#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3c4s s ILE 2 N 0.00 4.93 0.22 1.12 1.01 -1.26 -5.04 121.20 122.19 3c4s s ILE 2 Ca 0.00 1.14 0.05 0.00 0.00 0.00 0.00 60.65 61.85 3c4s s ILE 2 Cb 0.00 -3.99 -0.05 0.00 0.01 0.00 0.00 42.46 38.43 3c4s s ILE 2 CO 0.00 -0.05 -0.06 0.72 0.00 0.00 0.00 174.94 175.55 3c4s s PHE 3 N 2.62 1.64 0.13 3.97 -0.71 -1.26 -4.97 117.98 119.40 3c4s s PHE 3 Ca 0.28 -0.77 -0.33 0.00 -1.04 0.00 0.00 56.93 55.07 3c4s s PHE 3 Cb -0.15 -0.89 -0.13 0.00 -1.21 0.00 0.00 43.02 40.64 3c4s s PHE 3 CO 0.09 0.14 1.69 -2.30 -1.34 0.00 0.00 175.22 173.50 3c4s n PRO 4 N -0.42 2.37 0.00 1.99 -0.02 -1.26 -0.95 135.00 136.72 3c4s n PRO 4 Ca -0.07 0.86 0.00 0.00 -2.02 0.00 0.00 63.50 62.27 3c4s n PRO 4 Cb 0.63 -2.67 0.00 0.00 -0.02 0.00 0.00 33.50 31.43 3c4s n PRO 4 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3c4s n GLY 5 N 3.78 2.14 3.82 -1.23 0.00 0.87 -4.98 105.19 109.57 3c4s n GLY 5 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.88 3c4s n GLY 5 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3c4s s ALA 6 N -2.49 2.80 -0.15 4.61 0.00 -0.12 -4.71 121.76 121.70 3c4s s ALA 6 Ca 0.00 0.24 -0.07 0.00 0.00 0.00 0.00 51.96 52.13 3c4s s ALA 6 Cb 0.00 -3.19 -0.04 0.00 0.00 0.00 0.00 23.12 19.89 3c4s s ALA 6 CO 0.00 -0.83 0.10 0.99 0.00 0.00 0.00 175.76 176.01 3c4s s THR 7 N -2.70 5.11 0.12 0.00 2.01 -1.26 -0.49 115.64 118.43 3c4s s THR 7 Ca 0.61 0.07 0.03 0.00 0.31 0.00 0.00 61.69 62.71 3c4s s THR 7 Cb -0.14 -3.26 -0.04 0.00 0.01 0.00 0.00 72.50 69.06 3c4s s THR 7 CO 0.42 0.53 -0.09 0.68 -0.69 0.00 0.00 174.62 175.48 3c4s s VAL 8 N -0.30 0.95 -0.04 3.82 -7.23 -0.33 -1.86 120.40 115.42 3c4s s VAL 8 Ca 0.10 -1.97 0.06 0.00 -1.81 0.00 0.00 61.98 58.36 3c4s s VAL 8 Cb -0.12 -1.73 -0.02 0.00 0.56 0.00 0.00 36.38 35.07 3c4s s VAL 8 CO 0.01 -0.78 -0.23 -0.60 -0.31 0.00 0.00 175.10 173.19 3c4s s ARG 9 N -3.69 2.36 -0.05 4.82 3.52 -0.02 -1.49 118.95 124.41 3c4s s ARG 9 Ca 0.14 -0.87 -0.29 0.00 -0.13 0.00 0.00 55.73 54.57 3c4s s ARG 9 Cb 0.03 -2.16 -0.02 0.00 -1.56 0.00 0.00 34.95 31.24 3c4s s ARG 9 CO -0.02 0.50 0.95 0.08 -0.81 0.00 0.00 175.30 176.01 3c4s s VAL 10 N -0.46 4.86 -1.63 7.11 1.01 -0.80 -1.50 120.40 128.98 3c4s s VAL 10 Ca 0.05 1.97 0.14 0.00 0.00 0.00 0.00 61.98 64.15 3c4s s VAL 10 Cb -0.11 -4.28 0.17 0.00 0.00 0.00 0.00 36.38 32.15 3c4s s VAL 10 CO 0.01 0.11 1.02 0.35 0.00 0.00 0.00 175.10 176.59 3c4s n THR 11 N 4.16 0.20 -2.89 3.92 -2.24 0.03 -0.32 114.28 117.15 3c4s n THR 11 Ca 0.06 -0.60 -0.43 0.00 -2.27 0.00 0.00 64.05 60.81 3c4s n THR 11 Cb 0.50 1.13 -0.05 0.00 -2.10 0.00 0.00 70.33 69.82 3c4s n THR 11 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 3c4s s ASN 12 N -1.13 6.50 0.25 3.42 3.84 -1.26 -4.92 114.94 121.65 3c4s s ASN 12 Ca 0.19 0.14 0.20 0.00 0.21 0.00 0.00 52.86 53.60 3c4s s ASN 12 Cb 0.12 -2.42 0.98 0.00 -0.55 0.00 0.00 41.25 39.38 3c4s s ASN 12 CO 0.18 -0.93 1.62 0.55 -2.79 0.00 0.00 177.10 175.73 3c4s n VAL 13 N 6.18 1.02 0.68 -5.21 3.14 -1.26 -1.51 118.33 121.38 3c4s n VAL 13 Ca 0.04 0.49 0.10 0.00 -2.96 0.00 0.00 64.34 62.01 3c4s n VAL 13 Cb 0.48 -1.44 0.28 0.00 -1.06 0.00 0.00 33.84 32.10 3c4s n VAL 13 CO 0.00 0.00 0.00 0.47 -6.46 0.00 0.00 176.83 170.84 3c4s n ASP 14 N -2.15 2.57 -4.90 6.55 8.00 -1.26 -4.92 116.55 120.44 3c4s n ASP 14 Ca 0.00 -1.89 -0.34 0.00 0.71 0.00 0.00 54.79 53.27 3c4s n ASP 14 Cb 0.12 -0.22 -0.05 0.00 -0.02 0.00 0.00 41.12 40.95 3c4s n ASP 14 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 3c4s s ASP 15 N -1.38 6.41 0.27 -2.24 1.01 -0.57 -5.00 116.67 115.17 3c4s s ASP 15 Ca 0.35 0.42 -0.01 0.00 0.71 0.00 0.00 52.55 54.02 3c4s s ASP 15 Cb 0.19 -2.03 0.48 0.00 1.01 0.00 0.00 42.92 42.56 3c4s s ASP 15 CO 0.27 0.28 1.86 0.74 0.21 0.00 0.00 175.17 178.53 3c4s h THR 16 N 3.05 1.00 -0.76 -1.27 2.02 -1.91 -2.42 112.91 112.62 3c4s h THR 16 Ca -0.50 -0.37 -0.34 0.00 0.77 0.00 0.00 66.41 65.97 3c4s h THR 16 Cb 1.20 -0.17 -0.20 0.00 -1.74 0.00 0.00 68.15 67.24 3c4s h THR 16 CO 0.67 0.20 0.43 -1.22 0.37 0.00 0.00 175.52 175.96 3c4s n TYR 17 N -4.57 2.39 -1.63 3.16 4.01 -1.26 -4.98 117.16 114.28 3c4s n TYR 17 Ca 0.17 -1.40 -0.49 0.00 -0.16 0.00 0.00 57.90 56.03 3c4s n TYR 17 Cb 0.27 -0.75 -0.05 0.00 -0.31 0.00 0.00 39.34 38.50 3c4s n TYR 17 CO 0.00 0.00 0.00 0.98 -0.46 0.00 0.00 176.86 177.38 3c4s n TYR 18 N -0.56 1.95 -0.81 -0.72 9.36 -0.91 -1.10 117.16 124.36 3c4s n TYR 18 Ca 0.44 0.43 0.00 0.00 3.32 0.00 0.00 57.90 62.09 3c4s n TYR 18 Cb 1.39 -2.45 0.00 0.00 -0.63 0.00 0.00 39.34 37.65 3c4s n TYR 18 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 3c4s n ARG 19 N 3.02 -0.23 -2.22 2.98 1.74 0.56 -4.95 116.66 117.55 3c4s n ARG 19 Ca 0.18 0.06 -0.33 0.00 -0.77 0.00 0.00 57.85 56.98 3c4s n ARG 19 Cb 0.25 -3.60 -0.01 0.00 -1.02 0.00 0.00 32.46 28.07 3c4s n ARG 19 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 3c4s s PHE 20 N -2.28 3.06 -0.04 -1.55 0.08 -0.25 -4.75 117.98 112.24 3c4s s PHE 20 Ca 0.00 1.52 0.06 0.00 0.12 0.00 0.00 56.93 58.63 3c4s s PHE 20 Cb 0.00 -2.99 -0.02 0.00 -0.57 0.00 0.00 43.02 39.44 3c4s s PHE 20 CO 0.00 -0.93 -0.24 -1.21 -0.10 0.00 0.00 175.22 172.74 3c4s s GLU 21 N -3.86 2.41 0.32 0.44 2.02 -1.26 -1.91 118.70 116.86 3c4s s GLU 21 Ca 0.64 -0.88 -0.04 0.00 0.02 0.00 0.00 54.97 54.71 3c4s s GLU 21 Cb -0.15 -2.16 -0.00 0.00 0.10 0.00 0.00 34.13 31.92 3c4s s GLU 21 CO 0.32 0.47 0.46 0.20 0.02 0.00 0.00 175.26 176.72 3c4s s GLY 22 N -0.38 1.37 -0.21 -1.39 0.00 -0.55 -4.68 107.32 101.48 3c4s s GLY 22 Ca 0.03 -1.45 -0.10 0.00 0.00 0.00 0.00 44.72 43.20 3c4s s GLY 22 CO 0.02 -0.98 0.13 1.08 0.00 0.00 0.00 173.10 173.35 3c4s s LEU 23 N -3.20 4.19 0.02 0.66 1.43 -0.70 -1.18 118.68 119.89 3c4s s LEU 23 Ca 0.30 0.21 -0.30 0.00 -1.03 0.00 0.00 54.13 53.30 3c4s s LEU 23 Cb -0.00 -2.09 -0.06 0.00 0.03 0.00 0.00 46.19 44.07 3c4s s LEU 23 CO 0.18 0.16 1.48 -0.69 0.23 0.00 0.00 176.35 177.72 3c4s s VAL 24 N 0.47 3.48 -0.14 -1.59 1.01 0.36 -1.29 120.40 122.69 3c4s s VAL 24 Ca 0.08 0.90 0.02 0.00 0.00 0.00 0.00 61.98 62.97 3c4s s VAL 24 Cb -0.11 -3.58 -0.23 0.00 0.00 0.00 0.00 36.38 32.45 3c4s s VAL 24 CO -0.01 -0.00 0.28 0.00 0.00 0.00 0.00 175.10 175.36 3c4s n GLN 25 N 5.41 0.70 -3.52 2.72 1.13 0.69 -0.09 117.38 124.41 3c4s n GLN 25 Ca 0.14 0.22 -0.13 0.00 -1.94 0.00 0.00 57.00 55.29 3c4s n GLN 25 Cb 0.43 -1.67 -0.04 0.00 0.11 0.00 0.00 30.24 29.06 3c4s n GLN 25 CO 0.00 0.00 0.00 -0.98 -1.44 0.00 0.00 177.06 174.64 3c4s s ARG 26 N -2.55 0.90 -0.04 -1.09 1.70 -1.23 -4.80 118.95 111.83 3c4s s ARG 26 Ca -0.20 0.00 0.02 0.00 -0.47 0.00 0.00 55.73 55.08 3c4s s ARG 26 Cb 0.07 0.42 0.01 0.00 -0.57 0.00 0.00 34.95 34.88 3c4s s ARG 26 CO 0.75 -0.32 -0.09 0.08 -1.08 0.00 0.00 175.30 174.64 3c4s s VAL 27 N -1.94 0.82 -0.19 4.99 1.01 -1.26 -1.12 120.40 122.70 3c4s s VAL 27 Ca -0.03 -0.32 -0.28 0.00 0.00 0.00 0.00 61.98 61.35 3c4s s VAL 27 Cb -0.00 -0.76 0.11 0.00 0.00 0.00 0.00 36.38 35.72 3c4s s VAL 27 CO 0.00 0.27 0.90 -0.94 0.00 0.00 0.00 175.10 175.34 3c4s s SER 28 N 0.57 -0.51 -1.37 3.32 1.04 0.11 -4.97 113.70 111.89 3c4s s SER 28 Ca -0.10 0.77 -0.06 0.00 0.48 0.00 0.00 55.95 57.04 3c4s s SER 28 Cb -0.13 0.70 0.04 0.00 0.10 0.00 0.00 66.02 66.73 3c4s s SER 28 CO 0.01 -0.32 0.46 0.47 0.98 0.00 0.00 173.24 174.84 3c4s n ASP 29 N 1.52 -4.66 -0.12 7.02 8.00 -1.26 -0.93 116.55 126.12 3c4s n ASP 29 Ca -0.13 -0.27 -0.02 0.00 0.71 0.00 0.00 54.79 55.08 3c4s n ASP 29 Cb 0.57 -3.82 -0.01 0.00 -0.02 0.00 0.00 41.12 37.83 3c4s n ASP 29 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3c4s n GLY 30 N -1.25 0.52 3.27 0.44 0.00 -1.26 -5.02 105.19 101.90 3c4s n GLY 30 Ca -0.07 -0.39 -0.16 0.00 0.00 0.00 0.00 46.02 45.40 3c4s n GLY 30 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3c4s s LYS 31 N -1.20 1.13 -0.00 1.61 1.02 -0.11 -1.58 119.74 120.61 3c4s s LYS 31 Ca 0.00 -1.46 0.01 0.00 0.02 0.00 0.00 55.97 54.54 3c4s s LYS 31 Cb 0.00 -0.80 -0.00 0.00 -0.52 0.00 0.00 37.83 36.51 3c4s s LYS 31 CO 0.00 0.12 -0.02 0.00 -0.92 0.00 0.00 175.35 174.53 3c4s s ALA 32 N -3.05 0.20 -0.19 5.17 0.00 0.17 -0.71 121.76 123.35 3c4s s ALA 32 Ca 0.17 -0.10 -0.16 0.00 0.00 0.00 0.00 51.96 51.87 3c4s s ALA 32 Cb 0.01 -0.05 -0.04 0.00 0.00 0.00 0.00 23.12 23.03 3c4s s ALA 32 CO 0.03 0.05 0.40 0.00 0.00 0.00 0.00 175.76 176.24 3c4s s ALA 33 N -0.05 3.55 -0.06 0.00 0.00 -0.28 -0.68 121.76 124.24 3c4s s ALA 33 Ca 0.01 -0.47 0.06 0.00 0.00 0.00 0.00 51.96 51.56 3c4s s ALA 33 Cb -0.01 -2.62 -0.01 0.00 0.00 0.00 0.00 23.12 20.48 3c4s s ALA 33 CO -0.00 -0.23 -0.24 0.08 0.00 0.00 0.00 175.76 175.37 3c4s s VAL 34 N 1.15 2.10 -0.26 0.00 1.01 0.14 -0.23 120.40 124.31 3c4s s VAL 34 Ca 0.20 -1.05 -0.08 0.00 0.00 0.00 0.00 61.98 61.05 3c4s s VAL 34 Cb -0.15 -1.76 -0.04 0.00 0.00 0.00 0.00 36.38 34.44 3c4s s VAL 34 CO 0.08 0.57 0.11 -0.22 0.00 0.00 0.00 175.10 175.63 3c4s s LEU 35 N -0.15 3.64 -0.09 3.92 2.96 -0.41 -1.27 118.68 127.27 3c4s s LEU 35 Ca -0.04 -0.13 -0.05 0.00 -0.22 0.00 0.00 54.13 53.69 3c4s s LEU 35 Cb -0.14 -1.99 -0.04 0.00 0.50 0.00 0.00 46.19 44.53 3c4s s LEU 35 CO 0.04 -0.03 0.12 -0.36 -1.32 0.00 0.00 176.35 174.80 3c4s s PHE 36 N 1.59 3.50 0.02 5.38 0.08 -0.06 -1.73 117.98 126.77 3c4s s PHE 36 Ca 0.06 0.43 0.01 0.00 0.12 0.00 0.00 56.93 57.54 3c4s s PHE 36 Cb -0.15 -1.88 -0.02 0.00 -0.57 0.00 0.00 43.02 40.39 3c4s s PHE 36 CO 0.06 0.67 -0.04 -1.21 -0.10 0.00 0.00 175.22 174.60 3c4s s GLU 37 N -1.19 0.35 -0.32 0.44 0.41 -1.26 -1.64 118.70 115.49 3c4s s GLU 37 Ca 0.17 -0.61 -0.01 0.00 -0.41 0.00 0.00 54.97 54.11 3c4s s GLU 37 Cb -0.12 0.00 0.19 0.00 -1.78 0.00 0.00 34.13 32.42 3c4s s GLU 37 CO 0.06 -0.02 0.80 1.21 -0.49 0.00 0.00 175.26 176.83 3c4s s ASN 38 N -1.39 -1.06 1.76 -0.19 3.04 -0.36 -4.99 114.94 111.76 3c4s s ASN 38 Ca -0.13 -0.06 0.00 0.00 0.04 0.00 0.00 52.86 52.71 3c4s s ASN 38 Cb -0.09 1.57 0.00 0.00 -1.54 0.00 0.00 41.25 41.19 3c4s s ASN 38 CO -0.01 -0.17 0.00 0.61 -3.04 0.00 0.00 177.10 174.49 3c4s n GLY 39 N 4.94 3.41 0.33 1.21 0.00 -1.26 -1.35 105.19 112.47 3c4s n GLY 39 Ca 0.07 -0.10 0.14 0.00 0.00 0.00 0.00 46.02 46.13 3c4s n GLY 39 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3c4s n ASN 40 N 7.38 1.09 -4.86 1.61 3.02 -1.26 -4.87 115.26 117.37 3c4s n ASN 40 Ca 0.00 -1.20 -0.36 0.00 -0.03 0.00 0.00 54.58 52.99 3c4s n ASN 40 Cb 0.00 0.02 -0.06 0.00 -0.61 0.00 0.00 39.78 39.13 3c4s n ASN 40 CO 0.00 0.00 0.00 0.86 -2.62 0.00 0.00 177.26 175.50 3c4s s TRP 41 N -2.16 3.64 0.10 3.10 -0.00 -0.46 -5.09 118.94 118.08 3c4s s TRP 41 Ca 0.35 0.76 -0.24 0.00 -0.00 0.00 0.00 56.10 56.98 3c4s s TRP 41 Cb 0.21 -2.12 0.06 0.00 -0.00 0.00 0.00 33.47 31.61 3c4s s TRP 41 CO 0.39 0.63 0.58 0.16 -0.00 0.00 0.00 176.95 178.71 3c4s s ASP 42 N -1.36 -0.53 -0.18 5.86 -4.77 -1.26 -1.22 116.67 113.21 3c4s s ASP 42 Ca 0.25 0.12 -0.13 0.00 -3.30 0.00 0.00 52.55 49.50 3c4s s ASP 42 Cb -0.14 0.56 0.05 0.00 -1.09 0.00 0.00 42.92 42.30 3c4s s ASP 42 CO 0.13 -0.85 0.45 -0.54 0.70 0.00 0.00 175.17 175.06 3c4s s LYS 43 N -3.08 0.48 -0.23 2.11 -0.14 -0.65 -4.98 119.74 113.24 3c4s s LYS 43 Ca -0.02 0.76 -0.07 0.00 -1.36 0.00 0.00 55.97 55.28 3c4s s LYS 43 Cb -0.00 0.11 -0.03 0.00 -1.68 0.00 0.00 37.83 36.23 3c4s s LYS 43 CO -0.07 -0.12 0.05 -1.17 -0.76 0.00 0.00 175.35 173.28 3c4s s LEU 44 N 0.93 3.42 0.01 3.17 2.96 -1.26 -0.88 118.68 127.02 3c4s s LEU 44 Ca -0.06 -0.19 0.03 0.00 -0.22 0.00 0.00 54.13 53.70 3c4s s LEU 44 Cb -0.06 -1.90 -0.01 0.00 0.50 0.00 0.00 46.19 44.72 3c4s s LEU 44 CO -0.08 0.01 -0.09 -0.69 -1.32 0.00 0.00 176.35 174.18 3c4s s VAL 45 N 1.37 0.72 -0.18 1.68 1.01 -0.40 -4.95 120.40 119.64 3c4s s VAL 45 Ca 0.05 -0.54 -0.09 0.00 0.00 0.00 0.00 61.98 61.41 3c4s s VAL 45 Cb -0.15 -0.63 -0.05 0.00 0.00 0.00 0.00 36.38 35.56 3c4s s VAL 45 CO 0.03 0.10 0.11 -0.89 0.00 0.00 0.00 175.10 174.45 3c4s s THR 46 N -0.43 5.26 0.16 3.92 2.01 -1.26 0.23 115.64 125.52 3c4s s THR 46 Ca 0.02 0.13 0.07 0.00 0.31 0.00 0.00 61.69 62.21 3c4s s THR 46 Cb -0.05 -3.37 -0.04 0.00 0.01 0.00 0.00 72.50 69.05 3c4s s THR 46 CO 0.00 0.48 -0.14 -0.36 -0.69 0.00 0.00 174.62 173.91 3c4s s PHE 47 N 0.09 1.54 0.46 4.92 0.08 0.14 -4.95 117.98 120.25 3c4s s PHE 47 Ca 0.08 -0.58 -0.21 0.00 0.12 0.00 0.00 56.93 56.34 3c4s s PHE 47 Cb -0.11 -0.76 -0.10 0.00 -0.57 0.00 0.00 43.02 41.48 3c4s s PHE 47 CO -0.00 0.23 1.00 1.03 -0.10 0.00 0.00 175.22 177.37 3c4s s ARG 48 N -3.16 4.01 0.48 0.44 0.52 -1.26 -0.65 118.95 119.32 3c4s s ARG 48 Ca 0.15 1.25 0.19 0.00 -0.52 0.00 0.00 55.73 56.80 3c4s s ARG 48 Cb -0.03 -2.14 1.20 0.00 0.52 0.00 0.00 34.95 34.50 3c4s s ARG 48 CO 0.04 -0.24 1.99 -0.07 0.02 0.00 0.00 175.30 177.05 3c4s h LEU 49 N 1.74 0.19 0.00 2.53 3.38 -1.63 -0.79 115.31 120.73 3c4s h LEU 49 Ca -0.49 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.48 3c4s h LEU 49 Cb 1.20 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.92 3c4s h LEU 49 CO 0.60 0.11 0.00 -1.54 0.09 0.00 0.00 178.44 177.70 3c4s n SER 50 N -4.44 0.00 -0.88 -0.43 3.41 -1.26 -1.36 113.62 108.66 3c4s n SER 50 Ca 0.09 -0.08 0.10 0.00 -0.26 0.00 0.00 58.87 58.72 3c4s n SER 50 Cb 0.46 -0.18 0.13 0.00 -0.26 0.00 0.00 64.21 64.36 3c4s n SER 50 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3c4s n GLU 51 N -1.18 2.01 -4.32 4.33 1.02 -0.30 -4.89 120.64 117.31 3c4s n GLU 51 Ca 0.07 -1.89 -0.20 0.00 -0.02 0.00 0.00 57.16 55.13 3c4s n GLU 51 Cb 0.08 -1.40 -0.13 0.00 -0.02 0.00 0.00 31.44 29.96 3c4s n GLU 51 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3c4s s LEU 52 N -1.48 2.19 -0.01 -4.62 1.43 -0.46 -0.79 118.68 114.95 3c4s s LEU 52 Ca 0.28 -0.49 0.03 0.00 -1.03 0.00 0.00 54.13 52.92 3c4s s LEU 52 Cb 0.18 -0.60 -0.01 0.00 0.03 0.00 0.00 46.19 45.79 3c4s s LEU 52 CO 0.26 0.01 -0.11 -1.83 0.23 0.00 0.00 176.35 174.91 3c4s s GLU 53 N -1.26 0.85 0.36 1.70 -1.05 -0.56 -4.93 118.70 113.80 3c4s s GLU 53 Ca 0.01 -0.40 -0.27 0.00 -0.15 0.00 0.00 54.97 54.17 3c4s s GLU 53 Cb -0.08 -0.82 -0.09 0.00 -0.44 0.00 0.00 34.13 32.69 3c4s s GLU 53 CO 0.01 0.22 1.15 0.00 0.95 0.00 0.00 175.26 177.60 3c4s s ALA 54 N -0.29 3.25 0.16 -0.84 0.00 -1.26 -0.84 121.76 121.95 3c4s s ALA 54 Ca 0.04 0.96 -0.05 0.00 0.00 0.00 0.00 51.96 52.91 3c4s s ALA 54 Cb -0.04 -3.37 -0.03 0.00 0.00 0.00 0.00 23.12 19.68 3c4s s ALA 54 CO -0.00 -0.41 0.17 0.14 0.00 0.00 0.00 175.76 175.66 3c4s s VAL 55 N -1.34 0.07 0.39 0.00 -7.23 -0.78 -4.87 120.40 106.65 3c4s s VAL 55 Ca 0.53 -1.71 -0.25 0.00 -1.81 0.00 0.00 61.98 58.74 3c4s s VAL 55 Cb -0.31 -2.05 -0.09 0.00 0.56 0.00 0.00 36.38 34.50 3c4s s VAL 55 CO 0.40 -0.31 1.15 -0.54 -0.31 0.00 0.00 175.10 175.49 3c4s s LYS 56 N -4.03 4.09 0.00 4.82 1.02 -1.26 -4.32 119.74 120.05 3c4s s LYS 56 Ca 0.24 1.80 0.00 0.00 0.02 0.00 0.00 55.97 58.03 3c4s s LYS 56 Cb 0.05 -2.68 0.00 0.00 -0.52 0.00 0.00 37.83 34.68 3c4s s LYS 56 CO 0.03 -0.28 0.14 -2.30 -0.92 0.00 0.00 175.35 172.02