#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ja5 s ASN 3 N 0.00 2.89 0.46 4.04 0.01 -1.26 -4.88 114.94 116.20 2ja5 s ASN 3 Ca 0.00 -1.67 0.08 0.00 -0.71 0.00 0.00 52.86 50.56 2ja5 s ASN 3 Cb 0.00 0.49 0.02 0.00 0.41 0.00 0.00 41.25 42.17 2ja5 s ASN 3 CO 0.00 -0.92 0.57 -0.89 -1.51 0.00 0.00 177.10 174.35 2ja5 s THR 4 N -3.18 2.65 0.00 1.60 2.01 -1.26 -4.29 115.64 113.18 2ja5 s THR 4 Ca 0.23 -1.10 0.00 0.00 0.31 0.00 0.00 61.69 61.12 2ja5 s THR 4 Cb 0.03 -2.76 0.00 0.00 0.01 0.00 0.00 72.50 69.78 2ja5 s THR 4 CO 0.14 0.00 0.05 0.18 -0.69 0.00 0.00 174.62 174.29 2ja5 n LEU 5 N -1.87 0.00 -3.64 4.42 4.77 -1.26 -4.78 117.00 114.63 2ja5 n LEU 5 Ca 0.08 -0.00 -0.03 0.00 -0.03 0.00 0.00 56.01 56.03 2ja5 n LEU 5 Cb 0.60 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.63 2ja5 n LEU 5 CO 0.40 0.00 0.85 0.12 -1.33 0.00 0.00 177.39 177.43 2ja5 s PHE 6 N 0.00 -0.35 -0.01 -1.77 5.36 -1.26 -4.56 117.98 115.40 2ja5 s PHE 6 Ca 0.00 0.75 0.00 0.00 -0.96 0.00 0.00 56.93 56.72 2ja5 s PHE 6 Cb 0.00 0.31 0.01 0.00 -0.34 0.00 0.00 43.02 43.00 2ja5 s PHE 6 CO 0.00 -0.17 0.00 0.34 -1.46 0.00 0.00 175.22 173.93 2ja5 s ASP 7 N 0.75 0.07 0.00 6.13 -1.08 -1.26 -3.21 116.67 118.07 2ja5 s ASP 7 Ca -0.03 0.00 0.00 0.00 -0.52 0.00 0.00 52.55 52.01 2ja5 s ASP 7 Cb -0.04 -0.03 0.00 0.00 -1.46 0.00 0.00 42.92 41.39 2ja5 s ASP 7 CO -0.12 -0.03 0.00 -0.67 0.52 0.00 0.00 175.17 174.87 2ja5 n ASP 8 N 3.38 0.00 -4.18 -0.34 2.03 -1.13 -5.03 116.55 111.28 2ja5 n ASP 8 Ca -0.16 0.00 -0.27 0.00 0.52 0.00 0.00 54.79 54.87 2ja5 n ASP 8 Cb 0.57 0.00 -0.16 0.00 -0.72 0.00 0.00 41.12 40.81 2ja5 n ASP 8 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 2ja5 s ILE 9 N -2.00 1.60 0.33 5.18 1.01 -1.26 -1.38 121.20 124.69 2ja5 s ILE 9 Ca 0.00 -0.83 0.06 0.00 0.00 0.00 0.00 60.65 59.88 2ja5 s ILE 9 Cb 0.00 -1.36 -0.07 0.00 0.01 0.00 0.00 42.46 41.04 2ja5 s ILE 9 CO 0.00 0.46 -0.00 -0.36 0.00 0.00 0.00 174.94 175.03 2ja5 s PHE 10 N -0.12 2.15 -0.08 3.97 0.40 0.14 -2.31 117.98 122.12 2ja5 s PHE 10 Ca -0.01 -0.76 0.01 0.00 -0.60 0.00 0.00 56.93 55.57 2ja5 s PHE 10 Cb -0.11 -1.37 0.02 0.00 0.51 0.00 0.00 43.02 42.07 2ja5 s PHE 10 CO 0.02 0.26 -0.11 -1.14 0.70 0.00 0.00 175.22 174.95 2ja5 s GLN 11 N -3.77 1.63 -0.30 0.44 0.74 -0.46 -1.66 119.66 116.29 2ja5 s GLN 11 Ca 0.34 -0.36 -0.28 0.00 0.05 0.00 0.00 55.36 55.10 2ja5 s GLN 11 Cb 0.07 -1.47 -0.02 0.00 1.10 0.00 0.00 33.01 32.69 2ja5 s GLN 11 CO 0.15 -0.08 1.80 0.08 -0.55 0.00 0.00 175.29 176.69 2ja5 s VAL 12 N 1.03 3.47 0.12 1.34 1.01 -1.22 -1.77 120.40 124.39 2ja5 s VAL 12 Ca -0.08 0.49 -0.11 0.00 0.00 0.00 0.00 61.98 62.29 2ja5 s VAL 12 Cb -0.15 -3.61 -0.12 0.00 0.00 0.00 0.00 36.38 32.50 2ja5 s VAL 12 CO -0.01 -0.36 1.36 0.77 0.00 0.00 0.00 175.10 176.86 2ja5 h SER 13 N 12.62 0.90 -3.35 3.32 4.64 -0.44 0.14 113.55 131.38 2ja5 h SER 13 Ca -0.34 -0.55 0.05 0.00 -0.47 0.00 0.00 61.79 60.48 2ja5 h SER 13 Cb 1.17 -0.26 -0.25 0.00 -0.31 0.00 0.00 62.40 62.74 2ja5 h SER 13 CO 1.02 1.34 0.41 -0.70 -0.87 0.00 0.00 176.83 178.03 2ja5 s GLU 14 N -3.88 0.55 -0.14 4.77 2.12 -1.13 -4.77 118.70 116.22 2ja5 s GLU 14 Ca -0.10 0.63 -0.05 0.00 0.36 0.00 0.00 54.97 55.81 2ja5 s GLU 14 Cb 0.09 0.27 -0.04 0.00 0.26 0.00 0.00 34.13 34.72 2ja5 s GLU 14 CO 0.89 -0.07 0.04 0.08 -0.54 0.00 0.00 175.26 175.66 2ja5 s VAL 15 N 0.19 4.59 -0.11 3.70 1.01 -1.26 -2.76 120.40 125.75 2ja5 s VAL 15 Ca 0.03 -0.12 -0.00 0.00 0.00 0.00 0.00 61.98 61.88 2ja5 s VAL 15 Cb -0.05 -3.00 0.02 0.00 0.00 0.00 0.00 36.38 33.35 2ja5 s VAL 15 CO -0.05 0.54 -0.08 -0.62 0.00 0.00 0.00 175.10 174.89 2ja5 s ASP 16 N -0.25 2.20 -0.75 3.32 2.15 -0.76 -4.99 116.67 117.59 2ja5 s ASP 16 Ca 0.07 -0.31 0.01 0.00 0.43 0.00 0.00 52.55 52.74 2ja5 s ASP 16 Cb -0.12 -0.86 0.19 0.00 -0.30 0.00 0.00 42.92 41.82 2ja5 s ASP 16 CO 0.02 -0.11 0.58 -2.16 -0.17 0.00 0.00 175.17 173.33 2ja5 s PRO 17 N 1.65 2.78 -1.30 4.34 0.04 -1.26 -1.16 135.00 140.09 2ja5 s PRO 17 Ca 0.04 -3.09 -0.13 0.00 0.04 0.00 0.00 61.00 57.86 2ja5 s PRO 17 Cb -0.13 -3.70 0.13 0.00 0.04 0.00 0.00 34.50 30.84 2ja5 s PRO 17 CO -0.08 -1.24 1.78 0.41 0.04 0.00 0.00 177.00 177.91 2ja5 n GLY 18 N 2.53 3.83 2.19 0.56 0.00 -1.26 -4.33 105.19 108.71 2ja5 n GLY 18 Ca 0.17 -1.85 -0.08 0.00 0.00 0.00 0.00 46.02 44.25 2ja5 n GLY 18 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ja5 n ARG 19 N 5.73 -1.38 -3.52 1.61 1.74 -1.26 -5.00 116.66 114.58 2ja5 n ARG 19 Ca 0.43 0.36 -0.27 0.00 -0.77 0.00 0.00 57.85 57.60 2ja5 n ARG 19 Cb 0.41 -4.14 -0.09 0.00 -1.02 0.00 0.00 32.46 27.62 2ja5 n ARG 19 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 2ja5 n TYR 20 N -3.82 2.55 -0.49 -1.55 0.53 -1.26 -4.97 117.16 108.14 2ja5 n TYR 20 Ca -0.06 -4.04 0.37 0.00 -1.02 0.00 0.00 57.90 53.15 2ja5 n TYR 20 Cb 0.56 -0.48 0.57 0.00 -1.03 0.00 0.00 39.34 38.96 2ja5 n TYR 20 CO 0.00 0.00 0.00 0.09 -1.02 0.00 0.00 176.86 175.93 2ja5 n ASN 21 N 1.41 0.00 0.00 7.72 3.02 -1.26 -0.65 115.26 125.50 2ja5 n ASN 21 Ca 0.26 0.70 0.00 0.00 -0.03 0.00 0.00 54.58 55.50 2ja5 n ASN 21 Cb 0.42 -0.35 0.00 0.00 -0.61 0.00 0.00 39.78 39.24 2ja5 n ASN 21 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2ja5 n LYS 22 N -3.35 1.49 -3.75 3.52 5.02 -1.26 -4.98 118.16 114.85 2ja5 n LYS 22 Ca 0.31 -1.09 -0.13 0.00 -2.02 0.00 0.00 58.31 55.39 2ja5 n LYS 22 Cb 1.40 -0.96 -0.11 0.00 -0.02 0.00 0.00 35.03 35.35 2ja5 n LYS 22 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2ja5 s VAL 23 N -0.60 -0.00 0.12 -0.18 1.01 0.18 -2.55 120.40 118.37 2ja5 s VAL 23 Ca 0.00 0.01 0.06 0.00 0.00 0.00 0.00 61.98 62.05 2ja5 s VAL 23 Cb 0.00 -0.49 -0.04 0.00 0.00 0.00 0.00 36.38 35.86 2ja5 s VAL 23 CO 0.00 0.01 -0.15 0.00 0.00 0.00 0.00 175.10 174.96 2ja5 s ARG 25 N -2.48 4.15 0.16 0.00 3.52 -0.31 0.31 118.95 124.29 2ja5 s ARG 25 Ca 0.07 -0.24 0.07 0.00 -0.13 0.00 0.00 55.73 55.51 2ja5 s ARG 25 Cb -0.06 -3.43 -0.04 0.00 -1.56 0.00 0.00 34.95 29.86 2ja5 s ARG 25 CO 0.03 0.25 -0.01 0.42 -0.81 0.00 0.00 175.30 175.19 2ja5 s ILE 26 N 0.50 3.75 -0.08 4.11 1.01 0.16 -1.82 121.20 128.84 2ja5 s ILE 26 Ca 0.08 -1.34 -0.03 0.00 0.00 0.00 0.00 60.65 59.36 2ja5 s ILE 26 Cb -0.12 -2.86 0.04 0.00 0.01 0.00 0.00 42.46 39.53 2ja5 s ILE 26 CO -0.01 -0.06 0.06 -1.61 0.00 0.00 0.00 174.94 173.32 2ja5 s GLU 27 N -2.80 0.10 0.40 2.79 2.02 -1.11 -0.35 118.70 119.76 2ja5 s GLU 27 Ca 0.27 0.20 0.04 0.00 0.02 0.00 0.00 54.97 55.50 2ja5 s GLU 27 Cb -0.10 -0.94 -0.02 0.00 0.10 0.00 0.00 34.13 33.17 2ja5 s GLU 27 CO 0.18 -0.41 0.16 0.00 0.02 0.00 0.00 175.26 175.21 2ja5 s ALA 28 N 2.11 2.80 0.33 5.21 0.00 -0.74 0.36 121.76 131.83 2ja5 s ALA 28 Ca 0.04 -1.32 0.04 0.00 0.00 0.00 0.00 51.96 50.72 2ja5 s ALA 28 Cb -0.13 0.87 -0.06 0.00 0.00 0.00 0.00 23.12 23.80 2ja5 s ALA 28 CO -0.05 -0.39 0.07 0.00 0.00 0.00 0.00 175.76 175.39 2ja5 s ALA 29 N -3.23 2.37 -0.10 0.00 0.00 -0.73 -1.75 121.76 118.31 2ja5 s ALA 29 Ca 0.25 -1.97 -0.12 0.00 0.00 0.00 0.00 51.96 50.13 2ja5 s ALA 29 Cb 0.02 0.70 -0.05 0.00 0.00 0.00 0.00 23.12 23.79 2ja5 s ALA 29 CO 0.17 -0.32 0.28 0.45 0.00 0.00 0.00 175.76 176.33 2ja5 s SER 30 N -3.49 6.53 -1.06 0.00 0.15 -0.93 -1.35 113.70 113.55 2ja5 s SER 30 Ca 0.35 0.63 -0.05 0.00 0.70 0.00 0.00 55.95 57.58 2ja5 s SER 30 Cb 0.08 -2.17 0.10 0.00 -1.71 0.00 0.00 66.02 62.33 2ja5 s SER 30 CO 0.15 0.26 2.50 0.41 1.20 0.00 0.00 173.24 177.76 2ja5 n THR 31 N 2.57 4.69 0.00 6.45 -1.04 -0.98 -4.50 114.28 121.47 2ja5 n THR 31 Ca -0.15 -3.95 0.00 0.00 -2.04 0.00 0.00 64.05 57.91 2ja5 n THR 31 Cb 0.53 -1.92 0.00 0.00 -1.82 0.00 0.00 70.33 67.12 2ja5 n THR 31 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 2ja5 n THR 32 N 1.44 0.00 -2.18 12.58 -1.04 -1.26 -4.94 114.28 118.87 2ja5 n THR 32 Ca 0.58 0.00 -0.41 0.00 -2.04 0.00 0.00 64.05 62.19 2ja5 n THR 32 Cb 0.34 0.00 -0.03 0.00 -1.82 0.00 0.00 70.33 68.82 2ja5 n THR 32 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 2ja5 s GLN 33 N 1.71 4.41 -0.02 -2.82 1.11 -1.26 -4.88 119.66 117.91 2ja5 s GLN 33 Ca 0.00 2.14 0.02 0.00 0.01 0.00 0.00 55.36 57.53 2ja5 s GLN 33 Cb 0.00 -3.09 0.10 0.00 -1.01 0.00 0.00 33.01 29.01 2ja5 s GLN 33 CO 0.00 -0.11 0.78 -0.25 0.01 0.00 0.00 175.29 175.72 2ja5 n ASP 34 N 0.89 1.29 -0.10 5.90 8.00 -1.26 -3.65 116.55 127.62 2ja5 n ASP 34 Ca -0.00 -2.09 -0.19 0.00 0.71 0.00 0.00 54.79 53.23 2ja5 n ASP 34 Cb 0.42 -0.39 -0.09 0.00 -0.02 0.00 0.00 41.12 41.05 2ja5 n ASP 34 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2ja5 n GLN 35 N -0.01 0.48 -1.67 -1.24 6.02 -1.26 -4.94 117.38 114.75 2ja5 n GLN 35 Ca 0.04 0.16 -0.31 0.00 -0.01 0.00 0.00 57.00 56.88 2ja5 n GLN 35 Cb 0.29 -1.33 -0.04 0.00 1.02 0.00 0.00 30.24 30.17 2ja5 n GLN 35 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2ja5 s LYS 37 N 8.13 2.88 -0.01 0.00 1.02 -0.85 -2.19 119.74 128.72 2ja5 s LYS 37 Ca 0.89 -0.97 0.01 0.00 0.02 0.00 0.00 55.97 55.92 2ja5 s LYS 37 Cb -0.15 -2.59 0.00 0.00 -0.52 0.00 0.00 37.83 34.58 2ja5 s LYS 37 CO 0.19 0.45 -0.02 -1.17 -0.92 0.00 0.00 175.35 173.87 2ja5 s LEU 38 N -3.42 1.91 -0.22 3.17 2.96 -0.72 -1.81 118.68 120.55 2ja5 s LEU 38 Ca 0.32 -0.05 -0.03 0.00 -0.22 0.00 0.00 54.13 54.15 2ja5 s LEU 38 Cb -0.09 -0.15 0.07 0.00 0.50 0.00 0.00 46.19 46.52 2ja5 s LEU 38 CO 0.24 0.02 0.06 -0.89 -1.32 0.00 0.00 176.35 174.45 2ja5 s THR 39 N 0.06 0.54 -0.01 3.68 2.01 0.30 -1.79 115.64 120.42 2ja5 s THR 39 Ca -0.00 -0.74 0.00 0.00 0.31 0.00 0.00 61.69 61.26 2ja5 s THR 39 Cb -0.03 -1.15 0.02 0.00 0.01 0.00 0.00 72.50 71.36 2ja5 s THR 39 CO -0.00 -0.35 0.02 -0.22 -0.69 0.00 0.00 174.62 173.38 2ja5 s LEU 40 N 1.83 1.38 0.48 4.42 2.96 0.53 0.10 118.68 130.38 2ja5 s LEU 40 Ca 0.02 0.03 -0.21 0.00 -0.22 0.00 0.00 54.13 53.75 2ja5 s LEU 40 Cb -0.17 -0.05 -0.08 0.00 0.50 0.00 0.00 46.19 46.39 2ja5 s LEU 40 CO -0.14 -0.09 1.06 -1.81 -1.32 0.00 0.00 176.35 174.06 2ja5 s ASP 41 N 0.72 6.31 -0.23 3.68 1.01 -0.79 0.41 116.67 127.78 2ja5 s ASP 41 Ca -0.06 2.02 -0.13 0.00 0.71 0.00 0.00 52.55 55.08 2ja5 s ASP 41 Cb -0.09 -2.57 0.07 0.00 1.01 0.00 0.00 42.92 41.34 2ja5 s ASP 41 CO -0.02 -0.80 0.56 -0.63 0.21 0.00 0.00 175.17 174.48 2ja5 s ILE 42 N -1.86 -0.01 -0.67 0.77 1.01 0.15 -4.81 121.20 115.78 2ja5 s ILE 42 Ca 0.66 0.04 -0.26 0.00 0.00 0.00 0.00 60.65 61.09 2ja5 s ILE 42 Cb -0.19 -0.81 -0.10 0.00 0.01 0.00 0.00 42.46 41.36 2ja5 s ILE 42 CO 0.23 0.02 2.35 0.21 0.00 0.00 0.00 174.94 177.75 2ja5 s ASN 43 N 1.47 4.25 0.00 3.58 3.84 -1.26 -2.00 114.94 124.81 2ja5 s ASN 43 Ca -0.09 0.43 0.00 0.00 0.21 0.00 0.00 52.86 53.40 2ja5 s ASN 43 Cb -0.06 -2.53 0.00 0.00 -0.55 0.00 0.00 41.25 38.11 2ja5 s ASN 43 CO -0.16 -3.34 1.32 0.52 -2.79 0.00 0.00 177.10 172.65 2ja5 n VAL 44 N 8.34 1.32 0.00 -5.21 0.31 -1.05 -2.92 118.33 119.11 2ja5 n VAL 44 Ca 0.41 -0.23 0.00 0.00 -0.01 0.00 0.00 64.34 64.51 2ja5 n VAL 44 Cb 0.49 -1.20 0.00 0.00 -0.91 0.00 0.00 33.84 32.22 2ja5 n VAL 44 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 2ja5 n GLU 45 N 1.09 1.92 0.01 5.55 2.13 -1.26 -4.41 120.64 125.68 2ja5 n GLU 45 Ca 0.00 0.00 0.11 0.00 0.66 0.00 0.00 57.16 57.93 2ja5 n GLU 45 Cb 0.43 -0.81 -0.12 0.00 0.27 0.00 0.00 31.44 31.21 2ja5 n GLU 45 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 2ja5 n LEU 46 N -1.60 0.33 -2.95 4.31 4.77 -1.19 -4.66 117.00 116.01 2ja5 n LEU 46 Ca 0.00 -0.03 -0.14 0.00 -0.03 0.00 0.00 56.01 55.81 2ja5 n LEU 46 Cb 0.31 -0.02 -0.01 0.00 -2.33 0.00 0.00 43.42 41.37 2ja5 n LEU 46 CO 0.00 0.01 -0.02 0.33 -1.33 0.00 0.00 177.39 176.38 2ja5 n PHE 47 N -2.17 -2.27 -0.84 -1.77 7.35 -1.15 -5.05 117.46 111.56 2ja5 n PHE 47 Ca -0.02 -2.40 -0.34 0.00 -0.76 0.00 0.00 57.45 53.93 2ja5 n PHE 47 Cb 0.52 0.84 0.10 0.00 0.35 0.00 0.00 39.48 41.29 2ja5 n PHE 47 CO 0.00 0.00 0.00 -2.30 -0.76 0.00 0.00 176.76 173.70 2ja5 n PRO 48 N 1.92 -0.31 -3.66 -7.13 -0.02 -1.26 -4.54 135.00 119.99 2ja5 n PRO 48 Ca 0.16 -0.06 -0.07 0.00 -2.02 0.00 0.00 63.50 61.51 2ja5 n PRO 48 Cb 0.57 -1.63 -0.08 0.00 -0.02 0.00 0.00 33.50 32.34 2ja5 n PRO 48 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2ja5 s VAL 49 N -2.29 -0.34 0.25 -1.45 1.01 -1.26 -5.03 120.40 111.29 2ja5 s VAL 49 Ca 0.52 0.07 0.10 0.00 0.00 0.00 0.00 61.98 62.67 2ja5 s VAL 49 Cb -0.19 -0.81 -0.04 0.00 0.00 0.00 0.00 36.38 35.33 2ja5 s VAL 49 CO 0.71 0.03 -0.09 0.00 0.00 0.00 0.00 175.10 175.74 2ja5 s ALA 50 N 2.02 2.96 0.18 5.51 0.00 -1.26 -4.97 121.76 126.20 2ja5 s ALA 50 Ca -0.07 -1.67 -0.32 0.00 0.00 0.00 0.00 51.96 49.90 2ja5 s ALA 50 Cb -0.09 -0.60 -0.16 0.00 0.00 0.00 0.00 23.12 22.27 2ja5 s ALA 50 CO -0.16 0.33 0.95 0.00 0.00 0.00 0.00 175.76 176.88 2ja5 n ALA 51 N -0.53 -1.62 -2.71 0.00 0.00 -1.26 -4.21 120.51 110.18 2ja5 n ALA 51 Ca -0.07 0.46 -0.02 0.00 0.00 0.00 0.00 53.44 53.81 2ja5 n ALA 51 Cb 0.58 -1.88 -0.02 0.00 0.00 0.00 0.00 19.45 18.14 2ja5 n ALA 51 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2ja5 n GLN 52 N 1.33 -3.74 -3.96 0.00 6.02 0.50 -4.97 117.38 112.57 2ja5 n GLN 52 Ca 0.15 2.94 -0.10 0.00 -0.01 0.00 0.00 57.00 59.99 2ja5 n GLN 52 Cb 0.24 -5.04 -0.07 0.00 1.02 0.00 0.00 30.24 26.39 2ja5 n GLN 52 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2ja5 s ASP 53 N -1.25 0.03 -1.06 1.08 1.01 -1.26 -4.85 116.67 110.37 2ja5 s ASP 53 Ca -0.10 -0.86 -0.08 0.00 0.71 0.00 0.00 52.55 52.22 2ja5 s ASP 53 Cb 0.01 0.44 0.26 0.00 1.01 0.00 0.00 42.92 44.64 2ja5 s ASP 53 CO 0.75 -0.90 1.03 -0.94 0.21 0.00 0.00 175.17 175.32 2ja5 s SER 54 N -2.97 7.03 0.15 0.27 1.04 -1.26 -3.41 113.70 114.55 2ja5 s SER 54 Ca 0.17 -3.59 -0.20 0.00 0.48 0.00 0.00 55.95 52.81 2ja5 s SER 54 Cb 0.03 -2.15 -0.07 0.00 0.10 0.00 0.00 66.02 63.93 2ja5 s SER 54 CO 0.00 -0.27 0.65 -0.76 0.98 0.00 0.00 173.24 173.83 2ja5 s LEU 55 N -1.24 4.45 -0.30 2.42 1.43 -0.67 -4.67 118.68 120.12 2ja5 s LEU 55 Ca 0.30 1.34 -0.03 0.00 -1.03 0.00 0.00 54.13 54.71 2ja5 s LEU 55 Cb -0.09 -3.23 0.04 0.00 0.03 0.00 0.00 46.19 42.94 2ja5 s LEU 55 CO -0.09 0.16 0.01 -0.89 0.23 0.00 0.00 176.35 175.78 2ja5 s THR 56 N -1.30 3.16 -0.12 5.49 2.01 -1.12 0.24 115.64 124.01 2ja5 s THR 56 Ca 0.36 -1.23 -0.14 0.00 0.31 0.00 0.00 61.69 60.98 2ja5 s THR 56 Cb -0.19 -2.76 -0.05 0.00 0.01 0.00 0.00 72.50 69.52 2ja5 s THR 56 CO 0.21 -0.05 0.33 -0.69 -0.69 0.00 0.00 174.62 173.73 2ja5 s VAL 57 N 1.31 5.25 0.28 3.82 1.01 -0.48 -2.86 120.40 128.73 2ja5 s VAL 57 Ca -0.03 0.65 0.02 0.00 0.00 0.00 0.00 61.98 62.61 2ja5 s VAL 57 Cb -0.19 -3.66 -0.05 0.00 0.00 0.00 0.00 36.38 32.48 2ja5 s VAL 57 CO -0.01 0.43 0.12 -0.89 0.00 0.00 0.00 175.10 174.76 2ja5 s THR 58 N 0.07 0.49 0.00 3.92 2.01 -1.00 -2.84 115.64 118.28 2ja5 s THR 58 Ca 0.19 -2.00 0.00 0.00 0.31 0.00 0.00 61.69 60.19 2ja5 s THR 58 Cb -0.14 -2.58 0.00 0.00 0.01 0.00 0.00 72.50 69.79 2ja5 s THR 58 CO 0.07 0.00 0.00 -0.38 -0.69 0.00 0.00 174.62 173.62 2ja5 n ILE 59 N -0.53 0.00 -0.87 1.82 5.41 -1.20 -2.53 119.36 121.46 2ja5 n ILE 59 Ca 0.00 0.00 0.01 0.00 1.00 0.00 0.00 62.75 63.76 2ja5 n ILE 59 Cb 0.66 0.00 -0.01 0.00 -0.71 0.00 0.00 39.64 39.58 2ja5 n ILE 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2ja5 n ALA 60 N -3.00 -1.39 -3.57 -1.39 0.00 -1.25 -4.50 120.51 105.41 2ja5 n ALA 60 Ca 0.00 0.30 -0.31 0.00 0.00 0.00 0.00 53.44 53.42 2ja5 n ALA 60 Cb 0.00 -1.03 -0.08 0.00 0.00 0.00 0.00 19.45 18.35 2ja5 n ALA 60 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2ja5 n SER 61 N -2.24 3.96 0.00 0.00 3.41 -1.26 -2.17 113.62 115.32 2ja5 n SER 61 Ca -0.01 -3.30 0.00 0.00 -0.26 0.00 0.00 58.87 55.31 2ja5 n SER 61 Cb 0.28 -0.86 0.00 0.00 -0.26 0.00 0.00 64.21 63.37 2ja5 n SER 61 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2ja5 n SER 62 N 1.59 0.00 -1.82 4.04 3.41 -1.26 -4.62 113.62 114.95 2ja5 n SER 62 Ca 0.25 0.00 -0.06 0.00 -0.26 0.00 0.00 58.87 58.79 2ja5 n SER 62 Cb 0.37 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.24 2ja5 n SER 62 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2ja5 n LEU 63 N 0.00 4.86 -0.04 1.04 4.77 -1.26 -4.16 117.00 122.21 2ja5 n LEU 63 Ca 0.00 -2.64 -0.04 0.00 -0.03 0.00 0.00 56.01 53.30 2ja5 n LEU 63 Cb 0.00 -1.19 -0.01 0.00 -2.33 0.00 0.00 43.42 39.89 2ja5 n LEU 63 CO 0.00 1.26 -0.31 0.59 -1.33 0.00 0.00 177.39 177.60 2ja5 n ASN 64 N 2.10 0.88 -0.11 -1.43 3.02 -1.26 -4.23 115.26 114.24 2ja5 n ASN 64 Ca 0.22 0.15 -0.01 0.00 -0.03 0.00 0.00 54.58 54.91 2ja5 n ASN 64 Cb 0.68 -0.61 -0.01 0.00 -0.61 0.00 0.00 39.78 39.23 2ja5 n ASN 64 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2ja5 n LEU 65 N -3.39 0.07 0.00 3.41 4.77 -1.26 -4.74 117.00 115.86 2ja5 n LEU 65 Ca -0.06 0.03 0.00 0.00 -0.03 0.00 0.00 56.01 55.95 2ja5 n LEU 65 Cb 0.24 -1.01 0.00 0.00 -2.33 0.00 0.00 43.42 40.32 2ja5 n LEU 65 CO 0.10 -0.25 0.00 0.41 -1.33 0.00 0.00 177.39 176.32 2ja5 n THR 76 N -2.78 0.00 -1.75 -5.08 -1.04 -1.26 -5.04 114.28 97.33 2ja5 n THR 76 Ca -0.01 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.00 2ja5 n THR 76 Cb 0.13 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.64 2ja5 n THR 76 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2ja5 n ARG 77 N 0.00 -4.90 -1.22 -2.82 1.74 -1.26 -4.87 116.66 103.33 2ja5 n ARG 77 Ca 0.00 3.64 -0.38 0.00 -0.77 0.00 0.00 57.85 60.34 2ja5 n ARG 77 Cb 0.00 -4.10 0.03 0.00 -1.02 0.00 0.00 32.46 27.37 2ja5 n ARG 77 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2ja5 n SER 78 N -0.67 -3.51 -4.63 0.55 3.41 -1.26 -4.91 113.62 102.61 2ja5 n SER 78 Ca 0.00 0.56 -0.40 0.00 -0.26 0.00 0.00 58.87 58.77 2ja5 n SER 78 Cb 0.00 -0.92 -0.07 0.00 -0.26 0.00 0.00 64.21 62.96 2ja5 n SER 78 CO 0.00 0.00 0.00 0.86 -0.16 0.00 0.00 175.04 175.74 2ja5 s TRP 79 N -1.96 3.29 0.08 7.33 -0.00 -1.26 -5.07 118.94 121.34 2ja5 s TRP 79 Ca 0.56 0.68 -0.17 0.00 -0.00 0.00 0.00 56.10 57.17 2ja5 s TRP 79 Cb -0.41 -2.72 -0.07 0.00 -0.00 0.00 0.00 33.47 30.28 2ja5 s TRP 79 CO 0.67 -0.25 0.53 1.03 -0.00 0.00 0.00 176.95 178.93 2ja5 s ARG 80 N 2.19 4.09 0.00 5.86 0.52 -1.26 -5.11 118.95 125.24 2ja5 s ARG 80 Ca 0.22 0.61 0.00 0.00 -0.52 0.00 0.00 55.73 56.04 2ja5 s ARG 80 Cb -0.16 -3.16 0.00 0.00 0.52 0.00 0.00 34.95 32.16 2ja5 s ARG 80 CO 0.09 0.61 0.00 -2.30 0.02 0.00 0.00 175.30 173.72 2ja5 n PRO 81 N 1.51 0.00 0.00 3.54 -0.02 -1.26 -5.05 135.00 133.72 2ja5 n PRO 81 Ca -0.10 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.38 2ja5 n PRO 81 Cb 0.51 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.99 2ja5 n PRO 81 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 2ja5 n PRO 82 N 0.00 0.00 0.00 0.52 -0.04 -1.26 -4.72 135.00 129.50 2ja5 n PRO 82 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2ja5 n PRO 82 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 2ja5 n PRO 82 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 2ja5 n GLN 83 N 0.00 0.00 0.00 0.54 6.02 -1.26 -4.53 117.38 118.15 2ja5 n GLN 83 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 2ja5 n GLN 83 Cb 0.00 -0.23 0.00 0.00 1.02 0.00 0.00 30.24 31.03 2ja5 n GLN 83 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2ja5 n ALA 84 N 0.00 1.21 0.08 -1.58 0.00 -1.26 -3.11 120.51 115.85 2ja5 n ALA 84 Ca 0.00 0.00 0.18 0.00 0.00 0.00 0.00 53.44 53.62 2ja5 n ALA 84 Cb 0.00 -1.00 0.72 0.00 0.00 0.00 0.00 19.45 19.17 2ja5 n ALA 84 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2ja5 h GLY 85 N 1.26 0.00 -0.08 0.00 0.00 -1.93 -1.01 103.07 101.32 2ja5 h GLY 85 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2ja5 h GLY 85 CO 0.00 0.00 -0.04 1.34 0.00 0.00 0.00 176.54 177.84 2ja5 n ASP 86 N -4.22 1.55 -4.17 0.19 -0.08 -1.18 -5.06 116.55 103.58 2ja5 n ASP 86 Ca 0.06 -2.06 -0.15 0.00 -1.51 0.00 0.00 54.79 51.13 2ja5 n ASP 86 Cb 0.49 -0.11 0.04 0.00 2.34 0.00 0.00 41.12 43.88 2ja5 n ASP 86 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 2ja5 n ARG 87 N -0.58 0.73 -1.13 -0.67 1.74 -0.38 -5.07 116.66 111.30 2ja5 n ARG 87 Ca 0.04 -2.36 -0.36 0.00 -0.77 0.00 0.00 57.85 54.40 2ja5 n ARG 87 Cb 0.42 -0.11 0.07 0.00 -1.02 0.00 0.00 32.46 31.82 2ja5 n ARG 87 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 2ja5 n SER 88 N -2.41 -2.05 -2.74 0.55 3.41 -1.26 -4.90 113.62 104.22 2ja5 n SER 88 Ca 0.10 0.50 -0.06 0.00 -0.26 0.00 0.00 58.87 59.15 2ja5 n SER 88 Cb 0.45 -1.14 0.04 0.00 -0.26 0.00 0.00 64.21 63.29 2ja5 n SER 88 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2ja5 n LEU 89 N 0.06 -2.92 -0.67 1.04 4.77 -1.26 -4.92 117.00 113.09 2ja5 n LEU 89 Ca 0.08 -2.91 0.00 0.00 -0.03 0.00 0.00 56.01 53.15 2ja5 n LEU 89 Cb 0.51 0.77 0.00 0.00 -2.33 0.00 0.00 43.42 42.37 2ja5 n LEU 89 CO 0.51 1.90 0.09 0.00 -1.33 0.00 0.00 177.39 178.56 2ja5 n ALA 90 N 2.19 1.54 -0.78 -1.18 0.00 -1.26 -3.89 120.51 117.14 2ja5 n ALA 90 Ca 0.12 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.36 2ja5 n ALA 90 Cb 0.61 -1.00 0.12 0.00 0.00 0.00 0.00 19.45 19.18 2ja5 n ALA 90 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2ja5 n ASP 91 N 0.54 4.41 -0.96 0.00 5.75 -1.26 -4.66 116.55 120.37 2ja5 n ASP 91 Ca 0.00 -3.26 0.00 0.00 -0.01 0.00 0.00 54.79 51.52 2ja5 n ASP 91 Cb 0.09 -0.82 0.00 0.00 -1.03 0.00 0.00 41.12 39.37 2ja5 n ASP 91 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 2ja5 n ASP 92 N -0.63 1.08 -0.06 -1.12 8.00 -1.25 -4.63 116.55 117.93 2ja5 n ASP 92 Ca 0.45 -0.76 0.00 0.00 0.71 0.00 0.00 54.79 55.19 2ja5 n ASP 92 Cb 1.20 -0.19 0.00 0.00 -0.02 0.00 0.00 41.12 42.11 2ja5 n ASP 92 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2ja5 n TYR 93 N 0.77 0.00 -0.37 1.24 4.02 -1.26 -4.98 117.16 116.58 2ja5 n TYR 93 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 2ja5 n TYR 93 Cb 0.18 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.50 2ja5 n TYR 93 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 2ja5 n ASP 94 N -0.06 0.43 -3.39 7.72 8.00 0.64 -4.98 116.55 124.91 2ja5 n ASP 94 Ca 0.00 -0.85 -0.03 0.00 0.71 0.00 0.00 54.79 54.62 2ja5 n ASP 94 Cb 0.00 0.11 -0.05 0.00 -0.02 0.00 0.00 41.12 41.16 2ja5 n ASP 94 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 2ja5 s TYR 95 N -0.11 -1.17 -0.20 1.24 6.04 -1.07 -4.90 117.35 117.19 2ja5 s TYR 95 Ca 0.00 1.50 -0.00 0.00 0.04 0.00 0.00 57.07 58.61 2ja5 s TYR 95 Cb 0.00 0.38 0.05 0.00 -1.04 0.00 0.00 41.96 41.36 2ja5 s TYR 95 CO 0.00 -0.72 -0.05 0.08 -1.54 0.00 0.00 175.55 173.32 2ja5 s VAL 96 N 2.72 1.27 0.52 3.14 1.01 -1.26 -1.15 120.40 126.64 2ja5 s VAL 96 Ca 0.10 -0.90 0.07 0.00 0.00 0.00 0.00 61.98 61.24 2ja5 s VAL 96 Cb -0.14 -1.51 0.03 0.00 0.00 0.00 0.00 36.38 34.76 2ja5 s VAL 96 CO -0.17 -0.00 0.46 -0.04 0.00 0.00 0.00 175.10 175.34 2ja5 s MET 97 N 1.54 2.33 -0.24 2.72 -1.94 -0.57 -4.91 119.30 118.22 2ja5 s MET 97 Ca -0.02 -1.84 -0.08 0.00 -1.71 0.00 0.00 55.69 52.04 2ja5 s MET 97 Cb -0.17 -2.26 0.11 0.00 2.01 0.00 0.00 34.83 34.52 2ja5 s MET 97 CO -0.07 -0.55 0.51 -0.47 -0.01 0.00 0.00 175.02 174.43 2ja5 s TYR 98 N -2.68 -1.03 0.00 -0.03 5.04 -1.26 -1.02 117.35 116.37 2ja5 s TYR 98 Ca 0.42 1.86 0.00 0.00 -2.44 0.00 0.00 57.07 56.91 2ja5 s TYR 98 Cb -0.03 0.51 0.00 0.00 0.35 0.00 0.00 41.96 42.79 2ja5 s TYR 98 CO 0.26 -0.56 0.00 0.41 -1.34 0.00 0.00 175.55 174.31 2ja5 n GLY 99 N 5.42 4.75 3.23 8.97 0.00 -1.25 -4.56 105.19 121.76 2ja5 n GLY 99 Ca -0.10 -1.04 -0.13 0.00 0.00 0.00 0.00 46.02 44.75 2ja5 n GLY 99 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ja5 s THR 100 N -0.24 0.95 -0.08 2.61 2.01 0.24 -4.07 115.64 117.06 2ja5 s THR 100 Ca 0.00 -2.01 -0.01 0.00 0.31 0.00 0.00 61.69 59.98 2ja5 s THR 100 Cb 0.00 -1.90 -0.03 0.00 0.01 0.00 0.00 72.50 70.58 2ja5 s THR 100 CO 0.00 -0.69 -0.02 0.00 -0.69 0.00 0.00 174.62 173.21 2ja5 s ALA 101 N -3.47 3.18 -0.22 7.40 0.00 -1.26 0.40 121.76 127.78 2ja5 s ALA 101 Ca 0.18 -0.83 -0.08 0.00 0.00 0.00 0.00 51.96 51.23 2ja5 s ALA 101 Cb 0.04 -1.41 -0.11 0.00 0.00 0.00 0.00 23.12 21.65 2ja5 s ALA 101 CO 0.00 0.56 -0.26 2.48 0.00 0.00 0.00 175.76 178.55 2ja5 n TYR 102 N 2.24 0.00 -4.31 0.00 -0.00 -1.18 -4.87 117.16 109.04 2ja5 n TYR 102 Ca -0.18 0.00 -0.23 0.00 -0.00 0.00 0.00 57.90 57.49 2ja5 n TYR 102 Cb 0.53 -0.79 -0.12 0.00 -0.00 0.00 0.00 39.34 38.96 2ja5 n TYR 102 CO 0.00 0.00 0.00 0.21 -0.00 0.00 0.00 176.86 177.07 2ja5 s LYS 103 N -2.41 1.19 -0.72 -3.48 2.20 -1.26 -5.03 119.74 110.24 2ja5 s LYS 103 Ca -0.30 -1.27 0.04 0.00 -0.36 0.00 0.00 55.97 54.08 2ja5 s LYS 103 Cb 0.11 -1.38 0.21 0.00 -1.51 0.00 0.00 37.83 35.26 2ja5 s LYS 103 CO 0.41 0.30 0.67 1.19 -0.36 0.00 0.00 175.35 177.56 2ja5 n PHE 104 N 0.74 3.49 -2.13 4.03 3.01 -1.26 -2.02 117.46 123.32 2ja5 n PHE 104 Ca -0.17 -4.17 -0.34 0.00 1.01 0.00 0.00 57.45 53.78 2ja5 n PHE 104 Cb 0.55 -0.68 0.01 0.00 -0.01 0.00 0.00 39.48 39.35 2ja5 n PHE 104 CO 0.00 0.00 0.00 -2.00 1.01 0.00 0.00 176.76 175.77 2ja5 s GLU 105 N -1.93 3.21 -0.57 -1.08 2.12 -0.83 -4.89 118.70 114.74 2ja5 s GLU 105 Ca 0.31 1.55 -0.06 0.00 0.36 0.00 0.00 54.97 57.13 2ja5 s GLU 105 Cb 0.04 -1.99 0.15 0.00 0.26 0.00 0.00 34.13 32.58 2ja5 s GLU 105 CO -0.09 -0.95 0.42 -1.21 -0.54 0.00 0.00 175.26 172.89 2ja5 s GLU 106 N -3.50 2.58 -1.28 4.30 2.02 -1.26 -1.87 118.70 119.69 2ja5 s GLU 106 Ca 0.71 -2.20 -0.14 0.00 0.02 0.00 0.00 54.97 53.36 2ja5 s GLU 106 Cb -0.23 -3.85 -0.04 0.00 0.10 0.00 0.00 34.13 30.11 2ja5 s GLU 106 CO 0.31 -1.18 2.29 0.28 0.02 0.00 0.00 175.26 176.98 2ja5 n VAL 107 N 4.11 3.14 -0.81 2.63 0.31 0.14 -4.91 118.33 122.94 2ja5 n VAL 107 Ca 0.03 -2.43 0.06 0.00 -0.01 0.00 0.00 64.34 61.99 2ja5 n VAL 107 Cb 0.40 -2.49 -0.02 0.00 -0.91 0.00 0.00 33.84 30.82 2ja5 n VAL 107 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 2ja5 n SER 108 N 5.71 -2.81 0.00 4.52 3.41 -1.26 -4.32 113.62 118.87 2ja5 n SER 108 Ca 0.56 0.36 0.00 0.00 -0.26 0.00 0.00 58.87 59.53 2ja5 n SER 108 Cb 0.33 -2.57 0.00 0.00 -0.26 0.00 0.00 64.21 61.71 2ja5 n SER 108 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2ja5 n LYS 109 N -2.86 0.00 -2.50 4.33 5.02 -1.26 -1.61 118.16 119.28 2ja5 n LYS 109 Ca -0.02 0.00 -0.32 0.00 -2.02 0.00 0.00 58.31 55.95 2ja5 n LYS 109 Cb 0.51 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.52 2ja5 n LYS 109 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 2ja5 n ASP 110 N 1.65 5.71 -3.98 4.39 5.75 -1.26 -4.97 116.55 123.83 2ja5 n ASP 110 Ca 0.00 -3.73 -0.31 0.00 -0.01 0.00 0.00 54.79 50.74 2ja5 n ASP 110 Cb 0.00 -0.73 -0.15 0.00 -1.03 0.00 0.00 41.12 39.20 2ja5 n ASP 110 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 2ja5 s LEU 111 N -3.77 3.37 -0.17 -2.12 1.43 -0.63 -4.66 118.68 112.12 2ja5 s LEU 111 Ca 0.48 -1.54 -0.06 0.00 -1.03 0.00 0.00 54.13 51.98 2ja5 s LEU 111 Cb 0.34 -1.38 -0.04 0.00 0.03 0.00 0.00 46.19 45.15 2ja5 s LEU 111 CO -0.22 -0.27 0.03 -0.63 0.23 0.00 0.00 176.35 175.48 2ja5 s ILE 112 N 1.20 4.44 -0.06 -0.59 1.01 -1.17 0.25 121.20 126.28 2ja5 s ILE 112 Ca -0.01 -0.16 0.03 0.00 0.00 0.00 0.00 60.65 60.51 2ja5 s ILE 112 Cb -0.19 -2.98 0.01 0.00 0.01 0.00 0.00 42.46 39.30 2ja5 s ILE 112 CO -0.08 0.47 -0.16 0.00 0.00 0.00 0.00 174.94 175.17 2ja5 s ALA 113 N 0.40 1.49 -0.01 9.38 0.00 -0.78 -3.23 121.76 129.00 2ja5 s ALA 113 Ca 0.00 -0.58 0.03 0.00 0.00 0.00 0.00 51.96 51.41 2ja5 s ALA 113 Cb -0.13 -0.59 -0.03 0.00 0.00 0.00 0.00 23.12 22.37 2ja5 s ALA 113 CO 0.01 0.19 -0.09 0.14 0.00 0.00 0.00 175.76 176.01 2ja5 s VAL 114 N 0.43 3.46 -0.01 0.00 -7.23 -0.95 -1.96 120.40 114.14 2ja5 s VAL 114 Ca -0.12 -0.76 -0.04 0.00 -1.81 0.00 0.00 61.98 59.25 2ja5 s VAL 114 Cb -0.15 -2.46 -0.04 0.00 0.56 0.00 0.00 36.38 34.29 2ja5 s VAL 114 CO 0.04 0.46 0.20 -0.31 -0.31 0.00 0.00 175.10 175.18 2ja5 s TYR 115 N -0.91 3.56 0.15 2.82 1.51 -0.86 -1.84 117.35 121.78 2ja5 s TYR 115 Ca 0.15 0.42 0.06 0.00 -1.01 0.00 0.00 57.07 56.69 2ja5 s TYR 115 Cb -0.11 -1.88 -0.04 0.00 -0.11 0.00 0.00 41.96 39.82 2ja5 s TYR 115 CO 0.05 0.64 -0.12 0.71 -1.11 0.00 0.00 175.55 175.72 2ja5 s TYR 116 N -1.31 1.39 -0.13 2.71 1.51 0.59 -3.08 117.35 119.04 2ja5 s TYR 116 Ca 0.27 -0.66 -0.05 0.00 -1.01 0.00 0.00 57.07 55.61 2ja5 s TYR 116 Cb -0.13 -0.70 0.06 0.00 -0.11 0.00 0.00 41.96 41.09 2ja5 s TYR 116 CO 0.17 0.16 0.28 0.45 -1.11 0.00 0.00 175.55 175.50 2ja5 s SER 117 N -3.00 0.05 -0.95 2.29 0.15 0.16 -0.21 113.70 112.19 2ja5 s SER 117 Ca 0.16 0.62 -0.03 0.00 0.70 0.00 0.00 55.95 57.40 2ja5 s SER 117 Cb -0.00 0.66 0.24 0.00 -1.71 0.00 0.00 66.02 65.21 2ja5 s SER 117 CO 0.03 -0.21 0.89 0.49 1.20 0.00 0.00 173.24 175.64 2ja5 n PHE 118 N 4.92 4.39 -4.23 3.44 3.01 0.27 0.81 117.46 130.07 2ja5 n PHE 118 Ca -0.14 -4.02 -0.35 0.00 1.01 0.00 0.00 57.45 53.95 2ja5 n PHE 118 Cb 0.51 -1.26 -0.04 0.00 -0.01 0.00 0.00 39.48 38.68 2ja5 n PHE 118 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2ja5 n GLY 119 N 2.30 -0.36 0.00 1.37 0.00 -1.26 -1.90 105.19 105.34 2ja5 n GLY 119 Ca 0.23 0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.38 2ja5 n GLY 119 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ja5 n GLY 120 N -1.59 1.73 3.33 -0.02 0.00 -1.26 -5.07 105.19 102.31 2ja5 n GLY 120 Ca -0.04 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.61 2ja5 n GLY 120 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ja5 s LEU 121 N 0.00 4.08 0.80 0.99 1.43 -0.80 -5.08 118.68 120.10 2ja5 s LEU 121 Ca 0.00 -0.87 -0.09 0.00 -1.03 0.00 0.00 54.13 52.15 2ja5 s LEU 121 Cb 0.00 -1.89 0.13 0.00 0.03 0.00 0.00 46.19 44.45 2ja5 s LEU 121 CO 0.00 -0.25 1.12 -0.76 0.23 0.00 0.00 176.35 176.69 2ja5 s LEU 122 N 1.48 2.81 -0.12 1.79 1.43 -1.26 0.94 118.68 125.74 2ja5 s LEU 122 Ca 0.01 0.20 -0.30 0.00 -1.03 0.00 0.00 54.13 53.01 2ja5 s LEU 122 Cb -0.18 -2.55 0.11 0.00 0.03 0.00 0.00 46.19 43.60 2ja5 s LEU 122 CO 0.03 -2.07 0.91 -0.32 0.23 0.00 0.00 176.35 175.13 2ja5 s MET 123 N -5.46 0.72 -0.03 1.70 -2.45 0.70 -1.88 119.30 112.60 2ja5 s MET 123 Ca 0.67 0.14 -0.01 0.00 -1.25 0.00 0.00 55.69 55.24 2ja5 s MET 123 Cb -0.07 0.34 0.03 0.00 1.25 0.00 0.00 34.83 36.38 2ja5 s MET 123 CO 0.48 -0.23 0.05 0.50 1.05 0.00 0.00 175.02 176.87 2ja5 s ARG 124 N -1.26 -0.02 0.02 4.11 3.52 0.29 -0.30 118.95 125.31 2ja5 s ARG 124 Ca -0.03 0.24 0.09 0.00 -0.13 0.00 0.00 55.73 55.89 2ja5 s ARG 124 Cb -0.00 -0.26 -0.03 0.00 -1.56 0.00 0.00 34.95 33.10 2ja5 s ARG 124 CO 0.03 -0.19 -0.26 -1.17 -0.81 0.00 0.00 175.30 172.90 2ja5 s LEU 125 N 1.22 2.13 -0.03 -0.88 2.96 -0.77 -0.54 118.68 122.78 2ja5 s LEU 125 Ca -0.08 -0.55 0.01 0.00 -0.22 0.00 0.00 54.13 53.30 2ja5 s LEU 125 Cb -0.13 -1.28 0.02 0.00 0.50 0.00 0.00 46.19 45.30 2ja5 s LEU 125 CO -0.03 0.27 -0.01 -0.70 -1.32 0.00 0.00 176.35 174.56 2ja5 s GLU 126 N -1.02 0.33 0.00 1.98 2.12 -0.75 -2.24 118.70 119.11 2ja5 s GLU 126 Ca 0.11 0.03 0.00 0.00 0.36 0.00 0.00 54.97 55.47 2ja5 s GLU 126 Cb -0.10 -0.46 0.00 0.00 0.26 0.00 0.00 34.13 33.83 2ja5 s GLU 126 CO 0.01 -0.09 0.00 0.41 -0.54 0.00 0.00 175.26 175.05 2ja5 n GLY 127 N 3.91 -0.20 0.00 -1.50 0.00 -1.20 -2.00 105.19 104.20 2ja5 n GLY 127 Ca -0.24 0.47 0.00 0.00 0.00 0.00 0.00 46.02 46.25 2ja5 n GLY 127 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2ja5 n ASN 128 N 0.00 0.00 -1.35 1.61 2.85 -1.26 -3.04 115.26 114.06 2ja5 n ASN 128 Ca 0.00 0.00 0.08 0.00 -0.11 0.00 0.00 54.58 54.55 2ja5 n ASN 128 Cb 0.00 0.00 0.32 0.00 1.24 0.00 0.00 39.78 41.34 2ja5 n ASN 128 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2ja5 n TYR 129 N 0.00 1.31 -1.62 1.20 0.18 -1.26 -4.53 117.16 112.44 2ja5 n TYR 129 Ca 0.00 -0.66 -0.36 0.00 1.88 0.00 0.00 57.90 58.76 2ja5 n TYR 129 Cb 0.00 -0.26 0.06 0.00 -0.38 0.00 0.00 39.34 38.76 2ja5 n TYR 129 CO 0.00 0.00 0.00 0.54 -2.08 0.00 0.00 176.86 175.32 2ja5 n ARG 130 N 0.65 2.79 -0.16 -3.48 3.00 -1.26 -4.62 116.66 113.58 2ja5 n ARG 130 Ca 0.23 -3.47 -0.00 0.00 -0.01 0.00 0.00 57.85 54.60 2ja5 n ARG 130 Cb 0.87 -2.28 0.25 0.00 0.00 0.00 0.00 32.46 31.29 2ja5 n ARG 130 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.63 176.72 2ja5 h ASN 131 N 2.39 0.79 -0.05 0.55 2.35 -1.93 -2.61 115.58 117.08 2ja5 h ASN 131 Ca 0.57 -0.06 0.00 0.00 -0.55 0.00 0.00 56.30 56.26 2ja5 h ASN 131 Cb 0.57 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 38.74 2ja5 h ASN 131 CO 1.47 0.64 0.00 0.18 -1.65 0.00 0.00 177.43 178.07 2ja5 n LEU 132 N -4.37 2.38 -0.02 1.61 4.77 -1.26 -4.78 117.00 115.32 2ja5 n LEU 132 Ca 0.06 -2.58 -0.06 0.00 -0.03 0.00 0.00 56.01 53.40 2ja5 n LEU 132 Cb 0.10 -0.26 -0.02 0.00 -2.33 0.00 0.00 43.42 40.92 2ja5 n LEU 132 CO 0.37 0.63 -0.52 0.59 -1.33 0.00 0.00 177.39 177.13 2ja5 n ASN 133 N -0.85 1.01 -4.55 -1.43 3.02 -1.13 -4.95 115.26 106.38 2ja5 n ASN 133 Ca 0.10 0.16 -0.40 0.00 -0.03 0.00 0.00 54.58 54.41 2ja5 n ASN 133 Cb 0.49 -0.37 -0.03 0.00 -0.61 0.00 0.00 39.78 39.26 2ja5 n ASN 133 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 2ja5 s ASN 134 N -5.90 5.80 1.17 6.41 3.84 -1.00 -4.89 114.94 120.37 2ja5 s ASN 134 Ca -0.11 -0.17 -0.10 0.00 0.21 0.00 0.00 52.86 52.69 2ja5 s ASN 134 Cb 0.03 -2.55 0.15 0.00 -0.55 0.00 0.00 41.25 38.33 2ja5 s ASN 134 CO 0.15 -2.06 0.39 0.18 -2.79 0.00 0.00 177.10 172.96 2ja5 n LEU 135 N 10.80 0.00 0.00 3.21 4.77 -1.26 -4.95 117.00 129.57 2ja5 n LEU 135 Ca 0.11 -0.40 0.00 0.00 -0.03 0.00 0.00 56.01 55.70 2ja5 n LEU 135 Cb 0.50 -0.41 0.00 0.00 -2.33 0.00 0.00 43.42 41.18 2ja5 n LEU 135 CO 0.71 -1.87 0.13 0.29 -1.33 0.00 0.00 177.39 175.31 2ja5 n LYS 136 N -3.35 2.78 -0.82 3.23 5.02 -1.26 -5.06 118.16 118.69 2ja5 n LYS 136 Ca 0.06 -0.25 -0.30 0.00 -2.02 0.00 0.00 58.31 55.80 2ja5 n LYS 136 Cb 0.24 -0.75 0.25 0.00 -0.02 0.00 0.00 35.03 34.76 2ja5 n LYS 136 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 2ja5 s GLN 137 N -0.47 -1.71 -0.04 1.97 -0.21 -1.26 -4.82 119.66 113.12 2ja5 s GLN 137 Ca 0.00 0.08 -0.16 0.00 0.02 0.00 0.00 55.36 55.30 2ja5 s GLN 137 Cb 0.00 -1.53 -0.09 0.00 1.00 0.00 0.00 33.01 32.40 2ja5 s GLN 137 CO 0.00 -4.06 0.65 1.49 -2.12 0.00 0.00 175.29 171.25 2ja5 h GLU 138 N -2.83 -0.52 -5.00 2.91 4.81 -1.89 -3.38 114.58 108.66 2ja5 h GLU 138 Ca -0.46 0.04 -0.71 0.00 -0.13 0.00 0.00 59.36 58.10 2ja5 h GLU 138 Cb 1.31 0.12 0.02 0.00 0.63 0.00 0.00 28.75 30.83 2ja5 h GLU 138 CO 0.34 -0.34 0.39 0.09 -0.73 0.00 0.00 179.01 178.76 2ja5 n ASN 139 N -5.14 0.65 -2.66 1.04 3.02 -1.26 -4.24 115.26 106.67 2ja5 n ASN 139 Ca -0.07 0.98 -0.04 0.00 -0.03 0.00 0.00 54.58 55.43 2ja5 n ASN 139 Cb 0.22 -0.75 0.05 0.00 -0.61 0.00 0.00 39.78 38.70 2ja5 n ASN 139 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2ja5 n ALA 140 N 2.59 -3.93 -1.76 5.41 0.00 -1.26 -4.75 120.51 116.81 2ja5 n ALA 140 Ca 0.23 0.05 -0.40 0.00 0.00 0.00 0.00 53.44 53.32 2ja5 n ALA 140 Cb -0.01 -3.48 -0.04 0.00 0.00 0.00 0.00 19.45 15.92 2ja5 n ALA 140 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2ja5 s TYR 141 N 0.62 3.45 0.04 0.00 1.51 -0.92 -3.76 117.35 118.29 2ja5 s TYR 141 Ca 0.24 1.65 0.05 0.00 -1.01 0.00 0.00 57.07 58.00 2ja5 s TYR 141 Cb 0.17 -3.32 -0.04 0.00 -0.11 0.00 0.00 41.96 38.67 2ja5 s TYR 141 CO -0.10 -0.75 -0.09 -1.17 -1.11 0.00 0.00 175.55 172.33 2ja5 s LEU 142 N -1.70 3.04 0.06 -1.29 2.96 -0.19 -3.96 118.68 117.60 2ja5 s LEU 142 Ca 0.47 -0.27 0.02 0.00 -0.22 0.00 0.00 54.13 54.14 2ja5 s LEU 142 Cb -0.32 -1.78 -0.03 0.00 0.50 0.00 0.00 46.19 44.56 2ja5 s LEU 142 CO 0.41 0.24 -0.08 -0.76 -1.32 0.00 0.00 176.35 174.84 2ja5 s LEU 143 N -1.68 2.34 -0.05 -0.68 1.02 -1.05 -1.52 118.68 117.06 2ja5 s LEU 143 Ca 0.18 -0.70 -0.07 0.00 0.02 0.00 0.00 54.13 53.56 2ja5 s LEU 143 Cb -0.11 -0.15 0.02 0.00 0.02 0.00 0.00 46.19 45.96 2ja5 s LEU 143 CO 0.09 -0.28 0.19 -0.63 0.02 0.00 0.00 176.35 175.75 2ja5 s ILE 144 N -2.08 0.02 0.02 -0.59 1.01 -0.30 -2.38 121.20 116.91 2ja5 s ILE 144 Ca -0.03 -0.19 -0.01 0.00 0.00 0.00 0.00 60.65 60.42 2ja5 s ILE 144 Cb -0.05 -0.34 -0.02 0.00 0.01 0.00 0.00 42.46 42.06 2ja5 s ILE 144 CO -0.01 -0.11 -0.01 0.00 0.00 0.00 0.00 174.94 174.81 2ja5 s ARG 145 N -0.33 0.37 0.00 2.79 1.70 -1.13 -0.26 118.95 122.08 2ja5 s ARG 145 Ca -0.04 -0.68 0.00 0.00 -0.47 0.00 0.00 55.73 54.54 2ja5 s ARG 145 Cb -0.03 0.13 0.00 0.00 -0.57 0.00 0.00 34.95 34.48 2ja5 s ARG 145 CO 0.01 -0.07 0.00 0.54 -1.08 0.00 0.00 175.30 174.70