#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jb0 s GLN 2 N 0.00 2.06 -0.28 5.55 -2.07 -1.26 -5.01 119.66 118.65 1jb0 s GLN 2 Ca 0.00 -1.29 -0.41 0.00 -1.82 0.00 0.00 55.36 51.83 1jb0 s GLN 2 Cb 0.00 0.60 -0.17 0.00 -1.09 0.00 0.00 33.01 32.35 1jb0 s GLN 2 CO 0.00 -0.96 1.63 -2.13 -1.32 0.00 0.00 175.29 172.51 1jb0 n ARG 3 N -0.53 0.82 0.00 9.60 0.63 -1.26 -0.37 116.66 125.55 1jb0 n ARG 3 Ca -0.07 0.30 0.00 0.00 -0.92 0.00 0.00 57.85 57.16 1jb0 n ARG 3 Cb 0.60 -1.93 0.00 0.00 0.45 0.00 0.00 32.46 31.58 1jb0 n ARG 3 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1jb0 n GLY 4 N 3.84 3.09 3.68 5.14 0.00 0.12 -4.99 105.19 116.06 1jb0 n GLY 4 Ca 0.26 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.98 1jb0 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1jb0 s SER 5 N -1.12 3.05 -0.19 1.61 0.01 0.50 -4.65 113.70 112.91 1jb0 s SER 5 Ca 0.00 2.03 -0.05 0.00 1.31 0.00 0.00 55.95 59.23 1jb0 s SER 5 Cb 0.00 -2.52 -0.03 0.00 0.21 0.00 0.00 66.02 63.68 1jb0 s SER 5 CO 0.00 -3.00 0.01 -0.54 0.41 0.00 0.00 173.24 170.12 1jb0 s LYS 6 N -4.69 3.71 0.03 12.44 -0.14 -1.26 -0.81 119.74 129.02 1jb0 s LYS 6 Ca 0.66 -0.48 0.04 0.00 -1.36 0.00 0.00 55.97 54.83 1jb0 s LYS 6 Cb -0.22 -3.07 -0.02 0.00 -1.68 0.00 0.00 37.83 32.84 1jb0 s LYS 6 CO 0.58 0.12 -0.12 0.14 -0.76 0.00 0.00 175.35 175.31 1jb0 s VAL 7 N 0.72 0.95 -0.19 3.17 -7.23 0.60 -1.00 120.40 117.42 1jb0 s VAL 7 Ca 0.00 -0.85 -0.14 0.00 -1.81 0.00 0.00 61.98 59.19 1jb0 s VAL 7 Cb -0.14 -0.86 -0.04 0.00 0.56 0.00 0.00 36.38 35.89 1jb0 s VAL 7 CO 0.02 0.02 0.30 -0.75 -0.31 0.00 0.00 175.10 174.38 1jb0 s LYS 8 N -0.94 4.20 0.14 4.82 2.20 0.16 -0.20 119.74 130.13 1jb0 s LYS 8 Ca 0.01 0.05 -0.30 0.00 -0.36 0.00 0.00 55.97 55.37 1jb0 s LYS 8 Cb -0.07 -3.48 -0.07 0.00 -1.51 0.00 0.00 37.83 32.70 1jb0 s LYS 8 CO 0.01 0.12 1.11 0.42 -0.36 0.00 0.00 175.35 176.65 1jb0 s ILE 9 N 0.85 3.97 -0.63 5.43 -1.09 -0.32 -1.58 121.20 127.82 1jb0 s ILE 9 Ca 0.15 1.61 0.06 0.00 -2.23 0.00 0.00 60.65 60.25 1jb0 s ILE 9 Cb -0.14 -4.03 0.01 0.00 -1.58 0.00 0.00 42.46 36.73 1jb0 s ILE 9 CO 0.05 0.24 0.55 0.18 -1.23 0.00 0.00 174.94 174.72 1jb0 n LEU 10 N 2.80 1.11 -4.61 2.97 4.77 0.13 -1.93 117.00 122.24 1jb0 n LEU 10 Ca 0.04 -0.83 -0.43 0.00 -0.03 0.00 0.00 56.01 54.76 1jb0 n LEU 10 Cb 0.47 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.53 1jb0 n LEU 10 CO 0.54 0.23 1.21 -0.60 -1.33 0.00 0.00 177.39 177.45 1jb0 s ARG 11 N -0.88 3.65 0.28 3.23 3.52 -1.25 -4.93 118.95 122.57 1jb0 s ARG 11 Ca 0.06 1.00 0.02 0.00 -0.13 0.00 0.00 55.73 56.67 1jb0 s ARG 11 Cb 0.05 -4.00 0.60 0.00 -1.56 0.00 0.00 34.95 30.05 1jb0 s ARG 11 CO 0.13 -1.47 1.80 -1.35 -0.81 0.00 0.00 175.30 173.60 1jb0 h PRO 12 N 10.40 0.82 -0.05 5.12 0.11 -1.97 -1.48 132.00 144.96 1jb0 h PRO 12 Ca -0.27 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.79 1jb0 h PRO 12 Cb 1.10 -0.19 0.00 0.00 0.11 0.00 0.00 31.00 32.03 1jb0 h PRO 12 CO 1.08 0.55 0.00 -0.85 -0.21 0.00 0.00 178.00 178.56 1jb0 n GLU 13 N -4.72 1.15 -2.85 1.05 0.00 -1.26 -4.85 120.64 109.17 1jb0 n GLU 13 Ca 0.20 -0.23 -0.39 0.00 0.00 0.00 0.00 57.16 56.74 1jb0 n GLU 13 Cb 0.44 -1.18 -0.06 0.00 0.00 0.00 0.00 31.44 30.64 1jb0 n GLU 13 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 1jb0 s SER 14 N -1.28 7.50 0.52 -1.84 0.15 -0.56 -4.92 113.70 113.27 1jb0 s SER 14 Ca 0.16 1.81 0.16 0.00 0.70 0.00 0.00 55.95 58.78 1jb0 s SER 14 Cb 0.08 -2.56 1.26 0.00 -1.71 0.00 0.00 66.02 63.09 1jb0 s SER 14 CO 0.12 0.15 2.15 0.22 1.20 0.00 0.00 173.24 177.08 1jb0 h TYR 15 N 4.07 0.01 -0.50 3.44 3.20 -1.88 -2.31 116.97 123.00 1jb0 h TYR 15 Ca -0.46 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.41 1jb0 h TYR 15 Cb 1.20 -0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.47 1jb0 h TYR 15 CO 0.62 0.01 0.00 0.91 -1.64 0.00 0.00 178.16 178.06 1jb0 n TRP 16 N -4.54 1.75 -1.64 -3.82 8.01 -1.26 -5.00 117.44 110.94 1jb0 n TRP 16 Ca -0.03 -0.76 -0.45 0.00 -1.31 0.00 0.00 57.50 54.95 1jb0 n TRP 16 Cb 0.09 -0.45 -0.02 0.00 -2.01 0.00 0.00 31.31 28.92 1jb0 n TRP 16 CO 0.00 0.00 0.00 0.98 -1.01 0.00 0.00 177.69 177.66 1jb0 n TYR 17 N 0.35 1.83 -0.68 -5.99 9.36 -0.87 -0.17 117.16 120.99 1jb0 n TYR 17 Ca 0.26 0.56 0.00 0.00 3.32 0.00 0.00 57.90 62.04 1jb0 n TYR 17 Cb 1.10 -2.37 0.00 0.00 -0.63 0.00 0.00 39.34 37.44 1jb0 n TYR 17 CO 0.00 0.00 0.00 0.09 0.22 0.00 0.00 176.86 177.17 1jb0 n ASN 18 N 1.64 0.00 -5.00 2.98 5.03 -0.81 -4.95 115.26 114.14 1jb0 n ASN 18 Ca 0.10 0.00 -0.19 0.00 0.87 0.00 0.00 54.58 55.37 1jb0 n ASN 18 Cb 0.31 -0.92 0.02 0.00 -1.02 0.00 0.00 39.78 38.17 1jb0 n ASN 18 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 1jb0 s GLU 19 N -0.33 2.63 -0.09 3.52 2.02 0.76 -4.80 118.70 122.41 1jb0 s GLU 19 Ca 0.00 -1.42 0.02 0.00 0.02 0.00 0.00 54.97 53.59 1jb0 s GLU 19 Cb 0.00 -2.66 -0.02 0.00 0.10 0.00 0.00 34.13 31.55 1jb0 s GLU 19 CO 0.00 -0.44 -0.15 0.08 0.02 0.00 0.00 175.26 174.78 1jb0 s VAL 20 N -2.47 2.98 0.44 2.63 1.01 -1.26 -1.18 120.40 122.55 1jb0 s VAL 20 Ca 0.55 -0.72 0.03 0.00 0.00 0.00 0.00 61.98 61.84 1jb0 s VAL 20 Cb -0.08 -2.20 -0.02 0.00 0.00 0.00 0.00 36.38 34.08 1jb0 s VAL 20 CO 0.34 0.56 0.09 -0.83 0.00 0.00 0.00 175.10 175.25 1jb0 s GLY 21 N -0.14 2.73 -0.14 4.51 0.00 0.73 -4.76 107.32 110.24 1jb0 s GLY 21 Ca -0.01 -1.01 0.02 0.00 0.00 0.00 0.00 44.72 43.72 1jb0 s GLY 21 CO 0.03 -1.95 -0.20 -0.51 0.00 0.00 0.00 173.10 170.47 1jb0 s THR 22 N -3.10 1.94 0.16 0.90 -4.23 -0.59 -0.29 115.64 110.43 1jb0 s THR 22 Ca 0.19 -0.90 -0.32 0.00 -1.18 0.00 0.00 61.69 59.48 1jb0 s THR 22 Cb 0.03 -1.73 -0.11 0.00 1.34 0.00 0.00 72.50 72.02 1jb0 s THR 22 CO 0.11 0.53 1.79 0.52 -0.54 0.00 0.00 174.62 177.02 1jb0 n VAL 23 N 4.17 0.20 0.27 2.29 0.31 0.01 -1.83 118.33 123.75 1jb0 n VAL 23 Ca -0.20 -0.04 0.11 0.00 -0.01 0.00 0.00 64.34 64.21 1jb0 n VAL 23 Cb 0.51 -2.06 -0.06 0.00 -0.91 0.00 0.00 33.84 31.33 1jb0 n VAL 23 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1jb0 n ALA 24 N 4.88 3.03 0.00 3.52 0.00 0.17 -0.71 120.51 131.41 1jb0 n ALA 24 Ca 0.17 -0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.20 1jb0 n ALA 24 Cb 0.36 -0.92 0.00 0.00 0.00 0.00 0.00 19.45 18.89 1jb0 n ALA 24 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1jb0 n SER 25 N -2.23 0.00 -3.90 0.00 3.41 -1.21 -4.79 113.62 104.91 1jb0 n SER 25 Ca -0.01 0.00 -0.24 0.00 -0.26 0.00 0.00 58.87 58.36 1jb0 n SER 25 Cb 0.51 0.00 -0.17 0.00 -0.26 0.00 0.00 64.21 64.29 1jb0 n SER 25 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1jb0 s VAL 26 N -2.00 0.83 -0.14 -3.33 1.01 -1.26 -1.37 120.40 114.14 1jb0 s VAL 26 Ca 0.00 -0.21 -0.24 0.00 0.00 0.00 0.00 61.98 61.52 1jb0 s VAL 26 Cb 0.00 -0.86 -0.02 0.00 0.00 0.00 0.00 36.38 35.50 1jb0 s VAL 26 CO 0.00 0.32 0.78 -0.62 0.00 0.00 0.00 175.10 175.58 1jb0 s ASP 27 N 1.43 6.95 0.00 3.32 2.15 -0.91 -4.92 116.67 124.69 1jb0 s ASP 27 Ca -0.01 1.16 0.25 0.00 0.43 0.00 0.00 52.55 54.37 1jb0 s ASP 27 Cb -0.13 -2.44 0.46 0.00 -0.30 0.00 0.00 42.92 40.51 1jb0 s ASP 27 CO -0.04 -0.30 1.41 0.00 -0.17 0.00 0.00 175.17 176.07 1jb0 n GLN 28 N 4.77 2.17 -1.68 4.34 1.13 -1.26 -4.73 117.38 122.12 1jb0 n GLN 28 Ca 0.02 -1.72 -0.54 0.00 -1.94 0.00 0.00 57.00 52.82 1jb0 n GLN 28 Cb 0.50 -1.47 -0.06 0.00 0.11 0.00 0.00 30.24 29.31 1jb0 n GLN 28 CO 0.00 0.00 0.00 2.41 -1.44 0.00 0.00 177.06 178.03 1jb0 n THR 29 N 1.04 0.27 -1.73 5.09 -1.04 -1.26 -4.83 114.28 111.83 1jb0 n THR 29 Ca 0.16 -0.05 -0.41 0.00 -2.04 0.00 0.00 64.05 61.71 1jb0 n THR 29 Cb 0.53 -1.26 0.01 0.00 -1.82 0.00 0.00 70.33 67.79 1jb0 n THR 29 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 1jb0 n PRO 30 N 4.90 2.14 0.00 -2.82 -0.02 -1.26 -2.81 135.00 135.12 1jb0 n PRO 30 Ca 0.24 0.76 0.00 0.00 -2.02 0.00 0.00 63.50 62.47 1jb0 n PRO 30 Cb 0.18 -2.47 0.00 0.00 -0.02 0.00 0.00 33.50 31.18 1jb0 n PRO 30 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1jb0 n GLY 31 N 0.70 3.04 3.63 -1.23 0.00 -1.26 -5.01 105.19 105.05 1jb0 n GLY 31 Ca 0.05 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.64 1jb0 n GLY 31 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1jb0 n VAL 32 N -0.86 0.55 -0.01 1.61 0.31 -1.12 -4.91 118.33 113.89 1jb0 n VAL 32 Ca 0.00 -0.28 -0.04 0.00 -0.01 0.00 0.00 64.34 64.00 1jb0 n VAL 32 Cb 0.00 -2.37 0.18 0.00 -0.91 0.00 0.00 33.84 30.74 1jb0 n VAL 32 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 1jb0 h LYS 33 N 12.55 0.55 -2.85 5.55 1.57 -1.95 -3.37 116.57 128.62 1jb0 h LYS 33 Ca -0.45 -0.20 -0.61 0.00 -1.87 0.00 0.00 60.65 57.52 1jb0 h LYS 33 Cb 1.25 -0.03 -0.40 0.00 0.08 0.00 0.00 32.23 33.12 1jb0 h LYS 33 CO 0.95 0.74 -0.75 0.71 -0.57 0.00 0.00 179.45 180.53 1jb0 s TYR 34 N -4.55 2.30 0.23 -1.35 1.51 -1.26 -4.55 117.35 109.68 1jb0 s TYR 34 Ca -0.07 -2.73 0.03 0.00 -1.01 0.00 0.00 57.07 53.28 1jb0 s TYR 34 Cb 0.14 -1.91 0.23 0.00 -0.11 0.00 0.00 41.96 40.31 1jb0 s TYR 34 CO 0.80 -0.71 1.56 -1.00 -1.11 0.00 0.00 175.55 175.08 1jb0 h PRO 35 N 5.94 0.32 -6.60 -1.71 0.14 -1.70 -3.38 132.00 125.01 1jb0 h PRO 35 Ca 0.12 -0.21 -0.56 0.00 0.14 0.00 0.00 66.00 65.50 1jb0 h PRO 35 Cb 0.86 0.03 -0.06 0.00 0.14 0.00 0.00 31.00 31.96 1jb0 h PRO 35 CO 0.54 0.80 1.00 0.08 0.14 0.00 0.00 178.00 180.56 1jb0 s VAL 36 N -3.85 4.03 -0.54 1.56 1.01 -0.51 -2.14 120.40 119.95 1jb0 s VAL 36 Ca -0.05 1.01 -0.21 0.00 0.00 0.00 0.00 61.98 62.73 1jb0 s VAL 36 Cb 0.12 -4.50 0.06 0.00 0.00 0.00 0.00 36.38 32.06 1jb0 s VAL 36 CO 0.81 -1.03 0.76 -0.63 0.00 0.00 0.00 175.10 175.01 1jb0 s ILE 37 N 5.04 4.66 -0.03 2.22 1.01 -0.47 -0.06 121.20 133.57 1jb0 s ILE 37 Ca 0.51 -0.29 -0.03 0.00 0.00 0.00 0.00 60.65 60.84 1jb0 s ILE 37 Cb -0.09 -4.43 -0.04 0.00 0.01 0.00 0.00 42.46 37.91 1jb0 s ILE 37 CO 0.30 -1.00 0.14 -0.69 0.00 0.00 0.00 174.94 173.69 1jb0 s VAL 38 N 3.19 5.18 0.09 2.92 1.01 -0.14 0.43 120.40 133.07 1jb0 s VAL 38 Ca 0.20 -0.19 0.09 0.00 0.00 0.00 0.00 61.98 62.08 1jb0 s VAL 38 Cb -0.17 -3.37 -0.04 0.00 0.00 0.00 0.00 36.38 32.80 1jb0 s VAL 38 CO 0.13 0.39 -0.21 -0.60 0.00 0.00 0.00 175.10 174.81 1jb0 s ARG 39 N -1.71 1.79 0.23 2.72 3.52 -0.76 -1.73 118.95 123.01 1jb0 s ARG 39 Ca 0.24 -1.15 0.06 0.00 -0.13 0.00 0.00 55.73 54.75 1jb0 s ARG 39 Cb -0.12 -2.07 -0.05 0.00 -1.56 0.00 0.00 34.95 31.15 1jb0 s ARG 39 CO 0.14 0.50 -0.09 -0.06 -0.81 0.00 0.00 175.30 174.98 1jb0 s PHE 40 N -1.01 1.72 0.12 5.12 0.40 0.17 -1.55 117.98 122.95 1jb0 s PHE 40 Ca 0.15 -0.68 -0.03 0.00 -0.60 0.00 0.00 56.93 55.76 1jb0 s PHE 40 Cb -0.10 -0.90 -0.13 0.00 0.51 0.00 0.00 43.02 42.40 1jb0 s PHE 40 CO 0.07 0.25 1.27 -0.44 0.70 0.00 0.00 175.22 177.06 1jb0 h ASP 41 N 2.48 0.47 -3.73 1.36 3.32 -1.86 -3.45 116.42 115.00 1jb0 h ASP 41 Ca -0.39 -0.41 -0.68 0.00 0.02 0.00 0.00 57.03 55.58 1jb0 h ASP 41 Cb 1.22 -0.15 -0.19 0.00 0.22 0.00 0.00 39.33 40.44 1jb0 h ASP 41 CO 0.64 1.23 -0.75 -1.59 -1.72 0.00 0.00 179.24 177.06 1jb0 s LYS 42 N -3.10 2.29 0.63 3.56 -2.85 -1.26 -5.10 119.74 113.91 1jb0 s LYS 42 Ca -0.05 -0.88 -0.12 0.00 -1.00 0.00 0.00 55.97 53.93 1jb0 s LYS 42 Cb 0.08 -2.35 -0.03 0.00 -2.06 0.00 0.00 37.83 33.48 1jb0 s LYS 42 CO 0.87 0.56 1.04 0.14 0.10 0.00 0.00 175.35 178.05 1jb0 s VAL 43 N -1.01 4.45 0.00 1.79 -7.23 -1.26 -4.71 120.40 112.43 1jb0 s VAL 43 Ca 0.17 0.85 0.00 0.00 -1.81 0.00 0.00 61.98 61.19 1jb0 s VAL 43 Cb -0.11 -3.70 0.00 0.00 0.56 0.00 0.00 36.38 33.13 1jb0 s VAL 43 CO 0.08 -0.99 0.00 -0.46 -0.31 0.00 0.00 175.10 173.42 1jb0 n ASN 44 N -2.70 0.00 0.13 4.85 0.23 -0.57 -5.00 115.26 112.20 1jb0 n ASN 44 Ca 0.07 0.00 0.12 0.00 -0.53 0.00 0.00 54.58 54.24 1jb0 n ASN 44 Cb 0.54 0.00 0.25 0.00 -2.08 0.00 0.00 39.78 38.48 1jb0 n ASN 44 CO 0.00 0.00 0.00 1.88 -0.93 0.00 0.00 177.26 178.21 1jb0 h TYR 45 N 0.00 0.00 -1.63 -2.53 0.99 -1.89 -3.47 116.97 108.44 1jb0 h TYR 45 Ca 0.00 0.00 -0.71 0.00 2.00 0.00 0.00 58.73 60.02 1jb0 h TYR 45 Cb 0.00 0.00 0.02 0.00 1.00 0.00 0.00 36.73 37.75 1jb0 h TYR 45 CO 0.00 0.00 0.83 2.41 -0.00 0.00 0.00 178.16 181.40 1jb0 n THR 46 N -2.50 0.26 0.00 -2.88 -1.04 -1.26 -4.84 114.28 102.02 1jb0 n THR 46 Ca 0.04 -0.05 0.00 0.00 -2.04 0.00 0.00 64.05 62.00 1jb0 n THR 46 Cb 0.47 -1.21 0.00 0.00 -1.82 0.00 0.00 70.33 67.77 1jb0 n THR 46 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1jb0 n GLY 47 N 3.86 4.09 3.78 3.41 0.00 -1.26 -4.60 105.19 114.46 1jb0 n GLY 47 Ca 0.24 -0.91 -0.35 0.00 0.00 0.00 0.00 46.02 45.00 1jb0 n GLY 47 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1jb0 s TYR 48 N -2.00 2.70 0.02 1.61 5.04 -1.26 -4.86 117.35 118.59 1jb0 s TYR 48 Ca 0.00 1.55 -0.38 0.00 -2.44 0.00 0.00 57.07 55.79 1jb0 s TYR 48 Cb 0.00 -3.27 -0.18 0.00 0.35 0.00 0.00 41.96 38.86 1jb0 s TYR 48 CO 0.00 -1.52 1.26 0.45 -1.34 0.00 0.00 175.55 174.40 1jb0 n SER 49 N -1.29 0.99 0.00 4.32 2.88 -1.26 -0.76 113.62 118.51 1jb0 n SER 49 Ca 0.11 1.14 0.00 0.00 -1.33 0.00 0.00 58.87 58.79 1jb0 n SER 49 Cb 0.51 -1.07 0.00 0.00 -0.75 0.00 0.00 64.21 62.90 1jb0 n SER 49 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1jb0 n GLY 50 N 2.22 0.78 3.74 0.46 0.00 -1.26 -5.04 105.19 106.08 1jb0 n GLY 50 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 1jb0 n GLY 50 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1jb0 s SER 51 N -2.78 7.26 -0.81 1.61 0.15 0.07 -4.95 113.70 114.24 1jb0 s SER 51 Ca 0.00 2.07 -0.02 0.00 0.70 0.00 0.00 55.95 58.70 1jb0 s SER 51 Cb 0.00 -2.60 0.37 0.00 -1.71 0.00 0.00 66.02 62.08 1jb0 s SER 51 CO 0.00 -0.24 2.00 0.00 1.20 0.00 0.00 173.24 176.20 1jb0 n ALA 52 N 2.53 6.45 0.00 5.45 0.00 -1.26 -4.97 120.51 128.71 1jb0 n ALA 52 Ca 0.03 -4.03 0.00 0.00 0.00 0.00 0.00 53.44 49.45 1jb0 n ALA 52 Cb 0.46 -1.91 0.00 0.00 0.00 0.00 0.00 19.45 18.00 1jb0 n ALA 52 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1jb0 n SER 53 N -0.60 0.00 -1.27 0.00 3.41 -1.26 -5.18 113.62 108.72 1jb0 n SER 53 Ca 0.55 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 59.16 1jb0 n SER 53 Cb 0.31 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.26 1jb0 n SER 53 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1jb0 n GLY 54 N 0.00 -4.31 2.62 5.00 0.00 -1.26 -4.81 105.19 102.43 1jb0 n GLY 54 Ca 0.00 -0.79 -0.06 0.00 0.00 0.00 0.00 46.02 45.17 1jb0 n GLY 54 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1jb0 n VAL 55 N -0.91-12.61 -1.31 1.61 0.31 -1.26 -3.78 118.33 100.38 1jb0 n VAL 55 Ca 0.00 2.72 0.08 0.00 -0.01 0.00 0.00 64.34 67.13 1jb0 n VAL 55 Cb 0.00 -6.46 0.13 0.00 -0.91 0.00 0.00 33.84 26.60 1jb0 n VAL 55 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 1jb0 n ASN 56 N 1.74 1.90 -3.82 4.52 0.23 -1.26 -1.51 115.26 117.06 1jb0 n ASN 56 Ca -0.41 -3.03 -0.13 0.00 -0.53 0.00 0.00 54.58 50.48 1jb0 n ASN 56 Cb 0.64 -0.41 -0.13 0.00 -2.08 0.00 0.00 39.78 37.80 1jb0 n ASN 56 CO 0.00 0.00 0.00 0.28 -0.93 0.00 0.00 177.26 176.61 1jb0 s THR 57 N -2.46 -0.01 0.15 5.53 -1.32 -1.26 0.46 115.64 116.73 1jb0 s THR 57 Ca 0.29 0.04 -0.13 0.00 -1.21 0.00 0.00 61.69 60.67 1jb0 s THR 57 Cb 0.26 -0.15 0.01 0.00 -1.51 0.00 0.00 72.50 71.11 1jb0 s THR 57 CO 0.01 0.01 0.37 0.21 -2.21 0.00 0.00 174.62 173.02 1jb0 s ASN 58 N 0.26 -0.11 0.00 8.08 2.47 -0.70 -5.02 114.94 119.92 1jb0 s ASN 58 Ca -0.02 -0.59 0.01 0.00 0.42 0.00 0.00 52.86 52.68 1jb0 s ASN 58 Cb -0.03 0.48 -0.04 0.00 -1.45 0.00 0.00 41.25 40.21 1jb0 s ASN 58 CO -0.01 -0.91 0.05 0.20 -3.72 0.00 0.00 177.10 172.71 1jb0 s ASN 59 N -2.88 5.43 0.18 -4.21 0.01 -1.26 -0.96 114.94 111.25 1jb0 s ASN 59 Ca 0.10 0.07 -0.00 0.00 -0.71 0.00 0.00 52.86 52.31 1jb0 s ASN 59 Cb 0.02 -1.49 -0.04 0.00 0.41 0.00 0.00 41.25 40.14 1jb0 s ASN 59 CO -0.05 0.27 0.07 -0.36 -1.51 0.00 0.00 177.10 175.52 1jb0 s PHE 60 N -1.17 1.14 0.27 2.20 0.40 0.91 -4.96 117.98 116.78 1jb0 s PHE 60 Ca 0.22 -1.22 -0.05 0.00 -0.60 0.00 0.00 56.93 55.28 1jb0 s PHE 60 Cb -0.12 -0.62 -0.05 0.00 0.51 0.00 0.00 43.02 42.74 1jb0 s PHE 60 CO 0.13 -0.46 0.53 0.00 0.70 0.00 0.00 175.22 176.13 1jb0 s ALA 61 N -3.95 3.64 0.32 5.36 0.00 -1.26 -1.42 121.76 124.45 1jb0 s ALA 61 Ca 0.31 -0.57 0.03 0.00 0.00 0.00 0.00 51.96 51.73 1jb0 s ALA 61 Cb 0.07 -2.27 0.62 0.00 0.00 0.00 0.00 23.12 21.54 1jb0 s ALA 61 CO 0.07 0.28 1.91 -0.07 0.00 0.00 0.00 175.76 177.96 1jb0 h LEU 62 N 1.77 0.82 0.00 0.00 3.38 -1.93 0.10 115.31 119.45 1jb0 h LEU 62 Ca -0.48 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.51 1jb0 h LEU 62 Cb 1.19 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.78 1jb0 h LEU 62 CO 0.67 0.50 0.00 0.00 0.09 0.00 0.00 178.44 179.70 1jb0 n HIS 63 N -4.51 0.00 0.91 1.13 1.44 -1.26 -2.46 115.22 110.47 1jb0 n HIS 63 Ca 0.14 0.00 0.10 0.00 -2.01 0.00 0.00 57.72 55.95 1jb0 n HIS 63 Cb 0.26 -0.12 0.04 0.00 0.12 0.00 0.00 29.99 30.28 1jb0 n HIS 63 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 1jb0 n GLU 64 N -1.12 1.65 -4.43 -1.40 1.02 0.36 -4.93 120.64 111.79 1jb0 n GLU 64 Ca 0.14 -1.32 -0.23 0.00 -0.02 0.00 0.00 57.16 55.72 1jb0 n GLU 64 Cb 0.11 -1.42 -0.10 0.00 -0.02 0.00 0.00 31.44 30.01 1jb0 n GLU 64 CO 0.00 0.00 0.00 0.14 1.18 0.00 0.00 177.13 178.45 1jb0 s VAL 65 N -2.09 2.30 -0.16 2.62 -7.23 -1.03 0.17 120.40 114.98 1jb0 s VAL 65 Ca 0.21 -2.28 -0.03 0.00 -1.81 0.00 0.00 61.98 58.06 1jb0 s VAL 65 Cb 0.17 -2.20 0.05 0.00 0.56 0.00 0.00 36.38 34.97 1jb0 s VAL 65 CO 0.41 -0.38 0.05 -1.58 -0.31 0.00 0.00 175.10 173.30 1jb0 s GLN 66 N -3.34 0.41 0.34 4.82 0.74 -0.62 -4.93 119.66 117.08 1jb0 s GLN 66 Ca 0.26 -0.19 -0.29 0.00 0.05 0.00 0.00 55.36 55.19 1jb0 s GLN 66 Cb -0.05 -1.78 -0.11 0.00 1.10 0.00 0.00 33.01 32.18 1jb0 s GLN 66 CO 0.12 -0.59 1.40 -2.00 -0.55 0.00 0.00 175.29 173.68 1jb0 s GLU 67 N 1.98 4.24 0.00 1.67 2.12 -1.26 -0.66 118.70 126.79 1jb0 s GLU 67 Ca 0.01 2.38 0.00 0.00 0.36 0.00 0.00 54.97 57.72 1jb0 s GLU 67 Cb -0.16 -3.04 0.00 0.00 0.26 0.00 0.00 34.13 31.20 1jb0 s GLU 67 CO -0.08 -0.37 0.00 1.33 -0.54 0.00 0.00 175.26 175.61 1jb0 n VAL 68 N 0.94 0.00 0.00 3.70 0.24 -0.17 -4.90 118.33 118.14 1jb0 n VAL 68 Ca 0.02 0.05 0.00 0.00 -2.04 0.00 0.00 64.34 62.37 1jb0 n VAL 68 Cb 0.40 -0.91 0.00 0.00 -1.47 0.00 0.00 33.84 31.87 1jb0 n VAL 68 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69