#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2kr1 n LYS 2 N 0.00 3.29 -4.22 3.17 4.81 -1.26 -4.65 118.16 119.30 2kr1 n LYS 2 Ca 0.00 -3.55 -0.26 0.00 -0.87 0.00 0.00 58.31 53.62 2kr1 n LYS 2 Cb 0.00 -3.23 -0.08 0.00 0.02 0.00 0.00 35.03 31.74 2kr1 n LYS 2 CO 0.00 0.00 0.00 0.50 1.17 0.00 0.00 177.40 179.07 2kr1 s ARG 3 N 2.65 2.39 0.11 1.64 3.52 -1.26 -5.03 118.95 122.97 2kr1 s ARG 3 Ca 0.47 -1.14 -0.25 0.00 -0.13 0.00 0.00 55.73 54.68 2kr1 s ARG 3 Cb 0.01 -2.33 -0.08 0.00 -1.56 0.00 0.00 34.95 30.99 2kr1 s ARG 3 CO 0.03 0.44 1.66 0.00 -0.81 0.00 0.00 175.30 176.62 2kr1 h ALA 4 N 2.60 -0.29 -0.07 6.12 0.00 -1.99 -0.59 119.26 125.04 2kr1 h ALA 4 Ca -0.47 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.36 2kr1 h ALA 4 Cb 1.21 0.32 -0.01 0.00 0.00 0.00 0.00 17.79 19.31 2kr1 h ALA 4 CO 0.58 -0.71 -0.26 0.00 0.00 0.00 0.00 179.25 178.86 2kr1 h ALA 5 N 0.50 1.44 -0.18 0.00 0.00 -1.98 -0.21 119.26 118.84 2kr1 h ALA 5 Ca 0.04 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.64 2kr1 h ALA 5 Cb 0.39 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 2kr1 h ALA 5 CO -0.14 0.40 -0.03 0.00 0.00 0.00 0.00 179.25 179.49 2kr1 h ALA 6 N 1.63 0.24 0.00 0.00 0.00 -1.79 -1.57 119.26 117.77 2kr1 h ALA 6 Ca 0.02 -0.23 -0.08 0.00 0.00 0.00 0.00 54.91 54.61 2kr1 h ALA 6 Cb 0.52 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2kr1 h ALA 6 CO 0.04 -0.01 -0.40 0.87 0.00 0.00 0.00 179.25 179.75 2kr1 h LYS 7 N 0.05 0.00 -0.26 0.00 1.79 -0.88 -1.26 116.57 116.02 2kr1 h LYS 7 Ca 0.05 0.00 -0.16 0.00 -2.18 0.00 0.00 60.65 58.35 2kr1 h LYS 7 Cb 0.45 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.10 2kr1 h LYS 7 CO 0.01 0.40 -0.49 0.45 -1.08 0.00 0.00 179.45 178.74 2kr1 h HIS 8 N 0.00 0.87 -0.13 -1.35 3.86 -0.96 -0.35 115.15 117.09 2kr1 h HIS 8 Ca -0.00 -0.29 -0.17 0.00 -1.16 0.00 0.00 60.37 58.75 2kr1 h HIS 8 Cb 0.89 -0.17 -0.01 0.00 1.06 0.00 0.00 27.41 29.18 2kr1 h HIS 8 CO 0.00 1.05 -0.61 1.25 0.86 0.00 0.00 177.93 180.48 2kr1 h LEU 9 N 0.55 0.52 -0.69 2.43 7.12 -0.95 0.13 115.31 124.43 2kr1 h LEU 9 Ca 0.03 -0.30 -0.06 0.00 0.13 0.00 0.00 57.88 57.67 2kr1 h LEU 9 Cb 1.05 -0.15 -0.03 0.00 -0.53 0.00 0.00 40.66 41.00 2kr1 h LEU 9 CO 0.10 1.01 0.19 0.40 -0.13 0.00 0.00 178.44 180.01 2kr1 h ILE 10 N 0.34 1.26 -0.03 4.05 2.04 -1.22 -2.66 117.51 121.29 2kr1 h ILE 10 Ca -0.01 -0.93 -0.07 0.00 1.00 0.00 0.00 64.86 64.85 2kr1 h ILE 10 Cb 1.16 0.55 -0.01 0.00 -0.74 0.00 0.00 36.82 37.78 2kr1 h ILE 10 CO 0.11 0.36 -0.30 -0.08 0.00 0.00 0.00 178.15 178.23 2kr1 h GLU 11 N 1.03 0.05 -0.09 2.37 4.57 -0.71 0.71 114.58 122.51 2kr1 h GLU 11 Ca 0.22 -0.02 -0.01 0.00 -1.18 0.00 0.00 59.36 58.38 2kr1 h GLU 11 Cb 0.34 -0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.93 2kr1 h GLU 11 CO -0.00 0.36 0.03 0.00 -1.18 0.00 0.00 179.01 178.22 2kr1 h ARG 12 N 0.05 0.13 -0.02 1.92 2.47 -0.68 -1.04 114.38 117.21 2kr1 h ARG 12 Ca 0.01 -0.03 -0.18 0.00 -1.26 0.00 0.00 59.98 58.52 2kr1 h ARG 12 Cb 0.57 -0.02 -0.01 0.00 -1.65 0.00 0.00 29.97 28.85 2kr1 h ARG 12 CO 0.04 0.26 -0.78 1.88 0.56 0.00 0.00 179.97 181.94 2kr1 h TYR 13 N -0.02 0.28 -0.02 3.04 0.05 -1.24 -1.80 116.97 117.26 2kr1 h TYR 13 Ca 0.03 -0.13 -0.03 0.00 0.05 0.00 0.00 58.73 58.65 2kr1 h TYR 13 Cb 0.18 -0.04 0.00 0.00 1.01 0.00 0.00 36.73 37.88 2kr1 h TYR 13 CO -0.01 0.89 -0.10 -0.92 -1.05 0.00 0.00 178.16 176.97 2kr1 h TYR 14 N 0.12 0.13 0.00 4.88 3.20 -0.86 -2.28 116.97 122.17 2kr1 h TYR 14 Ca -0.03 -0.06 -0.03 0.00 3.14 0.00 0.00 58.73 61.75 2kr1 h TYR 14 Cb 1.36 -0.02 -0.00 0.00 1.54 0.00 0.00 36.73 39.60 2kr1 h TYR 14 CO 0.02 0.76 -0.16 1.25 -1.64 0.00 0.00 178.16 178.39 2kr1 h HIS 15 N -0.54 0.00 -0.39 -3.82 2.76 -1.29 -1.35 115.15 110.52 2kr1 h HIS 15 Ca -0.01 0.00 -0.08 0.00 -2.20 0.00 0.00 60.37 58.08 2kr1 h HIS 15 Cb 0.77 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.72 2kr1 h HIS 15 CO 0.16 0.16 -0.10 0.37 -1.30 0.00 0.00 177.93 177.21 2kr1 h GLN 16 N 0.00 0.69 0.00 5.26 4.15 -1.23 0.06 115.11 124.03 2kr1 h GLN 16 Ca -0.00 -0.22 -0.12 0.00 0.77 0.00 0.00 58.65 59.08 2kr1 h GLN 16 Cb 0.54 -0.06 -0.02 0.00 0.21 0.00 0.00 27.48 28.14 2kr1 h GLN 16 CO 0.02 0.78 -0.77 -0.07 -1.93 0.00 0.00 178.83 176.86 2kr1 h LEU 17 N 0.63 0.00 0.00 -2.39 3.38 -0.68 0.89 115.31 117.14 2kr1 h LEU 17 Ca 0.11 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.01 2kr1 h LEU 17 Cb 0.55 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 2kr1 h LEU 17 CO 0.03 0.53 -0.54 0.71 0.09 0.00 0.00 178.44 179.26 2kr1 h THR 18 N 0.00 0.68 0.00 0.22 1.35 -1.29 -3.40 112.91 110.47 2kr1 h THR 18 Ca -0.05 -1.67 0.00 0.00 -0.55 0.00 0.00 66.41 64.15 2kr1 h THR 18 Cb 1.44 1.44 0.00 0.00 -1.73 0.00 0.00 68.15 69.30 2kr1 h THR 18 CO 0.06 0.23 -0.97 -0.62 -0.25 0.00 0.00 175.52 173.97 2kr1 n GLU 19 N -4.59 2.73 0.00 4.72 1.02 -0.82 -4.84 120.64 118.86 2kr1 n GLU 19 Ca -0.14 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.00 2kr1 n GLU 19 Cb 0.39 -0.98 0.00 0.00 -0.02 0.00 0.00 31.44 30.83 2kr1 n GLU 19 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2kr1 n GLY 20 N 2.76 1.24 0.10 0.62 0.00 -0.06 -3.30 105.19 106.56 2kr1 n GLY 20 Ca 0.00 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.32 2kr1 n GLY 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2kr1 n GLY 22 N -0.08 1.79 3.71 0.00 0.00 -1.21 -4.62 105.19 104.78 2kr1 n GLY 22 Ca 0.00 -0.16 -0.42 0.00 0.00 0.00 0.00 46.02 45.44 2kr1 n GLY 22 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2kr1 s ASN 23 N 0.00 6.40 0.45 1.61 4.22 -1.26 -4.87 114.94 121.49 2kr1 s ASN 23 Ca 0.00 2.83 0.24 0.00 -2.14 0.00 0.00 52.86 53.79 2kr1 s ASN 23 Cb 0.00 -2.59 0.45 0.00 1.28 0.00 0.00 41.25 40.39 2kr1 s ASN 23 CO 0.00 -0.98 1.65 1.05 -2.04 0.00 0.00 177.10 176.78 2kr1 h GLU 24 N 7.39 0.00 -4.38 3.55 4.11 -1.94 -3.36 114.58 119.96 2kr1 h GLU 24 Ca -0.44 0.00 -0.71 0.00 0.07 0.00 0.00 59.36 58.28 2kr1 h GLU 24 Cb 1.21 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.40 2kr1 h GLU 24 CO 0.95 0.01 2.86 0.00 0.07 0.00 0.00 179.01 182.91 2kr1 n ALA 25 N -2.10 5.10 -3.60 1.06 0.00 -1.26 -4.35 120.51 115.36 2kr1 n ALA 25 Ca 0.04 -3.90 -0.17 0.00 0.00 0.00 0.00 53.44 49.41 2kr1 n ALA 25 Cb 0.51 -3.52 -0.14 0.00 0.00 0.00 0.00 19.45 16.30 2kr1 n ALA 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2kr1 h THR 27 N 6.33 0.00 -2.62 0.00 1.03 -1.95 -3.42 112.91 112.27 2kr1 h THR 27 Ca -0.15 -0.76 -0.58 0.00 -0.01 0.00 0.00 66.41 64.91 2kr1 h THR 27 Cb 1.13 1.76 -0.03 0.00 -1.07 0.00 0.00 68.15 69.94 2kr1 h THR 27 CO 0.19 0.00 1.28 0.21 -0.01 0.00 0.00 175.52 177.20 2kr1 s ASN 28 N -5.93 5.89 0.16 0.00 3.84 -1.26 -4.88 114.94 112.77 2kr1 s ASN 28 Ca 0.04 1.38 0.25 0.00 0.21 0.00 0.00 52.86 54.74 2kr1 s ASN 28 Cb 0.07 -2.52 0.92 0.00 -0.55 0.00 0.00 41.25 39.16 2kr1 s ASN 28 CO 0.61 -1.70 1.76 -1.84 -2.79 0.00 0.00 177.10 173.14 2kr1 n GLU 29 N 8.41 0.17 -0.51 0.43 0.00 -1.26 -2.63 120.64 125.25 2kr1 n GLU 29 Ca 0.23 0.23 0.04 0.00 0.00 0.00 0.00 57.16 57.66 2kr1 n GLU 29 Cb 0.46 -1.74 0.23 0.00 0.00 0.00 0.00 31.44 30.40 2kr1 n GLU 29 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.13 178.32 2kr1 n PHE 30 N -2.04 1.18 -4.04 -1.84 3.72 -1.26 -4.29 117.46 108.88 2kr1 n PHE 30 Ca 0.05 -0.41 -0.26 0.00 -0.05 0.00 0.00 57.45 56.78 2kr1 n PHE 30 Cb 0.34 -0.33 -0.17 0.00 -0.94 0.00 0.00 39.48 38.38 2kr1 n PHE 30 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2kr1 s ALA 32 N 1.48 1.99 0.00 0.00 0.00 0.29 -3.05 121.76 122.47 2kr1 s ALA 32 Ca 0.00 0.46 0.00 0.00 0.00 0.00 0.00 51.96 52.43 2kr1 s ALA 32 Cb -0.13 -3.36 0.00 0.00 0.00 0.00 0.00 23.12 19.63 2kr1 s ALA 32 CO -0.05 -2.08 0.00 0.43 0.00 0.00 0.00 175.76 174.06 2kr1 n SER 33 N -3.59 -1.21 -4.81 0.00 7.64 -1.25 -3.76 113.62 106.63 2kr1 n SER 33 Ca 0.11 0.00 -0.38 0.00 1.01 0.00 0.00 58.87 59.61 2kr1 n SER 33 Cb 0.52 -1.38 -0.06 0.00 -1.01 0.00 0.00 64.21 62.28 2kr1 n SER 33 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2kr1 n PRO 35 N 1.34 0.28 -0.00 0.00 -0.04 -1.26 -2.09 135.00 133.23 2kr1 n PRO 35 Ca -0.07 0.10 0.11 0.00 -0.04 0.00 0.00 63.50 63.59 2kr1 n PRO 35 Cb 0.51 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.33 2kr1 n PRO 35 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 2kr1 n THR 36 N -1.28 0.02 -2.53 0.52 -2.24 -1.26 -4.99 114.28 102.53 2kr1 n THR 36 Ca 0.09 -0.30 -0.40 0.00 -2.27 0.00 0.00 64.05 61.17 2kr1 n THR 36 Cb 0.15 0.37 -0.05 0.00 -2.10 0.00 0.00 70.33 68.71 2kr1 n THR 36 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 2kr1 s PHE 37 N -3.30 3.65 -0.01 4.78 5.36 -0.89 -4.96 117.98 122.60 2kr1 s PHE 37 Ca -0.01 1.74 0.03 0.00 -0.96 0.00 0.00 56.93 57.73 2kr1 s PHE 37 Cb 0.15 -3.22 -0.03 0.00 -0.34 0.00 0.00 43.02 39.57 2kr1 s PHE 37 CO 0.88 -0.36 -0.09 -0.51 -1.46 0.00 0.00 175.22 173.68 2kr1 s LEU 38 N -1.43 3.04 0.64 6.12 1.43 -1.26 -4.93 118.68 122.29 2kr1 s LEU 38 Ca 0.44 -0.16 -0.17 0.00 -1.03 0.00 0.00 54.13 53.21 2kr1 s LEU 38 Cb -0.31 -1.72 -0.01 0.00 0.03 0.00 0.00 46.19 44.18 2kr1 s LEU 38 CO 0.39 0.30 1.22 -0.13 0.23 0.00 0.00 176.35 178.37 2kr1 s ARG 39 N -1.20 2.66 0.04 1.70 1.81 -1.26 -5.06 118.95 117.64 2kr1 s ARG 39 Ca 0.15 1.84 -0.02 0.00 -1.72 0.00 0.00 55.73 55.98 2kr1 s ARG 39 Cb -0.11 -1.89 -0.03 0.00 -0.45 0.00 0.00 34.95 32.48 2kr1 s ARG 39 CO 0.05 -1.45 0.01 0.00 -0.68 0.00 0.00 175.30 173.23 2kr1 s MET 40 N -3.52 0.55 0.86 3.54 0.23 -1.26 -5.14 119.30 114.55 2kr1 s MET 40 Ca 0.77 -0.95 -0.11 0.00 -1.03 0.00 0.00 55.69 54.38 2kr1 s MET 40 Cb -0.31 0.20 0.11 0.00 -1.53 0.00 0.00 34.83 33.29 2kr1 s MET 40 CO 0.38 -0.11 1.09 0.34 -2.03 0.00 0.00 175.02 174.69 2kr1 s ASP 41 N -2.38 3.73 0.18 -1.18 2.15 -1.26 -4.77 116.67 113.14 2kr1 s ASP 41 Ca -0.01 1.69 -0.16 0.00 0.43 0.00 0.00 52.55 54.50 2kr1 s ASP 41 Cb 0.01 -2.36 0.13 0.00 -0.30 0.00 0.00 42.92 40.41 2kr1 s ASP 41 CO -0.07 -2.50 1.66 -1.13 -0.17 0.00 0.00 175.17 172.96 2kr1 h ASN 42 N -1.45 -0.38 -0.05 -0.34 -1.24 -2.02 0.64 115.58 110.74 2kr1 h ASN 42 Ca -0.47 0.13 -0.19 0.00 0.71 0.00 0.00 56.30 56.48 2kr1 h ASN 42 Cb 1.26 0.26 0.00 0.00 0.73 0.00 0.00 38.32 40.58 2kr1 h ASN 42 CO 0.52 -0.13 -0.65 0.78 -1.29 0.00 0.00 177.43 176.65 2kr1 h ASN 43 N 0.02 0.77 0.01 1.15 2.35 -1.99 -1.95 115.58 115.94 2kr1 h ASN 43 Ca 0.22 -0.46 -0.07 0.00 -0.55 0.00 0.00 56.30 55.44 2kr1 h ASN 43 Cb 0.33 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.46 2kr1 h ASN 43 CO -0.45 1.22 -0.20 0.00 -1.65 0.00 0.00 177.43 176.35 2kr1 h ALA 44 N 0.78 1.29 -0.05 -0.83 0.00 -1.85 -1.45 119.26 117.15 2kr1 h ALA 44 Ca -0.01 -0.29 -0.21 0.00 0.00 0.00 0.00 54.91 54.40 2kr1 h ALA 44 Cb 1.24 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.92 2kr1 h ALA 44 CO 0.13 0.47 -0.84 0.00 0.00 0.00 0.00 179.25 179.02 2kr1 h ALA 45 N 1.47 0.44 -0.50 0.00 0.00 -0.81 -1.86 119.26 118.00 2kr1 h ALA 45 Ca 0.05 -0.65 -0.06 0.00 0.00 0.00 0.00 54.91 54.25 2kr1 h ALA 45 Cb 0.54 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 2kr1 h ALA 45 CO 0.04 0.77 0.06 0.00 0.00 0.00 0.00 179.25 180.12 2kr1 h ALA 46 N 0.78 0.67 0.34 0.00 0.00 -1.04 -0.46 119.26 119.55 2kr1 h ALA 46 Ca -0.06 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.59 2kr1 h ALA 46 Cb 1.45 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2kr1 h ALA 46 CO 0.15 0.42 -0.16 0.82 0.00 0.00 0.00 179.25 180.48 2kr1 h ILE 47 N 0.72 0.67 0.00 0.00 1.08 -1.30 -2.84 117.51 115.84 2kr1 h ILE 47 Ca 0.15 -0.41 -0.04 0.00 -0.39 0.00 0.00 64.86 64.18 2kr1 h ILE 47 Cb 0.42 0.88 -0.01 0.00 -3.07 0.00 0.00 36.82 35.05 2kr1 h ILE 47 CO 0.01 0.08 -0.17 0.50 -0.69 0.00 0.00 178.15 177.88 2kr1 h LYS 48 N -0.69 0.00 -0.12 2.37 1.63 -1.34 -0.41 116.57 118.02 2kr1 h LYS 48 Ca -0.05 0.00 -0.01 0.00 -0.85 0.00 0.00 60.65 59.75 2kr1 h LYS 48 Cb 0.48 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.11 2kr1 h LYS 48 CO 0.08 0.17 0.04 0.00 -3.45 0.00 0.00 179.45 176.29 2kr1 h ALA 49 N 1.83 0.15 0.00 5.00 0.00 -1.07 -0.98 119.26 124.20 2kr1 h ALA 49 Ca -0.00 -0.10 -0.08 0.00 0.00 0.00 0.00 54.91 54.73 2kr1 h ALA 49 Cb 0.31 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2kr1 h ALA 49 CO 0.02 -0.26 -0.38 -0.07 0.00 0.00 0.00 179.25 178.57 2kr1 h LEU 50 N 0.03 0.00 -0.01 0.00 -0.00 -1.13 -0.67 115.31 113.53 2kr1 h LEU 50 Ca 0.04 0.00 -0.00 0.00 -0.00 0.00 0.00 57.88 57.92 2kr1 h LEU 50 Cb 0.18 0.00 -0.00 0.00 -0.00 0.00 0.00 40.66 40.84 2kr1 h LEU 50 CO -0.00 0.38 -0.00 -0.33 -0.00 0.00 0.00 178.44 178.49 2kr1 h GLU 51 N 0.00 0.01 0.00 1.13 4.39 -0.89 -1.39 114.58 117.84 2kr1 h GLU 51 Ca -0.00 -0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.65 2kr1 h GLU 51 Cb 0.73 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.37 2kr1 h GLU 51 CO 0.05 0.35 -0.21 -0.07 -1.16 0.00 0.00 179.01 177.97 2kr1 h LEU 52 N -0.33 0.00 -0.00 1.33 3.38 -1.05 -2.46 115.31 116.17 2kr1 h LEU 52 Ca 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 2kr1 h LEU 52 Cb 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 2kr1 h LEU 52 CO 0.00 0.21 -0.01 0.22 0.09 0.00 0.00 178.44 178.95 2kr1 h TYR 53 N 0.00 0.01 -0.30 1.13 3.20 -1.04 -0.73 116.97 119.24 2kr1 h TYR 53 Ca -0.00 -0.01 -0.15 0.00 3.14 0.00 0.00 58.73 61.72 2kr1 h TYR 53 Cb 0.49 -0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.75 2kr1 h TYR 53 CO 0.00 0.65 -0.41 1.57 -1.64 0.00 0.00 178.16 178.33 2kr1 h LYS 54 N -0.63 0.73 0.00 1.82 2.10 -1.13 -2.73 116.57 116.74 2kr1 h LYS 54 Ca -0.00 -0.38 0.00 0.00 -2.00 0.00 0.00 60.65 58.26 2kr1 h LYS 54 Cb 0.65 0.01 0.00 0.00 -0.90 0.00 0.00 32.23 31.99 2kr1 h LYS 54 CO 0.00 1.00 -0.04 -0.84 -2.00 0.00 0.00 179.45 177.57 2kr1 h ILE 55 N 0.60 0.00 -5.47 0.07 3.07 -1.59 -3.49 117.51 110.71 2kr1 h ILE 55 Ca 0.05 -0.83 -0.04 0.00 1.55 0.00 0.00 64.86 65.59 2kr1 h ILE 55 Cb 0.95 1.81 0.01 0.00 -0.27 0.00 0.00 36.82 39.31 2kr1 h ILE 55 CO 0.09 0.00 -0.10 0.59 -1.05 0.00 0.00 178.15 177.68 2kr1 n ASN 56 N -2.81 -7.58 -3.03 2.16 3.02 -0.91 -5.04 115.26 101.08 2kr1 n ASN 56 Ca 0.04 -0.15 -0.16 0.00 -0.03 0.00 0.00 54.58 54.29 2kr1 n ASN 56 Cb 0.50 -5.07 0.12 0.00 -0.61 0.00 0.00 39.78 34.72 2kr1 n ASN 56 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2kr1 n ALA 57 N -1.87 -1.08 -1.79 5.41 0.00 -0.33 -4.94 120.51 115.92 2kr1 n ALA 57 Ca -0.02 -0.91 -0.30 0.00 0.00 0.00 0.00 53.44 52.21 2kr1 n ALA 57 Cb 0.52 -0.05 -0.04 0.00 0.00 0.00 0.00 19.45 19.87 2kr1 n ALA 57 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 2kr1 s LYS 58 N -4.50 2.21 -0.22 0.00 -2.85 -1.26 -4.96 119.74 108.17 2kr1 s LYS 58 Ca 0.40 0.65 -0.26 0.00 -1.00 0.00 0.00 55.97 55.76 2kr1 s LYS 58 Cb -0.02 -4.67 -0.00 0.00 -2.06 0.00 0.00 37.83 31.08 2kr1 s LYS 58 CO 0.28 -3.42 0.88 -1.17 0.10 0.00 0.00 175.35 172.02 2kr1 s LEU 59 N 11.55 4.11 -0.11 2.77 2.96 -1.26 -4.99 118.68 133.70 2kr1 s LEU 59 Ca 0.83 1.16 -0.27 0.00 -0.22 0.00 0.00 54.13 55.63 2kr1 s LEU 59 Cb -0.13 -3.28 -0.02 0.00 0.50 0.00 0.00 46.19 43.26 2kr1 s LEU 59 CO 0.15 -0.52 0.87 0.00 -1.32 0.00 0.00 176.35 175.53 2kr1 s ASP 61 N 1.06 6.32 0.37 0.00 1.11 -1.26 -5.00 116.67 119.27 2kr1 s ASP 61 Ca 0.42 1.99 -0.28 0.00 0.18 0.00 0.00 52.55 54.86 2kr1 s ASP 61 Cb -0.18 -2.57 -0.11 0.00 1.07 0.00 0.00 42.92 41.14 2kr1 s ASP 61 CO 0.17 -0.80 1.46 -2.84 1.18 0.00 0.00 175.17 174.34 2kr1 s PRO 62 N -3.11 4.13 -0.15 8.23 0.02 -1.26 -4.91 135.00 137.96 2kr1 s PRO 62 Ca 0.66 2.52 -0.29 0.00 0.02 0.00 0.00 61.00 63.91 2kr1 s PRO 62 Cb -0.18 -2.98 -0.02 0.00 0.02 0.00 0.00 34.50 31.34 2kr1 s PRO 62 CO 0.22 -0.49 1.33 -3.38 -0.33 0.00 0.00 177.00 174.35 2kr1 s HIS 63 N -1.13 2.70 -2.40 6.54 -3.43 -1.26 -5.18 115.29 111.12 2kr1 s HIS 63 Ca 0.52 0.87 0.29 0.00 -0.80 0.00 0.00 55.06 55.94 2kr1 s HIS 63 Cb -0.45 -3.57 1.21 0.00 -1.43 0.00 0.00 32.58 28.34 2kr1 s HIS 63 CO 0.62 -2.07 1.84 -0.35 -2.00 0.00 0.00 174.74 172.77