#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 0.18 0.27 2.12 0.00 -1.26 -4.57 119.66 116.40 2krs s GLN 2 Ca 0.00 0.63 -0.12 0.00 -0.00 0.00 0.00 55.36 55.87 2krs s GLN 2 Cb 0.00 -0.29 -0.08 0.00 0.00 0.00 0.00 33.01 32.64 2krs s GLN 2 CO 0.00 -0.39 0.64 0.20 0.00 0.00 0.00 175.29 175.74 2krs s GLY 3 N 2.42 2.31 -0.10 2.60 0.00 -0.84 -3.76 107.32 109.96 2krs s GLY 3 Ca 0.03 -0.12 0.03 0.00 0.00 0.00 0.00 44.72 44.67 2krs s GLY 3 CO -0.10 0.06 -0.21 0.14 0.00 0.00 0.00 173.10 172.99 2krs s VAL 4 N -1.88 1.84 -0.18 1.40 1.01 -1.05 -2.41 120.40 119.14 2krs s VAL 4 Ca 0.50 -0.89 -0.17 0.00 0.00 0.00 0.00 61.98 61.43 2krs s VAL 4 Cb -0.11 -1.61 -0.04 0.00 0.00 0.00 0.00 36.38 34.62 2krs s VAL 4 CO 0.19 0.51 0.42 -0.69 0.00 0.00 0.00 175.10 175.54 2krs s VAL 5 N 0.47 5.19 -0.26 2.92 1.01 -1.23 -1.56 120.40 126.94 2krs s VAL 5 Ca -0.17 0.78 0.02 0.00 0.00 0.00 0.00 61.98 62.61 2krs s VAL 5 Cb -0.17 -3.76 0.05 0.00 0.00 0.00 0.00 36.38 32.50 2krs s VAL 5 CO 0.07 0.27 -0.09 -0.75 0.00 0.00 0.00 175.10 174.59 2krs s LYS 6 N 1.15 2.36 -0.03 2.72 2.47 0.17 -1.72 119.74 126.85 2krs s LYS 6 Ca 0.21 -1.28 -0.06 0.00 -1.56 0.00 0.00 55.97 53.28 2krs s LYS 6 Cb -0.15 -2.95 0.01 0.00 -1.46 0.00 0.00 37.83 33.29 2krs s LYS 6 CO 0.08 -0.55 0.14 0.54 0.16 0.00 0.00 175.35 175.72 2krs s VAL 7 N 1.16 0.04 0.19 4.02 0.11 -1.26 -4.63 120.40 120.03 2krs s VAL 7 Ca -0.07 -0.34 -0.10 0.00 -2.93 0.00 0.00 61.98 58.55 2krs s VAL 7 Cb -0.19 -0.32 0.11 0.00 -1.53 0.00 0.00 36.38 34.45 2krs s VAL 7 CO -0.04 -0.18 1.75 0.78 -3.33 0.00 0.00 175.10 174.07 2krs h ASN 8 N 5.13 0.97 0.00 3.54 2.35 -2.01 -3.43 115.58 122.14 2krs h ASN 8 Ca -0.28 -0.18 0.00 0.00 -0.55 0.00 0.00 56.30 55.29 2krs h ASN 8 Cb 1.20 -0.25 0.00 0.00 0.05 0.00 0.00 38.32 39.31 2krs h ASN 8 CO 0.41 0.89 0.00 -1.20 -1.65 0.00 0.00 177.43 175.88 2krs n SER 9 N -4.36 0.00 -3.61 5.81 7.64 -1.26 -5.01 113.62 112.83 2krs n SER 9 Ca 0.05 0.00 -0.16 0.00 1.01 0.00 0.00 58.87 59.78 2krs n SER 9 Cb 0.19 -0.01 -0.07 0.00 -1.01 0.00 0.00 64.21 63.30 2krs n SER 9 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2krs s ALA 10 N -2.09 -1.58 -0.15 -0.43 0.00 -1.26 -4.21 121.76 112.03 2krs s ALA 10 Ca 0.00 1.42 -0.03 0.00 0.00 0.00 0.00 51.96 53.35 2krs s ALA 10 Cb 0.00 -0.45 -0.03 0.00 0.00 0.00 0.00 23.12 22.64 2krs s ALA 10 CO 0.00 -0.33 -0.04 -1.17 0.00 0.00 0.00 175.76 174.22 2krs s LEU 11 N -0.54 3.27 0.33 0.00 2.96 0.12 -4.91 118.68 119.91 2krs s LEU 11 Ca -0.07 -0.11 -0.24 0.00 -0.22 0.00 0.00 54.13 53.50 2krs s LEU 11 Cb -0.03 -1.78 -0.10 0.00 0.50 0.00 0.00 46.19 44.79 2krs s LEU 11 CO 0.05 0.19 0.91 0.20 -1.32 0.00 0.00 176.35 176.39 2krs s ASN 12 N 0.22 7.21 0.08 3.68 0.02 -1.26 0.78 114.94 125.67 2krs s ASN 12 Ca -0.02 1.74 0.04 0.00 -1.02 0.00 0.00 52.86 53.59 2krs s ASN 12 Cb -0.14 -2.55 -0.04 0.00 0.02 0.00 0.00 41.25 38.55 2krs s ASN 12 CO 0.03 -0.11 0.05 -0.32 0.02 0.00 0.00 177.10 176.76 2krs s MET 13 N -2.29 2.75 -0.00 -0.60 -2.45 -0.83 -4.84 119.30 111.05 2krs s MET 13 Ca 0.52 -0.74 0.03 0.00 -1.25 0.00 0.00 55.69 54.24 2krs s MET 13 Cb -0.16 -2.65 -0.01 0.00 1.25 0.00 0.00 34.83 33.26 2krs s MET 13 CO 0.21 0.56 -0.09 1.03 1.05 0.00 0.00 175.02 177.78 2krs s ARG 14 N -2.33 0.68 0.22 4.11 0.52 -1.01 -1.09 118.95 120.05 2krs s ARG 14 Ca 0.28 -0.34 -0.08 0.00 -0.52 0.00 0.00 55.73 55.06 2krs s ARG 14 Cb -0.12 -0.65 0.22 0.00 0.52 0.00 0.00 34.95 34.92 2krs s ARG 14 CO 0.20 0.18 1.88 1.03 0.02 0.00 0.00 175.30 178.61 2krs h SER 15 N 5.82 0.90 -2.07 0.23 0.87 -1.84 0.76 113.55 118.21 2krs h SER 15 Ca -0.31 -0.01 -0.53 0.00 -1.23 0.00 0.00 61.79 59.71 2krs h SER 15 Cb 1.18 -0.21 -0.07 0.00 -0.44 0.00 0.00 62.40 62.86 2krs h SER 15 CO 0.49 0.63 -0.56 -0.83 -0.53 0.00 0.00 176.83 176.04 2krs s GLY 16 N -3.00 1.67 -1.30 5.77 0.00 -1.26 -4.28 107.32 104.91 2krs s GLY 16 Ca -0.13 -1.63 -0.17 0.00 0.00 0.00 0.00 44.72 42.80 2krs s GLY 16 CO 0.79 -1.63 2.04 -1.55 0.00 0.00 0.00 173.10 172.74 2krs n PRO 17 N -1.11 2.67 0.00 2.90 -0.04 -1.26 -4.54 135.00 133.62 2krs n PRO 17 Ca -0.05 -2.67 0.00 0.00 -0.04 0.00 0.00 63.50 60.74 2krs n PRO 17 Cb 0.59 -3.32 0.00 0.00 -0.04 0.00 0.00 33.50 30.73 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 4.61 1.08 0.16 0.55 0.00 -1.26 -5.00 105.19 105.33 2krs n GLY 18 Ca 0.50 -0.70 0.13 0.00 0.00 0.00 0.00 46.02 45.95 2krs n GLY 18 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2krs h SER 19 N 0.00 0.00 -0.33 1.61 0.02 -1.97 -3.26 113.55 109.63 2krs h SER 19 Ca 0.00 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.88 2krs h SER 19 Cb 0.00 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.52 2krs h SER 19 CO 0.00 0.00 -0.01 0.78 -1.14 0.00 0.00 176.83 176.46 2krs h ASN 20 N 0.00 0.66 -0.76 3.07 2.35 -1.94 -3.02 115.58 115.93 2krs h ASN 20 Ca 0.00 -0.15 0.02 0.00 -0.55 0.00 0.00 56.30 55.62 2krs h ASN 20 Cb 0.80 -0.17 -0.04 0.00 0.05 0.00 0.00 38.32 38.95 2krs h ASN 20 CO 0.00 0.73 0.50 1.88 -1.65 0.00 0.00 177.43 178.89 2krs h TYR 21 N 0.65 0.93 0.00 1.19 0.05 -1.88 -3.49 116.97 114.42 2krs h TYR 21 Ca 0.13 0.02 0.00 0.00 0.05 0.00 0.00 58.73 58.93 2krs h TYR 21 Cb 0.42 -0.31 0.00 0.00 1.01 0.00 0.00 36.73 37.85 2krs h TYR 21 CO 0.02 0.56 0.00 0.41 -1.05 0.00 0.00 178.16 178.10 2krs n GLY 22 N -1.31 2.14 3.72 3.88 0.00 -1.14 -4.92 105.19 107.56 2krs n GLY 22 Ca 0.08 -1.93 -0.41 0.00 0.00 0.00 0.00 46.02 43.76 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 -2.78 4.27 -0.43 1.61 0.11 -1.26 -4.21 120.40 117.72 2krs s VAL 23 Ca 0.00 1.77 0.07 0.00 -2.93 0.00 0.00 61.98 60.89 2krs s VAL 23 Cb 0.00 -4.13 -0.05 0.00 -1.53 0.00 0.00 36.38 30.66 2krs s VAL 23 CO 0.00 0.22 0.36 2.30 -3.33 0.00 0.00 175.10 174.65 2krs n ILE 24 N 3.19 0.00 -3.83 7.04 -5.35 -0.25 -5.01 119.36 115.16 2krs n ILE 24 Ca 0.05 -0.36 -0.01 0.00 -0.27 0.00 0.00 62.75 62.16 2krs n ILE 24 Cb 0.48 1.02 0.01 0.00 -1.74 0.00 0.00 39.64 39.41 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 -1.50 -0.10 -0.07 3.28 0.00 -1.24 -5.01 107.32 102.66 2krs s GLY 25 Ca 0.04 0.02 0.04 0.00 0.00 0.00 0.00 44.72 44.82 2krs s GLY 25 CO 0.26 2.14 -0.20 -1.59 0.00 0.00 0.00 173.10 173.70 2krs s THR 26 N -2.40 1.72 -0.04 0.90 2.01 -1.26 -1.96 115.64 114.60 2krs s THR 26 Ca 0.20 -0.84 0.01 0.00 0.31 0.00 0.00 61.69 61.36 2krs s THR 26 Cb -0.01 -1.49 -0.03 0.00 0.01 0.00 0.00 72.50 70.98 2krs s THR 26 CO 0.02 0.49 -0.04 -0.76 -0.69 0.00 0.00 174.62 173.64 2krs s LEU 27 N 0.25 3.34 0.48 4.42 1.43 0.23 -4.94 118.68 123.89 2krs s LEU 27 Ca -0.12 -0.01 0.03 0.00 -1.03 0.00 0.00 54.13 53.00 2krs s LEU 27 Cb -0.15 -1.82 0.01 0.00 0.03 0.00 0.00 46.19 44.26 2krs s LEU 27 CO 0.05 0.33 0.67 -0.13 0.23 0.00 0.00 176.35 177.51 2krs s ARG 28 N -1.12 2.79 0.67 1.70 0.52 -1.26 0.13 118.95 122.38 2krs s ARG 28 Ca 0.15 -0.82 -0.12 0.00 -0.52 0.00 0.00 55.73 54.42 2krs s ARG 28 Cb -0.11 -2.60 -0.00 0.00 0.52 0.00 0.00 34.95 32.76 2krs s ARG 28 CO 0.05 -0.43 1.06 0.54 0.02 0.00 0.00 175.30 176.53 2krs s ASN 29 N -4.33 5.52 -1.46 0.23 4.22 -1.26 -3.54 114.94 114.32 2krs s ASN 29 Ca 0.53 1.64 -0.02 0.00 -2.14 0.00 0.00 52.86 52.87 2krs s ASN 29 Cb -0.10 -2.50 0.01 0.00 1.28 0.00 0.00 41.25 39.94 2krs s ASN 29 CO 0.36 -1.35 0.21 0.59 -2.04 0.00 0.00 177.10 174.87 2krs n ASN 30 N -2.89 -5.12 -4.52 3.54 3.02 -0.70 -4.94 115.26 103.64 2krs n ASN 30 Ca 0.08 -0.07 -0.42 0.00 -0.03 0.00 0.00 54.58 54.14 2krs n ASN 30 Cb 0.53 -4.25 -0.09 0.00 -0.61 0.00 0.00 39.78 35.37 2krs n ASN 30 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2krs s ASP 31 N -2.28 6.21 0.16 6.41 -1.08 -1.23 -4.94 116.67 119.91 2krs s ASP 31 Ca 0.12 -0.40 -0.30 0.00 -0.52 0.00 0.00 52.55 51.45 2krs s ASP 31 Cb -0.06 -2.22 -0.07 0.00 -1.46 0.00 0.00 42.92 39.11 2krs s ASP 31 CO 0.15 -0.47 1.16 -0.54 0.52 0.00 0.00 175.17 175.99 2krs s LYS 32 N 2.14 4.52 0.12 4.34 1.02 -1.26 -3.52 119.74 127.10 2krs s LYS 32 Ca 0.13 1.80 0.01 0.00 0.02 0.00 0.00 55.97 57.92 2krs s LYS 32 Cb -0.17 -3.28 -0.04 0.00 -0.52 0.00 0.00 37.83 33.83 2krs s LYS 32 CO 0.13 -0.06 -0.02 0.14 -0.92 0.00 0.00 175.35 174.62 2krs s VAL 33 N 0.10 0.50 -0.26 3.17 -7.23 -1.01 -5.02 120.40 110.64 2krs s VAL 33 Ca 0.53 -1.93 -0.10 0.00 -1.81 0.00 0.00 61.98 58.67 2krs s VAL 33 Cb -0.31 -1.86 -0.04 0.00 0.56 0.00 0.00 36.38 34.73 2krs s VAL 33 CO 0.35 -0.69 0.15 -0.70 -0.31 0.00 0.00 175.10 173.89 2krs s GLU 34 N -3.91 3.89 -0.12 4.82 2.12 -1.26 -1.98 118.70 122.25 2krs s GLU 34 Ca 0.17 -0.36 -0.21 0.00 0.36 0.00 0.00 54.97 54.93 2krs s GLU 34 Cb 0.06 -3.53 -0.03 0.00 0.26 0.00 0.00 34.13 30.89 2krs s GLU 34 CO -0.02 -0.13 0.63 0.42 -0.54 0.00 0.00 175.26 175.62 2krs s ILE 35 N 1.57 5.07 -0.16 -3.70 1.01 -1.26 -2.47 121.20 121.25 2krs s ILE 35 Ca 0.07 1.25 -0.09 0.00 0.00 0.00 0.00 60.65 61.87 2krs s ILE 35 Cb -0.15 -3.96 -0.23 0.00 0.01 0.00 0.00 42.46 38.13 2krs s ILE 35 CO 0.08 0.22 0.23 -0.38 0.00 0.00 0.00 174.94 175.09 2krs n ILE 36 N 4.06 1.68 -3.61 2.92 5.41 0.11 -5.00 119.36 124.94 2krs n ILE 36 Ca -0.03 -0.49 -0.02 0.00 1.00 0.00 0.00 62.75 63.22 2krs n ILE 36 Cb 0.51 -1.78 -0.01 0.00 -0.71 0.00 0.00 39.64 37.65 2krs n ILE 36 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 176.55 174.96 2krs s LYS 37 N -2.51 0.40 -0.20 0.38 -2.85 -1.24 -5.01 119.74 108.71 2krs s LYS 37 Ca -0.26 -0.19 -0.03 0.00 -1.00 0.00 0.00 55.97 54.49 2krs s LYS 37 Cb 0.07 0.16 -0.01 0.00 -2.06 0.00 0.00 37.83 35.99 2krs s LYS 37 CO 0.70 -0.18 -0.07 -2.00 0.10 0.00 0.00 175.35 173.90 2krs s GLU 38 N -2.48 3.35 -0.06 1.78 2.12 -1.26 0.31 118.70 122.46 2krs s GLU 38 Ca 0.12 -0.65 0.03 0.00 0.36 0.00 0.00 54.97 54.82 2krs s GLU 38 Cb 0.02 -2.90 0.01 0.00 0.26 0.00 0.00 34.13 31.51 2krs s GLU 38 CO -0.04 -0.12 -0.15 0.08 -0.54 0.00 0.00 175.26 174.49 2krs s VAL 39 N 1.25 1.35 -1.29 3.70 1.01 0.12 -4.75 120.40 121.79 2krs s VAL 39 Ca 0.03 -0.62 -0.02 0.00 0.00 0.00 0.00 61.98 61.37 2krs s VAL 39 Cb -0.14 -1.20 0.01 0.00 0.00 0.00 0.00 36.38 35.05 2krs s VAL 39 CO -0.03 0.40 0.12 -0.67 0.00 0.00 0.00 175.10 174.92 2krs n ASP 40 N 3.58 -4.53 0.00 3.32 -0.08 -1.26 0.23 116.55 117.81 2krs n ASP 40 Ca -0.21 0.03 0.00 0.00 -1.51 0.00 0.00 54.79 53.10 2krs n ASP 40 Cb 0.52 -3.79 0.00 0.00 2.34 0.00 0.00 41.12 40.19 2krs n ASP 40 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2krs n GLY 41 N -0.96 2.80 3.81 0.27 0.00 -1.26 -5.01 105.19 104.84 2krs n GLY 41 Ca -0.15 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.52 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 -1.96 3.57 -0.19 1.61 0.52 0.14 -4.52 118.94 118.10 2krs s TRP 42 Ca 0.00 1.50 -0.09 0.00 0.02 0.00 0.00 56.10 57.53 2krs s TRP 42 Cb 0.00 -2.72 -0.05 0.00 -1.15 0.00 0.00 33.47 29.55 2krs s TRP 42 CO 0.00 0.20 0.11 0.71 0.02 0.00 0.00 176.95 177.99 2krs s TYR 43 N -1.72 3.36 -0.28 -1.98 2.02 -1.19 0.15 117.35 117.72 2krs s TYR 43 Ca 0.49 0.25 -0.22 0.00 -0.37 0.00 0.00 57.07 57.23 2krs s TYR 43 Cb -0.15 -2.13 -0.01 0.00 -0.40 0.00 0.00 41.96 39.27 2krs s TYR 43 CO 0.20 0.26 0.71 -2.00 -1.57 0.00 0.00 175.55 173.15 2krs s GLU 44 N 0.33 4.03 0.23 -0.62 2.56 0.15 -2.34 118.70 123.04 2krs s GLU 44 Ca 0.07 0.57 0.08 0.00 0.00 0.00 0.00 54.97 55.68 2krs s GLU 44 Cb -0.11 -3.69 -0.05 0.00 2.00 0.00 0.00 34.13 32.27 2krs s GLU 44 CO -0.01 -0.55 -0.12 0.96 -0.56 0.00 0.00 175.26 174.98 2krs s ILE 45 N 2.72 1.74 -0.09 -3.70 -4.36 -0.92 0.07 121.20 116.67 2krs s ILE 45 Ca 0.29 -2.20 0.02 0.00 -0.26 0.00 0.00 60.65 58.50 2krs s ILE 45 Cb -0.15 -2.17 0.01 0.00 1.25 0.00 0.00 42.46 41.40 2krs s ILE 45 CO 0.10 -0.50 -0.14 -0.60 0.24 0.00 0.00 174.94 174.04 2krs s ARG 46 N -3.66 1.97 -0.09 0.37 3.52 -1.03 -2.48 118.95 117.55 2krs s ARG 46 Ca 0.25 -0.48 -0.06 0.00 -0.13 0.00 0.00 55.73 55.31 2krs s ARG 46 Cb 0.00 -1.67 0.04 0.00 -1.56 0.00 0.00 34.95 31.76 2krs s ARG 46 CO 0.09 -0.03 0.22 0.12 -0.81 0.00 0.00 175.30 174.89 2krs s PHE 47 N 0.87 -0.27 -1.53 5.12 5.36 -0.28 -4.17 117.98 123.07 2krs s PHE 47 Ca -0.10 0.66 -0.04 0.00 -0.96 0.00 0.00 56.93 56.49 2krs s PHE 47 Cb -0.15 0.04 0.01 0.00 -0.34 0.00 0.00 43.02 42.58 2krs s PHE 47 CO 0.01 -0.18 0.37 0.09 -1.46 0.00 0.00 175.22 174.05 2krs n ASN 48 N 3.79 -5.55 0.00 6.13 3.02 -1.26 -0.61 115.26 120.79 2krs n ASN 48 Ca -0.21 -0.18 0.00 0.00 -0.03 0.00 0.00 54.58 54.16 2krs n ASN 48 Cb 0.55 -4.55 0.00 0.00 -0.61 0.00 0.00 39.78 35.17 2krs n ASN 48 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2krs n GLY 49 N -1.28 0.42 3.74 7.41 0.00 -1.26 -5.00 105.19 109.21 2krs n GLY 49 Ca -0.14 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.54 2.73 -0.10 1.61 1.02 0.22 -5.12 119.74 119.56 2krs s LYS 50 Ca 0.00 -0.76 0.03 0.00 0.02 0.00 0.00 55.97 55.25 2krs s LYS 50 Cb 0.00 -2.64 -0.01 0.00 -0.52 0.00 0.00 37.83 34.66 2krs s LYS 50 CO 0.00 0.55 -0.18 0.08 -0.92 0.00 0.00 175.35 174.88 2krs s VAL 51 N -1.37 2.64 0.00 3.17 1.01 -1.26 -1.13 120.40 123.46 2krs s VAL 51 Ca 0.28 -0.83 0.00 0.00 0.00 0.00 0.00 61.98 61.43 2krs s VAL 51 Cb -0.12 -2.05 0.00 0.00 0.00 0.00 0.00 36.38 34.21 2krs s VAL 51 CO 0.20 0.55 0.00 0.61 0.00 0.00 0.00 175.10 176.47 2krs n GLY 52 N 3.22 2.07 3.32 4.51 0.00 -1.04 -4.69 105.19 112.59 2krs n GLY 52 Ca -0.18 -1.00 -0.22 0.00 0.00 0.00 0.00 46.02 44.62 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 -8.60 1.78 0.05 1.61 2.02 0.26 -2.15 117.35 112.32 2krs s TYR 53 Ca 0.00 -0.47 0.02 0.00 -0.37 0.00 0.00 57.07 56.25 2krs s TYR 53 Cb 0.00 -0.90 -0.03 0.00 -0.40 0.00 0.00 41.96 40.63 2krs s TYR 53 CO 0.00 0.31 -0.07 0.00 -1.57 0.00 0.00 175.55 174.21 2krs s ALA 54 N -1.99 0.63 0.49 3.71 0.00 -0.99 -2.41 121.76 121.20 2krs s ALA 54 Ca 0.14 -0.87 -0.23 0.00 0.00 0.00 0.00 51.96 51.01 2krs s ALA 54 Cb -0.06 0.07 -0.06 0.00 0.00 0.00 0.00 23.12 23.06 2krs s ALA 54 CO 0.06 -0.06 1.32 -1.12 0.00 0.00 0.00 175.76 175.96 2krs s SER 55 N -1.84 5.71 0.33 0.00 0.01 -1.26 -3.15 113.70 113.49 2krs s SER 55 Ca -0.06 2.68 0.17 0.00 1.31 0.00 0.00 55.95 60.05 2krs s SER 55 Cb -0.07 -2.63 0.30 0.00 0.21 0.00 0.00 66.02 63.83 2krs s SER 55 CO -0.01 -1.26 1.55 0.07 0.41 0.00 0.00 173.24 174.00 2krs h LYS 56 N 1.91 0.00 -0.76 12.44 2.10 -1.86 -2.99 116.57 127.41 2krs h LYS 56 Ca -0.50 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 58.12 2krs h LYS 56 Cb 1.28 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 32.57 2krs h LYS 56 CO 0.59 0.42 0.37 0.77 -2.00 0.00 0.00 179.45 179.61 2krs h SER 57 N 0.00 0.98 0.06 7.07 0.02 -1.94 -2.59 113.55 117.15 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 1.20 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 63.49 2krs h SER 57 CO 0.05 0.83 -0.13 -1.22 -1.14 0.00 0.00 176.83 175.23 2krs n TYR 58 N -4.40 0.00 -4.75 3.45 4.02 -1.23 -4.85 117.16 109.41 2krs n TYR 58 Ca 0.07 0.00 -0.33 0.00 -0.01 0.00 0.00 57.90 57.63 2krs n TYR 58 Cb 0.13 -0.04 -0.14 0.00 -0.02 0.00 0.00 39.34 39.27 2krs n TYR 58 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 2krs s ILE 59 N -2.21 3.12 -0.12 -0.72 1.09 -0.98 0.43 121.20 121.81 2krs s ILE 59 Ca 0.30 -0.64 0.02 0.00 -1.10 0.00 0.00 60.65 59.24 2krs s ILE 59 Cb 0.20 -2.31 0.00 0.00 -1.06 0.00 0.00 42.46 39.29 2krs s ILE 59 CO 0.41 0.52 -0.20 -0.89 -0.10 0.00 0.00 174.94 174.68 2krs s THR 60 N 0.34 2.31 0.12 2.92 2.01 -0.60 -4.77 115.64 117.96 2krs s THR 60 Ca -0.10 -0.91 -0.30 0.00 0.31 0.00 0.00 61.69 60.68 2krs s THR 60 Cb -0.16 -1.92 -0.06 0.00 0.01 0.00 0.00 72.50 70.37 2krs s THR 60 CO 0.06 0.54 1.05 -0.63 -0.69 0.00 0.00 174.62 174.95 2krs s ILE 61 N 0.55 4.22 -0.15 1.82 -1.09 -1.26 -2.51 121.20 122.78 2krs s ILE 61 Ca -0.12 1.80 -0.13 0.00 -2.23 0.00 0.00 60.65 59.96 2krs s ILE 61 Cb -0.17 -4.15 -0.05 0.00 -1.58 0.00 0.00 42.46 36.52 2krs s ILE 61 CO 0.04 0.25 0.28 -0.69 -1.23 0.00 0.00 174.94 173.60 2krs s VAL 62 N 0.19 5.30 -1.19 2.92 1.01 -1.25 -4.38 120.40 123.01 2krs s VAL 62 Ca 0.50 0.53 -0.01 0.00 0.00 0.00 0.00 61.98 63.00 2krs s VAL 62 Cb -0.26 -3.61 -0.01 0.00 0.00 0.00 0.00 36.38 32.49 2krs s VAL 62 CO 0.31 0.42 0.94 -3.20 0.00 0.00 0.00 175.10 173.58 2krs n ASN 63 N 3.33 -2.75 -3.02 3.32 2.85 -1.26 -4.72 115.26 113.00 2krs n ASN 63 Ca -0.13 -0.67 -0.15 0.00 -0.11 0.00 0.00 54.58 53.52 2krs n ASN 63 Cb 0.52 -4.97 -0.02 0.00 1.24 0.00 0.00 39.78 36.55 2krs n ASN 63 CO 0.00 0.00 0.00 -1.84 -2.11 0.00 0.00 177.26 173.31 2krs n GLU 64 N -4.00 1.48 -1.10 1.20 0.00 -1.26 -3.93 120.64 113.04 2krs n GLU 64 Ca -0.25 -1.12 -0.03 0.00 0.00 0.00 0.00 57.16 55.76 2krs n GLU 64 Cb 0.66 -2.26 -0.01 0.00 0.00 0.00 0.00 31.44 29.83 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 3.68 0.64 3.75 -1.84 0.00 -1.26 -5.01 105.19 105.15 2krs n GLY 65 Ca 0.32 -0.80 -0.33 0.00 0.00 0.00 0.00 46.02 45.21 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 -2.85 4.64 0.00 1.61 1.04 -1.25 -4.94 113.70 111.94 2krs s SER 66 Ca 0.00 2.05 0.00 0.00 0.48 0.00 0.00 55.95 58.48 2krs s SER 66 Cb 0.00 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.57 2krs s SER 66 CO 0.00 -1.95 0.00 0.00 0.98 0.00 0.00 173.24 172.27 2krs n LEU 67 N -2.84 0.00 -4.74 2.42 -0.00 -1.26 -5.05 117.00 105.53 2krs n LEU 67 Ca 0.11 0.00 -0.41 0.00 -0.00 0.00 0.00 56.01 55.70 2krs n LEU 67 Cb 0.52 0.00 -0.03 0.00 -0.00 0.00 0.00 43.42 43.91 2krs n LEU 67 CO 0.49 0.04 1.05 -1.61 -0.00 0.00 0.00 177.39 177.36 2krs s GLU 68 N 0.00 4.32 0.16 1.47 8.01 -1.26 -5.02 118.70 126.37 2krs s GLU 68 Ca 0.00 2.20 0.11 0.00 0.01 0.00 0.00 54.97 57.29 2krs s GLU 68 Cb 0.00 -3.14 -0.04 0.00 -4.31 0.00 0.00 34.13 26.64 2krs s GLU 68 CO 0.00 -0.34 -0.25 -1.01 0.01 0.00 0.00 175.26 173.66 2krs s HIS 69 N -0.02 2.32 -1.75 1.61 3.76 -1.26 -4.71 115.29 115.24 2krs s HIS 69 Ca 0.58 -0.37 -0.21 0.00 -0.15 0.00 0.00 55.06 54.91 2krs s HIS 69 Cb -0.40 -1.21 0.21 0.00 1.11 0.00 0.00 32.58 32.30 2krs s HIS 69 CO 0.42 0.41 0.54 -2.39 -0.85 0.00 0.00 174.74 172.86 2krs n HIS 70 N 0.62 -1.08 -2.38 1.40 -0.00 -1.26 -4.84 115.22 107.67 2krs n HIS 70 Ca -0.16 0.64 -0.38 0.00 -0.00 0.00 0.00 57.72 57.83 2krs n HIS 70 Cb 0.54 -1.77 -0.03 0.00 -0.00 0.00 0.00 29.99 28.74 2krs n HIS 70 CO 0.00 0.00 0.00 -3.38 -0.00 0.00 0.00 176.34 172.96 2krs s HIS 71 N -3.15 3.14 -0.04 -1.40 -0.00 -1.26 -5.05 115.29 107.54 2krs s HIS 71 Ca 0.75 1.59 0.02 0.00 -0.00 0.00 0.00 55.06 57.42 2krs s HIS 71 Cb -0.44 -3.30 0.02 0.00 -0.00 0.00 0.00 32.58 28.86 2krs s HIS 71 CO 0.96 -1.07 -0.06 -1.58 -0.00 0.00 0.00 174.74 172.98 2krs s HIS 72 N -1.48 0.85 0.06 0.38 5.65 -1.26 -5.13 115.29 114.35 2krs s HIS 72 Ca 0.57 -0.24 -0.25 0.00 0.25 0.00 0.00 55.06 55.39 2krs s HIS 72 Cb -0.28 -0.69 -0.06 0.00 -1.18 0.00 0.00 32.58 30.37 2krs s HIS 72 CO 0.35 -0.17 0.75 -1.01 -0.65 0.00 0.00 174.74 174.01 2krs s HIS 73 N 0.67 3.76 0.00 3.88 0.09 -1.26 -5.26 115.29 117.16 2krs s HIS 73 Ca -0.10 1.47 0.00 0.00 -0.00 0.00 0.00 55.06 56.43 2krs s HIS 73 Cb -0.13 -2.79 0.00 0.00 -0.00 0.00 0.00 32.58 29.66 2krs s HIS 73 CO 0.01 0.32 0.00 1.58 -0.00 0.00 0.00 174.74 176.65