#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 -0.88 -0.04 0.00 0.01 -1.26 -4.81 113.70 106.72 2k4f s SER 2 Ca 0.00 1.40 -0.00 0.00 1.31 0.00 0.00 55.95 58.66 2k4f s SER 2 Cb 0.00 1.50 0.00 0.00 0.21 0.00 0.00 66.02 67.74 2k4f s SER 2 CO 0.00 -0.23 0.01 1.17 0.41 0.00 0.00 173.24 174.60 2k4f n LYS 3 N 4.64 -2.95 -3.63 12.44 4.81 -1.26 -0.11 118.16 132.11 2k4f n LYS 3 Ca -0.18 0.00 -0.25 0.00 -0.87 0.00 0.00 58.31 57.01 2k4f n LYS 3 Cb 0.56 -4.49 0.04 0.00 0.02 0.00 0.00 35.03 31.16 2k4f n LYS 3 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 2k4f n ASN 4 N -1.51 -4.04 0.31 3.14 4.05 -1.26 -4.77 115.26 111.17 2k4f n ASN 4 Ca 0.00 -0.91 0.13 0.00 0.45 0.00 0.00 54.58 54.26 2k4f n ASN 4 Cb 0.50 -3.87 0.72 0.00 1.23 0.00 0.00 39.78 38.36 2k4f n ASN 4 CO 0.00 0.00 0.00 -0.09 -3.05 0.00 0.00 177.26 174.12 2k4f h ARG 5 N -1.74 0.00 -3.68 1.20 2.43 -0.91 -3.46 114.38 108.22 2k4f h ARG 5 Ca -0.64 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.53 2k4f h ARG 5 Cb 1.35 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.90 2k4f h ARG 5 CO 0.51 0.00 -0.17 1.17 -1.51 0.00 0.00 179.97 179.97 2k4f n LYS 6 N -2.73 -0.77 0.00 0.20 3.00 -1.26 -4.41 118.16 112.18 2k4f n LYS 6 Ca -0.02 1.02 0.00 0.00 -0.00 0.00 0.00 58.31 59.31 2k4f n LYS 6 Cb 0.38 -2.71 0.00 0.00 0.00 0.00 0.00 35.03 32.70 2k4f n LYS 6 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2k4f n ALA 7 N -0.35 0.00 0.00 3.14 0.00 -1.26 -3.34 120.51 118.70 2k4f n ALA 7 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 2k4f n ALA 7 Cb 0.12 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.57 2k4f n ALA 7 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 2k4f n LYS 8 N 0.00 0.00 0.00 0.00 2.85 -1.26 -5.00 118.16 114.75 2k4f n LYS 8 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 2k4f n LYS 8 Cb 0.00 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.38 2k4f n LYS 8 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2k4f n ALA 9 N 0.00 -0.37 -0.11 0.58 0.00 -1.21 -4.44 120.51 114.96 2k4f n ALA 9 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 53.44 53.28 2k4f n ALA 9 Cb 0.00 -0.37 -0.13 0.00 0.00 0.00 0.00 19.45 18.95 2k4f n ALA 9 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2k4f n LYS 10 N -0.93 0.67 0.21 0.00 5.02 -1.26 -4.37 118.16 117.49 2k4f n LYS 10 Ca 0.00 0.12 0.11 0.00 -2.02 0.00 0.00 58.31 56.52 2k4f n LYS 10 Cb 0.00 -1.54 0.60 0.00 -0.02 0.00 0.00 35.03 34.07 2k4f n LYS 10 CO 0.00 0.00 0.00 -1.35 -0.52 0.00 0.00 177.40 175.53 2k4f h PRO 11 N 0.00 0.00 0.00 1.97 0.11 -1.98 -3.44 132.00 128.66 2k4f h PRO 11 Ca -0.56 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.55 2k4f h PRO 11 Cb 2.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 33.11 2k4f h PRO 11 CO -0.05 0.00 0.00 0.28 -0.21 0.00 0.00 178.00 178.02 2k4f n VAL 12 N -2.36 0.00 0.16 3.15 0.31 -1.26 -4.09 118.33 114.23 2k4f n VAL 12 Ca -0.01 0.00 0.01 0.00 -0.01 0.00 0.00 64.34 64.32 2k4f n VAL 12 Cb 0.21 0.00 0.27 0.00 -0.91 0.00 0.00 33.84 33.41 2k4f n VAL 12 CO 0.00 0.00 0.00 0.74 -1.32 0.00 0.00 176.83 176.25 2k4f h THR 13 N 0.00 1.34 0.00 2.52 2.02 -1.96 -2.44 112.91 114.39 2k4f h THR 13 Ca 0.00 -1.69 -0.00 0.00 0.77 0.00 0.00 66.41 65.49 2k4f h THR 13 Cb 0.00 1.92 -0.00 0.00 -1.74 0.00 0.00 68.15 68.33 2k4f h THR 13 CO 0.00 0.48 -0.01 -0.09 0.37 0.00 0.00 175.52 176.28 2k4f h ARG 14 N 0.00 0.00 -0.60 6.66 9.65 -1.95 -3.09 114.38 125.05 2k4f h ARG 14 Ca -0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 2k4f h ARG 14 Cb 0.88 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.46 2k4f h ARG 14 CO 0.06 0.01 0.00 0.41 2.80 0.00 0.00 179.97 183.25 2k4f n GLY 15 N 0.73 2.88 1.90 2.80 0.00 -0.94 -4.65 105.19 107.91 2k4f n GLY 15 Ca 0.03 -0.86 -0.08 0.00 0.00 0.00 0.00 46.02 45.11 2k4f n GLY 15 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2k4f n THR 16 N 0.93 2.46 0.00 2.61 -1.04 -1.10 -4.68 114.28 113.46 2k4f n THR 16 Ca 0.25 -1.10 0.00 0.00 -2.04 0.00 0.00 64.05 61.17 2k4f n THR 16 Cb 0.92 -1.81 0.00 0.00 -1.82 0.00 0.00 70.33 67.62 2k4f n THR 16 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2k4f n GLY 17 N 2.25 -2.77 0.95 3.41 0.00 -1.26 -4.95 105.19 102.82 2k4f n GLY 17 Ca 0.28 0.52 0.00 0.00 0.00 0.00 0.00 46.02 46.82 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 -2.81 -1.91 -0.88 4.61 0.00 -1.26 -4.73 120.51 113.53 2k4f n ALA 18 Ca 0.00 0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.71 2k4f n ALA 18 Cb 0.00 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.42 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 -0.73 0.53 0.62 0.00 0.00 -1.26 -4.82 105.19 99.53 2k4f n GLY 19 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.15 2k4f n GLY 19 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2k4f n SER 20 N -0.12 1.92 -3.54 1.61 3.41 -1.26 -4.99 113.62 110.65 2k4f n SER 20 Ca 0.00 -1.64 -0.32 0.00 -0.26 0.00 0.00 58.87 56.64 2k4f n SER 20 Cb 0.06 -0.01 0.01 0.00 -0.26 0.00 0.00 64.21 64.01 2k4f n SER 20 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2k4f n ARG 21 N 0.51 0.00 -0.47 4.33 1.74 -1.26 -4.61 116.66 116.90 2k4f n ARG 21 Ca 0.18 0.00 0.40 0.00 -0.77 0.00 0.00 57.85 57.66 2k4f n ARG 21 Cb 0.42 -0.84 0.61 0.00 -1.02 0.00 0.00 32.46 31.64 2k4f n ARG 21 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 2k4f n PRO 22 N 1.32 0.01 -0.55 5.56 -0.02 -1.26 -4.65 135.00 135.40 2k4f n PRO 22 Ca 0.06 1.00 -0.25 0.00 -2.02 0.00 0.00 63.50 62.28 2k4f n PRO 22 Cb 0.40 -2.38 -0.05 0.00 -0.02 0.00 0.00 33.50 31.45 2k4f n PRO 22 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 2k4f n ARG 23 N -3.51 0.00 0.00 -0.52 0.63 -1.26 -4.16 116.66 107.84 2k4f n ARG 23 Ca 0.33 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.26 2k4f n ARG 23 Cb 1.71 -0.62 0.00 0.00 0.45 0.00 0.00 32.46 34.00 2k4f n ARG 23 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2k4f n GLY 24 N 2.84 0.15 3.47 5.14 0.00 -1.26 -5.06 105.19 110.46 2k4f n GLY 24 Ca 0.21 -1.65 -0.24 0.00 0.00 0.00 0.00 46.02 44.35 2k4f n GLY 24 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2k4f n GLN 25 N 0.00 -1.35 -2.69 1.61 -0.06 -1.26 -4.91 117.38 108.71 2k4f n GLN 25 Ca 0.00 0.74 -0.07 0.00 -2.00 0.00 0.00 57.00 55.67 2k4f n GLN 25 Cb 0.00 -1.79 0.06 0.00 -4.06 0.00 0.00 30.24 24.45 2k4f n GLN 25 CO 0.00 0.00 0.00 -1.71 -0.20 0.00 0.00 177.06 175.15 2k4f n ASN 26 N -1.62 0.38 -0.07 1.69 2.85 -1.26 -4.90 115.26 112.32 2k4f n ASN 26 Ca -0.23 -2.53 -0.04 0.00 -0.11 0.00 0.00 54.58 51.67 2k4f n ASN 26 Cb 0.58 -0.03 -0.16 0.00 1.24 0.00 0.00 39.78 41.40 2k4f n ASN 26 CO 0.00 0.00 0.00 2.29 -2.11 0.00 0.00 177.26 177.44 2k4f n LYS 27 N -0.36 0.68 -2.81 1.20 0.00 -1.26 -5.07 118.16 110.55 2k4f n LYS 27 Ca 0.04 -0.06 -0.02 0.00 -0.00 0.00 0.00 58.31 58.27 2k4f n LYS 27 Cb 0.83 -1.52 -0.02 0.00 -0.00 0.00 0.00 35.03 34.32 2k4f n LYS 27 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 2k4f n GLU 28 N -2.61 -3.08 0.00 -1.58 -0.58 -1.26 -4.93 120.64 106.60 2k4f n GLU 28 Ca -0.25 2.50 0.00 0.00 -0.42 0.00 0.00 57.16 58.99 2k4f n GLU 28 Cb 1.00 -3.87 0.00 0.00 -0.57 0.00 0.00 31.44 27.99 2k4f n GLU 28 CO 0.00 0.00 0.00 -2.13 -0.48 0.00 0.00 177.13 174.52 2k4f n ARG 29 N 1.47 0.00 -2.89 3.49 0.00 -1.26 -5.15 116.66 112.33 2k4f n ARG 29 Ca -0.16 0.00 -0.35 0.00 -0.00 0.00 0.00 57.85 57.34 2k4f n ARG 29 Cb 0.32 0.00 -0.07 0.00 0.00 0.00 0.00 32.46 32.71 2k4f n ARG 29 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.63 176.38 2k4f s PRO 30 N 0.00 4.33 -0.22 -0.14 0.04 -1.26 -5.01 135.00 132.74 2k4f s PRO 30 Ca 0.00 1.10 -0.29 0.00 0.04 0.00 0.00 61.00 61.85 2k4f s PRO 30 Cb 0.00 -2.52 -0.02 0.00 0.04 0.00 0.00 34.50 32.00 2k4f s PRO 30 CO 0.00 0.16 1.48 -1.25 0.04 0.00 0.00 177.00 177.43 2k4f s PRO 31 N -2.60 3.93 0.00 0.56 0.04 -1.26 -5.02 135.00 130.65 2k4f s PRO 31 Ca 0.54 1.60 0.00 0.00 0.04 0.00 0.00 61.00 63.18 2k4f s PRO 31 Cb -0.14 -3.95 0.00 0.00 0.04 0.00 0.00 34.50 30.45 2k4f s PRO 31 CO 0.18 -1.12 0.00 -2.30 0.04 0.00 0.00 177.00 173.80 2k4f n PRO 32 N 7.37 0.67 -2.39 0.56 -0.02 -1.26 -4.81 135.00 135.12 2k4f n PRO 32 Ca 0.17 0.00 -0.01 0.00 -2.02 0.00 0.00 63.50 61.64 2k4f n PRO 32 Cb 0.45 0.00 -0.01 0.00 -0.02 0.00 0.00 33.50 33.92 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 -1.88-11.92 -2.06 -1.45 0.31 -1.26 -4.95 118.33 95.12 2k4f n VAL 33 Ca 0.00 2.77 -0.32 0.00 -0.01 0.00 0.00 64.34 66.78 2k4f n VAL 33 Cb 0.00 -5.69 0.01 0.00 -0.91 0.00 0.00 33.84 27.24 2k4f n VAL 33 CO 0.00 0.00 0.00 -2.16 -1.32 0.00 0.00 176.83 173.35 2k4f s PRO 34 N -0.54 3.43 -0.22 5.55 0.04 -1.26 -5.01 135.00 136.99 2k4f s PRO 34 Ca -0.05 1.10 0.02 0.00 0.04 0.00 0.00 61.00 62.11 2k4f s PRO 34 Cb 0.00 -2.05 -0.14 0.00 0.04 0.00 0.00 34.50 32.35 2k4f s PRO 34 CO 0.13 -0.71 -0.19 0.09 0.04 0.00 0.00 177.00 176.36 2k4f n ASN 35 N -2.09 2.30 0.00 6.66 4.13 -1.26 -4.44 115.26 120.56 2k4f n ASN 35 Ca 0.08 -0.12 0.00 0.00 1.68 0.00 0.00 54.58 56.22 2k4f n ASN 35 Cb 0.53 -0.33 0.00 0.00 -1.54 0.00 0.00 39.78 38.44 2k4f n ASN 35 CO 0.00 0.00 0.00 -2.65 0.28 0.00 0.00 177.26 174.89 2k4f n PRO 36 N -3.13 0.00 -0.06 3.52 -0.02 -1.26 0.16 135.00 134.21 2k4f n PRO 36 Ca -0.38 0.35 0.11 0.00 -2.02 0.00 0.00 63.50 61.56 2k4f n PRO 36 Cb 0.91 -1.62 0.41 0.00 -0.02 0.00 0.00 33.50 33.18 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 -1.34 1.67 -0.53 2.55 5.75 -1.26 -3.79 116.55 119.59 2k4f n ASP 37 Ca 0.00 -1.66 0.07 0.00 -0.01 0.00 0.00 54.79 53.18 2k4f n ASP 37 Cb 0.12 -0.08 0.22 0.00 -1.03 0.00 0.00 41.12 40.34 2k4f n ASP 37 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2k4f n TYR 38 N 0.32 0.33 -2.46 2.11 9.36 0.12 -4.11 117.16 122.83 2k4f n TYR 38 Ca 0.17 -0.17 -0.28 0.00 3.32 0.00 0.00 57.90 60.94 2k4f n TYR 38 Cb 0.34 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.06 2k4f n TYR 38 CO 0.00 0.00 0.00 -0.85 0.22 0.00 0.00 176.86 176.23 2k4f n GLU 39 N 0.31 3.38 0.00 2.98 -0.00 -1.25 -4.86 120.64 121.20 2k4f n GLU 39 Ca 0.12 -4.45 0.00 0.00 -0.00 0.00 0.00 57.16 52.83 2k4f n GLU 39 Cb 0.26 -2.25 0.00 0.00 -0.00 0.00 0.00 31.44 29.45 2k4f n GLU 39 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.13 176.78 2k4f n PRO 40 N -0.47 0.35 -0.65 3.44 -0.04 -1.26 -2.30 135.00 134.07 2k4f n PRO 40 Ca 0.40 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.94 2k4f n PRO 40 Cb 0.61 -1.01 0.33 0.00 -0.04 0.00 0.00 33.50 33.40 2k4f n PRO 40 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 2k4f n ILE 41 N -0.45 2.35 -3.54 0.52 -0.00 -1.26 -4.81 119.36 112.17 2k4f n ILE 41 Ca 0.00 -1.52 -0.41 0.00 -0.00 0.00 0.00 62.75 60.82 2k4f n ILE 41 Cb 0.01 -0.16 -0.06 0.00 -0.00 0.00 0.00 39.64 39.43 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 -2.54 3.03 -0.12 6.28 3.52 -0.97 -5.01 118.95 123.14 2k4f s ARG 42 Ca 0.48 -2.47 -0.30 0.00 -0.13 0.00 0.00 55.73 53.31 2k4f s ARG 42 Cb 0.36 -4.05 0.12 0.00 -1.56 0.00 0.00 34.95 29.82 2k4f s ARG 42 CO 0.15 -1.23 1.01 0.21 -0.81 0.00 0.00 175.30 174.63 2k4f s LYS 43 N 0.10 0.60 -0.04 5.12 2.47 -1.26 -5.09 119.74 121.64 2k4f s LYS 43 Ca 0.17 -0.06 -0.00 0.00 -1.56 0.00 0.00 55.97 54.51 2k4f s LYS 43 Cb -0.16 0.28 -0.00 0.00 -1.46 0.00 0.00 37.83 36.49 2k4f s LYS 43 CO -0.06 -0.23 -0.00 0.78 0.16 0.00 0.00 175.35 176.00 2k4f h GLY 44 N 2.24 0.00 -5.94 5.54 0.00 -2.02 -3.49 103.07 99.40 2k4f h GLY 44 Ca -0.18 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.13 2k4f h GLY 44 CO 0.29 0.00 -1.00 -0.18 0.00 0.00 0.00 176.54 175.65 2k4f n GLN 45 N -3.16 -1.50 0.00 4.80 -0.06 -1.26 -4.89 117.38 111.31 2k4f n GLN 45 Ca -0.00 1.52 0.00 0.00 -2.00 0.00 0.00 57.00 56.52 2k4f n GLN 45 Cb 0.01 -2.65 0.00 0.00 -4.06 0.00 0.00 30.24 23.53 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 0.97 0.00 0.00 3.69 1.85 -1.26 -4.94 116.66 116.97 2k4f n ARG 46 Ca -0.00 0.00 0.14 0.00 -1.00 0.00 0.00 57.85 56.99 2k4f n ARG 46 Cb 0.34 0.00 0.52 0.00 -1.05 0.00 0.00 32.46 32.27 2k4f n ARG 46 CO 0.00 0.00 0.00 -0.40 -0.01 0.00 0.00 177.63 177.22 2k4f n ASP 47 N -0.00 1.36 0.04 2.89 5.75 -1.26 -3.90 116.55 121.42 2k4f n ASP 47 Ca 0.00 -1.38 0.02 0.00 -0.01 0.00 0.00 54.79 53.42 2k4f n ASP 47 Cb 0.00 0.02 0.37 0.00 -1.03 0.00 0.00 41.12 40.48 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 2.08 0.40 -0.80 -2.12 5.85 -1.98 -1.90 115.31 116.84 2k4f h LEU 48 Ca 0.00 -0.05 -0.11 0.00 0.84 0.00 0.00 57.88 58.55 2k4f h LEU 48 Cb 0.48 -0.10 -0.01 0.00 0.37 0.00 0.00 40.66 41.40 2k4f h LEU 48 CO 0.00 0.43 -0.30 1.88 -0.34 0.00 0.00 178.44 180.12 2k4f h TYR 49 N 0.43 0.65 -0.35 1.25 0.05 -2.00 -2.94 116.97 114.06 2k4f h TYR 49 Ca 0.10 -0.16 -0.17 0.00 0.05 0.00 0.00 58.73 58.55 2k4f h TYR 49 Cb 0.21 -0.15 -0.00 0.00 1.01 0.00 0.00 36.73 37.80 2k4f h TYR 49 CO 0.01 0.80 -0.45 1.03 -1.05 0.00 0.00 178.16 178.50 2k4f h SER 50 N 0.49 1.00 0.18 3.88 0.87 -1.62 -2.78 113.55 115.58 2k4f h SER 50 Ca 0.06 -0.49 0.00 0.00 -1.23 0.00 0.00 61.79 60.13 2k4f h SER 50 Cb 0.76 -0.28 0.00 0.00 -0.44 0.00 0.00 62.40 62.44 2k4f h SER 50 CO 0.06 1.29 0.00 0.61 -0.53 0.00 0.00 176.83 178.26 2k4f n GLY 51 N 0.24 -0.76 0.32 5.77 0.00 -0.78 -3.01 105.19 106.96 2k4f n GLY 51 Ca -0.03 -0.10 -0.07 0.00 0.00 0.00 0.00 46.02 45.81 2k4f n GLY 51 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2k4f h LEU 52 N 0.00 1.05 -3.53 0.99 7.12 -1.32 -2.81 115.31 116.80 2k4f h LEU 52 Ca 0.00 -0.23 -0.05 0.00 0.13 0.00 0.00 57.88 57.73 2k4f h LEU 52 Cb 0.09 -0.28 -0.02 0.00 -0.53 0.00 0.00 40.66 39.93 2k4f h LEU 52 CO 0.00 1.00 -0.07 0.59 -0.13 0.00 0.00 178.44 179.83 2k4f n ASN 53 N -4.27 4.21 -0.96 1.25 5.03 -1.16 -4.51 115.26 114.85 2k4f n ASN 53 Ca 0.05 -2.17 0.00 0.00 0.87 0.00 0.00 54.58 53.33 2k4f n ASN 53 Cb 0.25 -0.97 0.00 0.00 -1.02 0.00 0.00 39.78 38.04 2k4f n ASN 53 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2k4f n GLN 54 N 1.93 0.41 -1.99 3.52 10.64 -1.06 -4.83 117.38 126.00 2k4f n GLN 54 Ca 0.11 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.28 2k4f n GLN 54 Cb 0.50 -1.29 0.00 0.00 -0.86 0.00 0.00 30.24 28.60 2k4f n GLN 54 CO 0.00 0.00 0.00 -2.13 -1.83 0.00 0.00 177.06 173.10 2k4f n ARG 55 N 0.76 -5.51 -3.59 2.61 3.00 -1.26 -4.71 116.66 107.96 2k4f n ARG 55 Ca 0.00 3.96 -0.28 0.00 -0.00 0.00 0.00 57.85 61.53 2k4f n ARG 55 Cb 0.20 -4.34 0.05 0.00 0.00 0.00 0.00 32.46 28.36 2k4f n ARG 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2k4f n ALA 56 N 0.87 -2.55 0.00 5.13 0.00 -1.26 -5.20 120.51 117.49 2k4f n ALA 56 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.27 2k4f n ALA 56 Cb 0.00 -4.27 0.00 0.00 0.00 0.00 0.00 19.45 15.18 2k4f n ALA 56 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83