#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k4f s SER 2 N 0.00 -0.39 -0.14 0.00 0.15 -1.26 -4.80 113.70 107.26 2k4f s SER 2 Ca 0.00 -0.36 0.09 0.00 0.70 0.00 0.00 55.95 56.38 2k4f s SER 2 Cb 0.00 0.67 0.51 0.00 -1.71 0.00 0.00 66.02 65.49 2k4f s SER 2 CO 0.00 -1.19 1.29 2.29 1.20 0.00 0.00 173.24 176.83 2k4f n LYS 3 N -0.42 3.37 0.00 5.44 2.85 -1.23 -4.60 118.16 123.56 2k4f n LYS 3 Ca -0.09 -1.96 0.00 0.00 -1.05 0.00 0.00 58.31 55.20 2k4f n LYS 3 Cb 0.62 -1.94 0.00 0.00 -0.65 0.00 0.00 35.03 33.05 2k4f n LYS 3 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 2k4f n ASN 4 N 0.43 0.00 -0.19 -5.58 4.13 -1.26 -4.47 115.26 108.31 2k4f n ASN 4 Ca 0.17 0.00 -0.09 0.00 1.68 0.00 0.00 54.58 56.34 2k4f n ASN 4 Cb 0.82 0.00 0.02 0.00 -1.54 0.00 0.00 39.78 39.07 2k4f n ASN 4 CO 0.00 0.00 0.00 0.03 0.28 0.00 0.00 177.26 177.57 2k4f h ARG 5 N 0.00 0.93 -3.26 3.52 2.47 -1.91 -3.39 114.38 112.74 2k4f h ARG 5 Ca 0.00 -0.27 -0.24 0.00 -1.26 0.00 0.00 59.98 58.21 2k4f h ARG 5 Cb 0.00 -0.10 -0.32 0.00 -1.65 0.00 0.00 29.97 27.90 2k4f h ARG 5 CO 0.00 0.91 -0.60 0.15 0.56 0.00 0.00 179.97 180.99 2k4f s LYS 6 N -5.13 0.09 -0.74 0.04 1.02 -1.26 -4.14 119.74 109.61 2k4f s LYS 6 Ca -0.12 0.37 0.04 0.00 0.02 0.00 0.00 55.97 56.27 2k4f s LYS 6 Cb 0.12 -0.18 0.27 0.00 -0.52 0.00 0.00 37.83 37.52 2k4f s LYS 6 CO 0.83 -0.17 0.93 0.00 -0.92 0.00 0.00 175.35 176.02 2k4f n ALA 7 N 4.21 4.36 -2.47 5.17 0.00 -1.26 -3.58 120.51 126.95 2k4f n ALA 7 Ca -0.27 -4.79 -0.00 0.00 0.00 0.00 0.00 53.44 48.39 2k4f n ALA 7 Cb 0.52 -1.25 0.02 0.00 0.00 0.00 0.00 19.45 18.74 2k4f n ALA 7 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2k4f n LYS 8 N 0.94 0.50 -4.46 0.00 0.00 -1.26 -5.10 118.16 108.77 2k4f n LYS 8 Ca 0.29 -1.98 -0.28 0.00 0.00 0.00 0.00 58.31 56.34 2k4f n LYS 8 Cb 0.39 -0.16 -0.13 0.00 0.00 0.00 0.00 35.03 35.13 2k4f n LYS 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2k4f s ALA 9 N -0.76 2.21 -0.37 3.14 0.00 -1.26 -5.05 121.76 119.68 2k4f s ALA 9 Ca 0.22 -1.37 0.10 0.00 0.00 0.00 0.00 51.96 50.90 2k4f s ALA 9 Cb 0.29 -0.37 0.37 0.00 0.00 0.00 0.00 23.12 23.41 2k4f s ALA 9 CO -0.10 0.50 1.39 1.17 0.00 0.00 0.00 175.76 178.72 2k4f n LYS 10 N 1.13 1.18 -1.77 0.00 4.81 -1.26 -4.96 118.16 117.29 2k4f n LYS 10 Ca -0.18 -1.51 -0.42 0.00 -0.87 0.00 0.00 58.31 55.33 2k4f n LYS 10 Cb 0.53 0.13 -0.03 0.00 0.02 0.00 0.00 35.03 35.67 2k4f n LYS 10 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 2k4f s PRO 11 N 0.16 4.15 -0.11 1.64 0.04 -1.26 -4.93 135.00 134.69 2k4f s PRO 11 Ca 0.16 2.55 -0.21 0.00 0.04 0.00 0.00 61.00 63.54 2k4f s PRO 11 Cb 0.39 -3.20 -0.27 0.00 0.04 0.00 0.00 34.50 31.47 2k4f s PRO 11 CO -0.10 -0.74 0.65 0.28 0.04 0.00 0.00 177.00 177.13 2k4f h VAL 12 N 4.03 1.31 0.00 -0.36 2.07 -2.00 -2.72 116.25 118.58 2k4f h VAL 12 Ca -0.43 -2.40 0.00 0.00 0.82 0.00 0.00 66.70 64.69 2k4f h VAL 12 Cb 1.20 2.93 0.00 0.00 -1.52 0.00 0.00 31.29 33.90 2k4f h VAL 12 CO 0.95 0.63 -0.51 0.41 0.02 0.00 0.00 177.57 179.07 2k4f n THR 13 N -4.19 0.25 -2.06 2.57 -1.04 -1.26 -3.96 114.28 104.58 2k4f n THR 13 Ca -0.20 -0.18 -0.09 0.00 -2.04 0.00 0.00 64.05 61.54 2k4f n THR 13 Cb 0.76 -0.08 0.08 0.00 -1.82 0.00 0.00 70.33 69.27 2k4f n THR 13 CO 0.00 0.00 0.00 -1.14 -0.64 0.00 0.00 175.07 173.29 2k4f n ARG 14 N -1.91 2.38 -1.19 -2.82 0.63 -1.26 -5.04 116.66 107.46 2k4f n ARG 14 Ca 0.04 -3.61 -0.23 0.00 -0.92 0.00 0.00 57.85 53.14 2k4f n ARG 14 Cb 0.40 -1.76 -0.16 0.00 0.45 0.00 0.00 32.46 31.39 2k4f n ARG 14 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2k4f n GLY 15 N -0.70 -0.39 0.47 5.14 0.00 -1.03 -4.62 105.19 104.07 2k4f n GLY 15 Ca 0.27 0.34 0.37 0.00 0.00 0.00 0.00 46.02 47.00 2k4f n GLY 15 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2k4f n THR 16 N 4.96 -0.08 0.00 2.61 5.66 -1.26 -4.80 114.28 121.37 2k4f n THR 16 Ca 0.53 1.23 0.00 0.00 -3.05 0.00 0.00 64.05 62.76 2k4f n THR 16 Cb 0.08 -2.03 0.00 0.00 -1.55 0.00 0.00 70.33 66.82 2k4f n THR 16 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2k4f n GLY 17 N -1.58 1.74 2.80 1.09 0.00 -1.26 -4.81 105.19 103.18 2k4f n GLY 17 Ca 0.33 -1.34 -0.32 0.00 0.00 0.00 0.00 46.02 44.68 2k4f n GLY 17 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k4f n ALA 18 N 2.86 4.28 -2.69 4.61 0.00 -1.26 -4.64 120.51 123.67 2k4f n ALA 18 Ca 0.00 -2.66 -0.35 0.00 0.00 0.00 0.00 53.44 50.43 2k4f n ALA 18 Cb 0.00 -3.29 -0.00 0.00 0.00 0.00 0.00 19.45 16.16 2k4f n ALA 18 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k4f n GLY 19 N 4.08 5.90 2.69 0.00 0.00 -1.26 -4.61 105.19 111.99 2k4f n GLY 19 Ca 0.48 -2.66 -0.06 0.00 0.00 0.00 0.00 46.02 43.78 2k4f n GLY 19 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2k4f n SER 20 N -0.19 -1.70 -4.87 1.61 7.64 -1.26 -5.00 113.62 109.84 2k4f n SER 20 Ca 0.41 -2.40 -0.28 0.00 1.01 0.00 0.00 58.87 57.62 2k4f n SER 20 Cb 0.33 1.20 -0.02 0.00 -1.01 0.00 0.00 64.21 64.70 2k4f n SER 20 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2k4f s ARG 21 N 0.15 2.24 0.60 1.43 0.52 -1.26 -4.63 118.95 118.01 2k4f s ARG 21 Ca 0.17 -2.11 0.32 0.00 -0.52 0.00 0.00 55.73 53.59 2k4f s ARG 21 Cb 0.28 -1.97 1.92 0.00 0.52 0.00 0.00 34.95 35.69 2k4f s ARG 21 CO -0.07 -0.57 2.26 -1.35 0.02 0.00 0.00 175.30 175.59 2k4f h PRO 22 N 0.87 0.00 -5.11 3.54 0.11 -2.00 -3.40 132.00 126.01 2k4f h PRO 22 Ca -0.38 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 65.69 2k4f h PRO 22 Cb 1.31 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.40 2k4f h PRO 22 CO 0.61 0.00 0.45 0.54 -0.21 0.00 0.00 178.00 179.39 2k4f n ARG 23 N -3.71 0.16 0.00 1.05 1.74 -1.26 -2.49 116.66 112.15 2k4f n ARG 23 Ca -0.03 -0.95 0.00 0.00 -0.77 0.00 0.00 57.85 56.11 2k4f n ARG 23 Cb 0.10 -2.90 0.00 0.00 -1.02 0.00 0.00 32.46 28.64 2k4f n ARG 23 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2k4f n GLY 24 N 5.84 -1.29 3.51 -0.13 0.00 -1.26 -5.04 105.19 106.81 2k4f n GLY 24 Ca 0.36 0.50 -0.35 0.00 0.00 0.00 0.00 46.02 46.53 2k4f n GLY 24 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k4f n GLN 25 N 0.00 2.23 -0.74 1.61 0.00 -1.04 -4.64 117.38 114.80 2k4f n GLN 25 Ca 0.00 -2.73 0.07 0.00 0.00 0.00 0.00 57.00 54.34 2k4f n GLN 25 Cb 0.00 -3.57 0.36 0.00 0.00 0.00 0.00 30.24 27.03 2k4f n GLN 25 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.06 175.35 2k4f n ASN 26 N 11.34 5.04 -0.00 2.61 4.05 -1.26 -4.10 115.26 132.94 2k4f n ASN 26 Ca 0.47 -2.70 0.10 0.00 0.45 0.00 0.00 54.58 52.90 2k4f n ASN 26 Cb 0.46 -0.63 -0.13 0.00 1.23 0.00 0.00 39.78 40.70 2k4f n ASN 26 CO 0.00 0.00 0.00 1.17 -3.05 0.00 0.00 177.26 175.38 2k4f n LYS 27 N 0.73 0.18 -3.01 1.20 4.81 -1.26 -5.04 118.16 115.76 2k4f n LYS 27 Ca 0.25 -0.05 -0.15 0.00 -0.87 0.00 0.00 58.31 57.49 2k4f n LYS 27 Cb 1.02 -1.51 0.02 0.00 0.02 0.00 0.00 35.03 34.58 2k4f n LYS 27 CO 0.00 0.00 0.00 0.39 1.17 0.00 0.00 177.40 178.96 2k4f n GLU 28 N -1.70 -2.25 0.15 1.64 1.02 -1.26 -4.95 120.64 113.29 2k4f n GLU 28 Ca 0.02 1.94 0.00 0.00 -0.02 0.00 0.00 57.16 59.10 2k4f n GLU 28 Cb 0.39 -4.83 0.00 0.00 -0.02 0.00 0.00 31.44 26.99 2k4f n GLU 28 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2k4f n ARG 29 N -0.33 0.00 -1.60 3.49 1.74 -1.26 -5.10 116.66 113.61 2k4f n ARG 29 Ca 0.07 0.00 -0.44 0.00 -0.77 0.00 0.00 57.85 56.71 2k4f n ARG 29 Cb 0.52 0.00 -0.04 0.00 -1.02 0.00 0.00 32.46 31.92 2k4f n ARG 29 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 2k4f n PRO 30 N -3.10 2.03 -2.47 5.56 -0.04 -1.26 -4.93 135.00 130.79 2k4f n PRO 30 Ca 0.00 0.61 -0.43 0.00 -0.04 0.00 0.00 63.50 63.64 2k4f n PRO 30 Cb 0.00 -3.09 -0.02 0.00 -0.04 0.00 0.00 33.50 30.35 2k4f n PRO 30 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 2k4f s PRO 31 N 5.93 3.96 0.00 0.54 0.04 -1.26 -5.03 135.00 139.18 2k4f s PRO 31 Ca 1.00 1.22 0.00 0.00 0.04 0.00 0.00 61.00 63.26 2k4f s PRO 31 Cb -0.42 -3.85 0.00 0.00 0.04 0.00 0.00 34.50 30.27 2k4f s PRO 31 CO 0.39 -1.06 0.00 -2.30 0.04 0.00 0.00 177.00 174.06 2k4f n PRO 32 N 7.20 1.59 -3.00 0.56 -0.02 -1.26 -4.87 135.00 135.21 2k4f n PRO 32 Ca 0.14 0.00 -0.05 0.00 -2.02 0.00 0.00 63.50 61.57 2k4f n PRO 32 Cb 0.47 0.00 0.01 0.00 -0.02 0.00 0.00 33.50 33.95 2k4f n PRO 32 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2k4f n VAL 33 N 0.00-10.27 -1.83 -1.45 0.31 -1.26 -4.93 118.33 98.90 2k4f n VAL 33 Ca 0.00 0.26 -0.39 0.00 -0.01 0.00 0.00 64.34 64.20 2k4f n VAL 33 Cb 0.00 -6.92 0.03 0.00 -0.91 0.00 0.00 33.84 26.04 2k4f n VAL 33 CO 0.00 0.00 0.00 -2.84 -1.32 0.00 0.00 176.83 172.67 2k4f s PRO 34 N -2.88 3.33 -0.18 5.55 0.02 -1.26 -4.97 135.00 134.61 2k4f s PRO 34 Ca 0.11 2.24 -0.07 0.00 0.02 0.00 0.00 61.00 63.31 2k4f s PRO 34 Cb -0.03 -2.37 -0.22 0.00 0.02 0.00 0.00 34.50 31.90 2k4f s PRO 34 CO 0.77 -1.04 0.12 0.09 -0.33 0.00 0.00 177.00 176.61 2k4f n ASN 35 N -0.77 2.04 0.07 2.53 3.02 -1.26 -4.16 115.26 116.73 2k4f n ASN 35 Ca 0.09 0.15 0.03 0.00 -0.03 0.00 0.00 54.58 54.82 2k4f n ASN 35 Cb 0.44 -0.75 0.19 0.00 -0.61 0.00 0.00 39.78 39.05 2k4f n ASN 35 CO 0.00 0.00 0.00 -2.65 -2.62 0.00 0.00 177.26 171.99 2k4f n PRO 36 N -3.61 0.05 -0.05 3.52 -0.02 -1.26 0.29 135.00 133.92 2k4f n PRO 36 Ca -0.38 0.47 0.11 0.00 -2.02 0.00 0.00 63.50 61.68 2k4f n PRO 36 Cb 0.97 -1.78 0.45 0.00 -0.02 0.00 0.00 33.50 33.11 2k4f n PRO 36 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 2k4f n ASP 37 N -1.69 1.25 -0.70 2.55 5.68 -1.26 -3.59 116.55 118.79 2k4f n ASP 37 Ca -0.00 -1.60 0.09 0.00 -0.50 0.00 0.00 54.79 52.77 2k4f n ASP 37 Cb 0.15 -0.07 0.27 0.00 -1.14 0.00 0.00 41.12 40.32 2k4f n ASP 37 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2k4f n TYR 38 N 0.03 0.40 -2.46 2.11 9.36 0.15 -4.16 117.16 122.58 2k4f n TYR 38 Ca 0.16 -0.20 -0.22 0.00 3.32 0.00 0.00 57.90 60.96 2k4f n TYR 38 Cb 0.27 0.00 0.01 0.00 -0.63 0.00 0.00 39.34 38.99 2k4f n TYR 38 CO 0.00 0.00 0.00 0.39 0.22 0.00 0.00 176.86 177.47 2k4f n GLU 39 N 0.60 2.97 0.00 2.98 4.71 -1.24 -4.89 120.64 125.77 2k4f n GLU 39 Ca 0.15 -4.19 0.00 0.00 -0.01 0.00 0.00 57.16 53.11 2k4f n GLU 39 Cb 0.36 -2.04 0.00 0.00 -1.01 0.00 0.00 31.44 28.75 2k4f n GLU 39 CO 0.00 0.00 0.00 -0.35 0.09 0.00 0.00 177.13 176.87 2k4f n PRO 40 N -0.44 0.41 -0.22 3.49 -0.04 -1.26 -2.99 135.00 133.95 2k4f n PRO 40 Ca 0.33 0.00 0.11 0.00 -0.04 0.00 0.00 63.50 63.90 2k4f n PRO 40 Cb 0.74 -1.26 0.22 0.00 -0.04 0.00 0.00 33.50 33.16 2k4f n PRO 40 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 2k4f n ILE 41 N 0.58 0.63 -3.74 0.52 -0.00 -1.26 -4.78 119.36 111.31 2k4f n ILE 41 Ca 0.00 -0.82 -0.37 0.00 -0.00 0.00 0.00 62.75 61.57 2k4f n ILE 41 Cb 0.16 0.85 -0.10 0.00 -0.00 0.00 0.00 39.64 40.54 2k4f n ILE 41 CO 0.00 0.00 0.00 -0.60 -0.00 0.00 0.00 176.55 175.95 2k4f s ARG 42 N -1.29 2.28 0.00 0.38 3.00 -1.16 -5.01 118.95 117.15 2k4f s ARG 42 Ca 0.38 -2.13 0.00 0.00 -1.00 0.00 0.00 55.73 52.98 2k4f s ARG 42 Cb 0.21 -3.67 0.00 0.00 0.00 0.00 0.00 34.95 31.49 2k4f s ARG 42 CO 0.29 -1.13 0.00 1.63 0.00 0.00 0.00 175.30 176.10 2k4f n LYS 43 N 4.12 0.00 0.00 5.12 4.76 -1.26 -5.11 118.16 125.79 2k4f n LYS 43 Ca 0.02 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.46 2k4f n LYS 43 Cb 0.40 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.59 2k4f n LYS 43 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2k4f n GLY 44 N -0.70 0.60 3.00 0.72 0.00 -1.26 -5.03 105.19 102.52 2k4f n GLY 44 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 2k4f n GLY 44 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2k4f n GLN 45 N -1.25 -2.08 0.00 1.61 -0.06 -1.26 -4.94 117.38 109.40 2k4f n GLN 45 Ca 0.00 1.87 0.00 0.00 -2.00 0.00 0.00 57.00 56.87 2k4f n GLN 45 Cb 0.00 -5.20 0.00 0.00 -4.06 0.00 0.00 30.24 20.98 2k4f n GLN 45 CO 0.00 0.00 0.00 2.89 -0.20 0.00 0.00 177.06 179.75 2k4f n ARG 46 N -0.69 0.16 -0.03 3.69 0.00 -1.26 -4.87 116.66 113.66 2k4f n ARG 46 Ca 0.06 0.00 0.10 0.00 -0.00 0.00 0.00 57.85 58.00 2k4f n ARG 46 Cb 0.50 -0.08 0.48 0.00 -0.00 0.00 0.00 32.46 33.36 2k4f n ARG 46 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.63 177.23 2k4f n ASP 47 N -0.41 0.69 -0.13 2.89 5.75 -1.26 -3.75 116.55 120.33 2k4f n ASP 47 Ca 0.00 -1.54 -0.02 0.00 -0.01 0.00 0.00 54.79 53.22 2k4f n ASP 47 Cb 0.00 -0.04 0.20 0.00 -1.03 0.00 0.00 41.12 40.25 2k4f n ASP 47 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 2k4f h LEU 48 N 0.93 0.77 -1.88 -2.12 7.12 -2.00 -2.30 115.31 115.82 2k4f h LEU 48 Ca 0.00 -0.13 0.37 0.00 0.13 0.00 0.00 57.88 58.25 2k4f h LEU 48 Cb 0.20 -0.20 -0.06 0.00 -0.53 0.00 0.00 40.66 40.07 2k4f h LEU 48 CO 0.00 0.74 0.90 0.22 -0.13 0.00 0.00 178.44 180.17 2k4f h TYR 49 N 0.81 0.12 -0.67 1.25 5.03 -1.99 0.46 116.97 121.98 2k4f h TYR 49 Ca 0.18 0.00 -0.02 0.00 2.58 0.00 0.00 58.73 61.48 2k4f h TYR 49 Cb 0.26 -0.03 -0.03 0.00 1.55 0.00 0.00 36.73 38.47 2k4f h TYR 49 CO 0.02 -0.00 0.35 1.03 -1.32 0.00 0.00 178.16 178.23 2k4f h SER 50 N 0.06 0.84 0.00 -2.11 0.87 -1.71 -1.31 113.55 110.19 2k4f h SER 50 Ca 0.63 -0.11 0.00 0.00 -1.23 0.00 0.00 61.79 61.08 2k4f h SER 50 Cb 2.36 -0.22 0.00 0.00 -0.44 0.00 0.00 62.40 64.11 2k4f h SER 50 CO -0.07 0.71 0.00 0.61 -0.53 0.00 0.00 176.83 177.55 2k4f n GLY 51 N -1.03 -0.69 0.00 5.77 0.00 0.16 -3.21 105.19 106.19 2k4f n GLY 51 Ca 0.05 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.19 2k4f n GLY 51 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2k4f n LEU 52 N -0.44 0.43 0.14 0.99 -0.00 -0.49 -4.11 117.00 113.51 2k4f n LEU 52 Ca 0.00 0.08 0.02 0.00 -0.00 0.00 0.00 56.01 56.10 2k4f n LEU 52 Cb 0.02 -0.29 0.09 0.00 -0.00 0.00 0.00 43.42 43.25 2k4f n LEU 52 CO 0.00 0.11 0.72 0.59 -0.00 0.00 0.00 177.39 178.81 2k4f n ASN 53 N -1.49 0.09 0.00 1.96 3.02 -1.20 -4.62 115.26 113.02 2k4f n ASN 53 Ca 0.06 0.30 0.00 0.00 -0.03 0.00 0.00 54.58 54.91 2k4f n ASN 53 Cb 0.34 -0.14 0.00 0.00 -0.61 0.00 0.00 39.78 39.36 2k4f n ASN 53 CO 0.00 0.00 0.00 1.67 -2.62 0.00 0.00 177.26 176.31 2k4f n GLN 54 N -1.72 0.00 -0.82 3.52 -0.06 -1.26 -2.01 117.38 115.03 2k4f n GLN 54 Ca -0.00 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.00 2k4f n GLN 54 Cb 0.59 -3.65 0.00 0.00 -4.06 0.00 0.00 30.24 23.11 2k4f n GLN 54 CO 0.00 0.00 0.00 2.89 -0.20 0.00 0.00 177.06 179.75 2k4f n ARG 55 N -1.82 0.00 -0.91 3.69 1.85 -1.26 -4.24 116.66 113.96 2k4f n ARG 55 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 2k4f n ARG 55 Cb 0.00 -2.35 0.00 0.00 -1.05 0.00 0.00 32.46 29.06 2k4f n ARG 55 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2k4f n ALA 56 N 0.47 -1.47 -0.03 2.89 0.00 -0.85 -5.28 120.51 116.24 2k4f n ALA 56 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2k4f n ALA 56 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2k4f n ALA 56 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78