114.94 110.69 2krs s ASN 29 Ca 0.46 2.59 -0.05 0.00 -1.57 0.00 0.00 52.86 54.29 2krs s ASN 29 Cb -0.05 -2.62 0.02 0.00 -0.02 0.00 0.00 41.25 38.57 2krs s ASN 29 CO 0.28 -1.29 0.49 0.59 -2.57 0.00 0.00 177.10 174.60 2krs n ASN 30 N -0.76 -5.46 -4.55 -1.22 5.03 -0.74 -4.92 115.26 102.64 2krs n ASN 30 Ca 0.09 -0.25 -0.43 0.00 0.87 0.00 0.00 54.58 54.86 2krs n ASN 30 Cb 0.46 -4.45 -0.05 0.00 -1.02 0.00 0.00 39.78 34.72 2krs n ASN 30 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 2krs s ASP 31 N -2.60 6.42 0.08 6.41 -1.08 -1.01 -4.89 116.67 119.99 2krs s ASP 31 Ca 0.28 -0.07 -0.30 0.00 -0.52 0.00 0.00 52.55 51.94 2krs s ASP 31 Cb -0.13 -2.39 -0.05 0.00 -1.46 0.00 0.00 42.92 38.89 2krs s ASP 31 CO 0.34 -0.91 1.02 -0.54 0.52 0.00 0.00 175.17 175.60 2krs s LYS 32 N 3.29 4.60 0.08 4.34 3.01 -1.26 -3.11 119.74 130.69 2krs s LYS 32 Ca 0.30 1.52 -0.01 0.00 -1.01 0.00 0.00 55.97 56.77 2krs s LYS 32 Cb -0.12 -3.39 -0.04 0.00 -1.01 0.00 0.00 37.83 33.27 2krs s LYS 32 CO 0.22 0.05 0.00 0.14 0.51 0.00 0.00 175.35 176.27 2krs s VAL 33 N 0.44 0.19 -0.19 3.17 -7.23 -1.08 -5.01 120.40 110.69 2krs s VAL 33 Ca 0.50 -1.85 -0.10 0.00 -1.81 0.00 0.00 61.98 58.73 2krs s VAL 33 Cb -0.24 -1.73 -0.05 0.00 0.56 0.00 0.00 36.38 34.92 2krs s VAL 33 CO 0.30 -0.79 0.14 -1.61 -0.31 0.00 0.00 175.10 172.82 2krs s GLU 34 N -3.97 4.08 -0.20 4.82 2.02 -1.26 -0.97 118.70 123.23 2krs s GLU 34 Ca 0.14 -0.20 -0.14 0.00 0.02 0.00 0.00 54.97 54.79 2krs s GLU 34 Cb 0.08 -3.38 -0.04 0.00 0.10 0.00 0.00 34.13 30.88 2krs s GLU 34 CO -0.05 0.37 0.29 0.42 0.02 0.00 0.00 175.26 176.31 2krs s ILE 35 N 0.15 5.28 -0.11 -1.63 1.01 -1.26 -2.56 121.20 122.08 2krs s ILE 35 Ca 0.09 0.50 -0.09 0.00 0.00 0.00 0.00 60.65 61.15 2krs s ILE 35 Cb -0.11 -3.63 -0.03 0.00 0.01 0.00 0.00 42.46 38.70 2krs s ILE 35 CO -0.01 0.32 -0.18 -0.38 0.00 0.00 0.00 174.94 174.69 2krs n ILE 36 N 4.07 1.02 -3.81 2.92 2.08 -0.12 -4.96 119.36 120.57 2krs n ILE 36 Ca -0.11 0.28 -0.09 0.00 0.56 0.00 0.00 62.75 63.38 2krs n ILE 36 Cb 0.52 -2.11 -0.07 0.00 -0.75 0.00 0.00 39.64 37.22 2krs n ILE 36 CO 0.00 0.00 0.00 -0.54 0.56 0.00 0.00 176.55 176.57 2krs s LYS 37 N -2.09 0.88 -0.19 0.38 1.02 -1.25 -5.01 119.74 113.48 2krs s LYS 37 Ca -0.15 -0.89 -0.03 0.00 0.02 0.00 0.00 55.97 54.91 2krs s LYS 37 Cb 0.02 0.37 -0.01 0.00 -0.52 0.00 0.00 37.83 37.68 2krs s LYS 37 CO 0.22 -0.29 -0.06 -2.00 -0.92 0.00 0.00 175.35 172.30 2krs s GLU 38 N -3.80 3.43 -0.06 1.68 2.12 -1.26 0.21 118.70 121.03 2krs s GLU 38 Ca 0.04 -0.62 0.03 0.00 0.36 0.00 0.00 54.97 54.79 2krs s GLU 38 Cb 0.04 -2.93 0.01 0.00 0.26 0.00 0.00 34.13 31.51 2krs s GLU 38 CO -0.11 -0.06 -0.15 0.08 -0.54 0.00 0.00 175.26 174.49 2krs s VAL 39 N 1.10 1.27 -1.38 3.70 1.01 0.11 -4.75 120.40 121.47 2krs s VAL 39 Ca 0.01 -0.59 -0.01 0.00 0.00 0.00 0.00 61.98 61.39 2krs s VAL 39 Cb -0.15 -1.13 0.00 0.00 0.00 0.00 0.00 36.38 35.11 2krs s VAL 39 CO -0.01 0.38 0.07 0.47 0.00 0.00 0.00 175.10 176.02 2krs n ASP 40 N 3.50 -4.82 0.00 3.32 8.00 -1.26 0.03 116.55 125.33 2krs n ASP 40 Ca -0.20 0.05 0.00 0.00 0.71 0.00 0.00 54.79 55.34 2krs n ASP 40 Cb 0.52 -4.03 0.00 0.00 -0.02 0.00 0.00 41.12 37.59 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 -0.96 2.84 3.82 0.44 0.00 -1.26 -5.00 105.19 105.07 2krs n GLY 41 Ca -0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.50 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 -1.90 3.50 -0.19 1.61 0.52 0.11 -4.07 118.94 118.51 2krs s TRP 42 Ca 0.00 1.45 -0.09 0.00 0.02 0.00 0.00 56.10 57.47 2krs s TRP 42 Cb 0.00 -2.69 -0.05 0.00 -1.15 0.00 0.00 33.47 29.58 2krs s TRP 42 CO 0.00 0.15 0.11 0.71 0.02 0.00 0.00 176.95 177.94 2krs s TYR 43 N -1.82 3.38 -0.20 -1.98 2.02 -0.48 0.04 117.35 118.31 2krs s TYR 43 Ca 0.52 0.28 -0.23 0.00 -0.37 0.00 0.00 57.07 57.27 2krs s TYR 43 Cb -0.13 -2.13 -0.02 0.00 -0.40 0.00 0.00 41.96 39.27 2krs s TYR 43 CO 0.19 0.28 0.72 -2.00 -1.57 0.00 0.00 175.55 173.16 2krs s GLU 44 N 0.31 4.23 0.18 -0.62 2.12 0.13 -2.14 118.70 122.91 2krs s GLU 44 Ca 0.07 0.78 0.05 0.00 0.36 0.00 0.00 54.97 56.23 2krs s GLU 44 Cb -0.11 -3.59 -0.05 0.00 0.26 0.00 0.00 34.13 30.64 2krs s GLU 44 CO -0.01 -0.32 -0.08 0.96 -0.54 0.00 0.00 175.26 175.27 2krs s ILE 45 N 2.17 1.23 -0.16 -3.70 -4.36 -0.79 -0.94 121.20 114.64 2krs s ILE 45 Ca 0.32 -2.08 0.01 0.00 -0.26 0.00 0.00 60.65 58.65 2krs s ILE 45 Cb -0.16 -2.02 0.01 0.00 1.25 0.00 0.00 42.46 41.53 2krs s ILE 45 CO 0.10 -0.60 -0.19 -0.60 0.24 0.00 0.00 174.94 173.89 2krs s ARG 46 N -3.76 3.08 -0.07 0.37 3.52 -1.06 -1.81 118.95 119.23 2krs s ARG 46 Ca 0.21 -0.81 -0.05 0.00 -0.13 0.00 0.00 55.73 54.95 2krs s ARG 46 Cb 0.03 -2.54 0.03 0.00 -1.56 0.00 0.00 34.95 30.90 2krs s ARG 46 CO 0.04 -0.06 0.16 0.12 -0.81 0.00 0.00 175.30 174.75 2krs s PHE 47 N 0.96 -0.19 -1.50 5.12 5.36 0.18 -4.13 117.98 123.78 2krs s PHE 47 Ca -0.03 0.48 -0.05 0.00 -0.96 0.00 0.00 56.93 56.37 2krs s PHE 47 Cb -0.15 0.02 0.02 0.00 -0.34 0.00 0.00 43.02 42.57 2krs s PHE 47 CO -0.04 -0.13 0.54 -1.71 -1.46 0.00 0.00 175.22 172.42 2krs n ASN 48 N 3.49 -5.58 -0.72 6.13 2.85 -1.26 -0.36 115.26 119.81 2krs n ASN 48 Ca -0.18 -0.28 -0.09 0.00 -0.11 0.00 0.00 54.58 53.92 2krs n ASN 48 Cb 0.56 -4.54 -0.04 0.00 1.24 0.00 0.00 39.78 37.00 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 -1.41 1.08 3.26 8.20 0.00 -1.26 -5.00 105.19 110.06 2krs n GLY 49 Ca -0.10 -0.44 -0.25 0.00 0.00 0.00 0.00 46.02 45.23 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 -2.65 1.33 -0.12 1.61 1.02 0.52 -5.14 119.74 116.31 2krs s LYS 50 Ca 0.00 -1.00 0.00 0.00 0.02 0.00 0.00 55.97 55.00 2krs s LYS 50 Cb 0.00 -1.48 -0.02 0.00 -0.52 0.00 0.00 37.83 35.81 2krs s LYS 50 CO 0.00 0.37 -0.13 0.08 -0.92 0.00 0.00 175.35 174.75 2krs s VAL 51 N -0.89 3.07 0.00 3.17 1.01 -1.26 0.51 120.40 126.01 2krs s VAL 51 Ca 0.07 -0.67 0.00 0.00 0.00 0.00 0.00 61.98 61.39 2krs s VAL 51 Cb -0.09 -2.28 0.00 0.00 0.00 0.00 0.00 36.38 34.01 2krs s VAL 51 CO 0.02 0.53 0.00 0.61 0.00 0.00 0.00 175.10 176.27 2krs n GLY 52 N 3.33 3.55 3.15 4.51 0.00 -0.75 -4.90 105.19 114.08 2krs n GLY 52 Ca -0.18 -1.19 -0.12 0.00 0.00 0.00 0.00 46.02 44.53 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 -3.71 0.90 0.00 1.61 1.51 0.17 -1.89 117.35 115.94 2krs s TYR 53 Ca 0.00 -0.75 -0.10 0.00 -1.01 0.00 0.00 57.07 55.20 2krs s TYR 53 Cb 0.00 -0.51 0.01 0.00 -0.11 0.00 0.00 41.96 41.35 2krs s TYR 53 CO 0.00 -0.09 0.21 0.00 -1.11 0.00 0.00 175.55 174.56 2krs s ALA 54 N -2.84 -0.49 0.35 3.71 0.00 -0.91 -2.07 121.76 119.51 2krs s ALA 54 Ca 0.06 0.01 -0.27 0.00 0.00 0.00 0.00 51.96 51.75 2krs s ALA 54 Cb -0.00 0.12 -0.09 0.00 0.00 0.00 0.00 23.12 23.15 2krs s ALA 54 CO -0.02 -0.25 1.19 -1.12 0.00 0.00 0.00 175.76 175.56 2krs s SER 55 N -1.46 6.76 0.18 0.00 0.01 -1.26 -1.39 113.70 116.55 2krs s SER 55 Ca -0.13 2.42 0.19 0.00 1.31 0.00 0.00 55.95 59.74 2krs s SER 55 Cb -0.06 -2.63 0.84 0.00 0.21 0.00 0.00 66.02 64.38 2krs s SER 55 CO 0.02 -0.51 1.59 2.29 0.41 0.00 0.00 173.24 177.04 2krs n LYS 56 N 0.53 0.12 0.14 12.44 2.85 -1.26 -1.72 118.16 131.26 2krs n LYS 56 Ca 0.02 0.40 0.07 0.00 -1.05 0.00 0.00 58.31 57.76 2krs n LYS 56 Cb 0.45 -1.75 0.40 0.00 -0.65 0.00 0.00 35.03 33.47 2krs n LYS 56 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 177.40 176.22 2krs n SER 57 N -1.99 0.38 0.00 -5.58 3.41 -1.26 -2.22 113.62 106.37 2krs n SER 57 Ca 0.02 0.62 0.00 0.00 -0.26 0.00 0.00 58.87 59.25 2krs n SER 57 Cb 0.18 -0.64 0.00 0.00 -0.26 0.00 0.00 64.21 63.49 2krs n SER 57 CO 0.00 0.00 0.00 -1.22 -0.16 0.00 0.00 175.04 173.66 2krs n TYR 58 N -2.03 0.00 -3.22 7.33 4.01 -0.70 -5.03 117.16 117.51 2krs n TYR 58 Ca -0.01 0.00 -0.39 0.00 -0.16 0.00 0.00 57.90 57.34 2krs n TYR 58 Cb 0.15 0.00 -0.06 0.00 -0.31 0.00 0.00 39.34 39.13 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 -1.58 5.13 -0.09 -0.72 1.09 -0.94 -2.48 121.20 121.61 2krs s ILE 59 Ca 0.00 1.11 0.03 0.00 -1.10 0.00 0.00 60.65 60.69 2krs s ILE 59 Cb 0.00 -3.89 0.01 0.00 -1.06 0.00 0.00 42.46 37.51 2krs s ILE 59 CO 0.00 0.28 -0.19 -0.89 -0.10 0.00 0.00 174.94 174.05 2krs s THR 60 N 0.81 1.66 -0.07 2.92 2.01 -0.80 -4.65 115.64 117.52 2krs s THR 60 Ca 0.29 -0.78 -0.27 0.00 0.31 0.00 0.00 61.69 61.25 2krs s THR 60 Cb -0.16 -1.46 -0.03 0.00 0.01 0.00 0.00 72.50 70.86 2krs s THR 60 CO 0.13 0.47 0.86 -0.63 -0.69 0.00 0.00 174.62 174.76 2krs s ILE 61 N 0.55 4.92 0.14 1.82 1.09 -1.26 -2.66 121.20 125.80 2krs s ILE 61 Ca -0.16 1.77 -0.26 0.00 -1.10 0.00 0.00 60.65 60.91 2krs s ILE 61 Cb -0.17 -4.19 -0.07 0.00 -1.06 0.00 0.00 42.46 36.97 2krs s ILE 61 CO 0.06 0.14 0.81 0.68 -0.10 0.00 0.00 174.94 176.53 2krs s VAL 62 N 1.30 4.42 0.02 2.92 -7.23 -1.26 -4.91 120.40 115.66 2krs s VAL 62 Ca 0.44 1.76 0.00 0.00 -1.81 0.00 0.00 61.98 62.37 2krs s VAL 62 Cb -0.19 -4.17 0.00 0.00 0.56 0.00 0.00 36.38 32.58 2krs s VAL 62 CO 0.20 0.47 0.00 -3.20 -0.31 0.00 0.00 175.10 172.26 2krs n ASN 63 N 1.94 -1.76 -2.58 4.85 2.85 -1.26 -4.93 115.26 114.38 2krs n ASN 63 Ca -0.04 0.09 -0.01 0.00 -0.11 0.00 0.00 54.58 54.52 2krs n ASN 63 Cb 0.49 -0.34 0.00 0.00 1.24 0.00 0.00 39.78 41.17 2krs n ASN 63 CO 0.00 0.00 0.00 1.21 -2.11 0.00 0.00 177.26 176.36 2krs n GLU 64 N -0.75 -0.95 0.00 1.20 0.00 -1.26 -5.03 120.64 113.85 2krs n GLU 64 Ca 0.00 1.15 0.00 0.00 0.00 0.00 0.00 57.16 58.31 2krs n GLU 64 Cb 0.04 -4.44 0.00 0.00 0.00 0.00 0.00 31.44 27.04 2krs n GLU 64 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2krs n GLY 65 N -1.51 -0.20 3.82 8.31 0.00 -1.26 -4.98 105.19 109.37 2krs n GLY 65 Ca -0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 2krs n GLY 65 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2krs s SER 66 N -2.81 5.14 -0.05 1.61 1.04 -1.26 -4.99 113.70 112.39 2krs s SER 66 Ca 0.00 1.48 -0.30 0.00 0.48 0.00 0.00 55.95 57.61 2krs s SER 66 Cb 0.00 -2.32 -0.03 0.00 0.10 0.00 0.00 66.02 63.78 2krs s SER 66 CO 0.00 -1.58 1.10 -0.22 0.98 0.00 0.00 173.24 173.52 2krs s LEU 67 N -5.59 4.30 0.37 2.42 2.96 -1.26 -5.02 118.68 116.85 2krs s LEU 67 Ca 0.59 1.73 -0.16 0.00 -0.22 0.00 0.00 54.13 56.07 2krs s LEU 67 Cb -0.14 -3.56 -0.09 0.00 0.50 0.00 0.00 46.19 42.90 2krs s LEU 67 CO 0.55 -0.47 0.81 -0.70 -1.32 0.00 0.00 176.35 175.21 2krs s GLU 68 N 1.79 4.04 -0.19 1.98 2.12 -1.26 -5.06 118.70 122.12 2krs s GLU 68 Ca 0.53 0.79 -0.06 0.00 0.36 0.00 0.00 54.97 56.59 2krs s GLU 68 Cb -0.23 -2.34 -0.04 0.00 0.26 0.00 0.00 34.13 31.79 2krs s GLU 68 CO 0.23 0.06 0.04 -1.01 -0.54 0.00 0.00 175.26 174.04 2krs s HIS 69 N -2.11 3.17 -0.20 5.30 3.76 -1.26 -5.08 115.29 118.87 2krs s HIS 69 Ca 0.56 -0.10 -0.24 0.00 -0.15 0.00 0.00 55.06 55.14 2krs s HIS 69 Cb -0.10 -2.07 -0.02 0.00 1.11 0.00 0.00 32.58 31.50 2krs s HIS 69 CO 0.18 0.02 0.77 -1.58 -0.85 0.00 0.00 174.74 173.29 2krs s HIS 70 N 0.57 3.38 0.12 1.40 2.46 -1.26 -5.05 115.29 116.91 2krs s HIS 70 Ca 0.02 1.13 -0.14 0.00 0.47 0.00 0.00 55.06 56.54 2krs s HIS 70 Cb -0.13 -2.96 -0.07 0.00 -0.13 0.00 0.00 32.58 29.29 2krs s HIS 70 CO 0.02 -0.26 0.51 -1.01 -2.47 0.00 0.00 174.74 171.52 2krs s HIS 71 N 2.26 3.62 0.32 3.88 3.76 -1.26 -5.05 115.29 122.82 2krs s HIS 71 Ca 0.35 1.01 -0.29 0.00 -0.15 0.00 0.00 55.06 55.97 2krs s HIS 71 Cb -0.16 -2.32 -0.10 0.00 1.11 0.00 0.00 32.58 31.11 2krs s HIS 71 CO 0.11 0.47 1.29 -3.38 -0.85 0.00 0.00 174.74 172.38 2krs s HIS 72 N -1.40 3.12 -0.11 1.40 -3.43 -1.26 -4.98 115.29 108.62 2krs s HIS 72 Ca 0.35 1.43 -0.26 0.00 -0.80 0.00 0.00 55.06 55.78 2krs s HIS 72 Cb -0.15 -3.64 -0.02 0.00 -1.43 0.00 0.00 32.58 27.34 2krs s HIS 72 CO 0.18 -1.72 0.85 -1.58 -2.00 0.00 0.00 174.74 170.47 2krs s HIS 73 N -1.08 3.50 -2.00 0.38 2.46 -1.26 -5.35 115.29 111.95 2krs s HIS 73 Ca 0.49 1.37 0.14 0.00 0.47 0.00 0.00 55.06 57.53 2krs s HIS 73 Cb -0.39 -3.01 0.85 0.00 -0.13 0.00 0.00 32.58 29.90 2krs s HIS 73 CO 0.51 -0.13 1.27 0.72 -2.47 0.00 0.00 174.74 174.64