#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ju4 n ASN 2 N 0.00 0.00 0.00 3.17 2.85 -1.26 -4.95 115.26 115.07 2ju4 n ASN 2 Ca 0.00 -0.51 0.01 0.00 -0.11 0.00 0.00 54.58 53.97 2ju4 n ASN 2 Cb 0.00 0.00 0.04 0.00 1.24 0.00 0.00 39.78 41.06 2ju4 n ASN 2 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 2ju4 n LEU 3 N 0.00 0.00 -4.64 1.20 4.32 -1.26 -4.76 117.00 111.86 2ju4 n LEU 3 Ca 0.00 0.00 -0.53 0.00 -0.02 0.00 0.00 56.01 55.46 2ju4 n LEU 3 Cb 0.00 0.00 -0.06 0.00 -1.62 0.00 0.00 43.42 41.74 2ju4 n LEU 3 CO 0.00 0.00 1.09 1.21 -1.22 0.00 0.00 177.39 178.47 2ju4 n GLU 4 N -0.69 1.32 -1.11 3.23 0.00 -1.26 -4.83 120.64 117.29 2ju4 n GLU 4 Ca 0.01 0.48 -0.37 0.00 0.00 0.00 0.00 57.16 57.28 2ju4 n GLU 4 Cb 0.01 -2.16 0.03 0.00 0.00 0.00 0.00 31.44 29.31 2ju4 n GLU 4 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.13 174.83 2ju4 n PRO 5 N 3.69 0.00 -2.09 5.31 -0.02 -1.26 -4.91 135.00 135.71 2ju4 n PRO 5 Ca 0.21 0.00 -0.33 0.00 -2.02 0.00 0.00 63.50 61.36 2ju4 n PRO 5 Cb 0.19 -0.99 0.01 0.00 -0.02 0.00 0.00 33.50 32.68 2ju4 n PRO 5 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2ju4 s PRO 6 N -1.51 3.37 0.00 0.52 0.04 -1.26 -4.90 135.00 131.26 2ju4 s PRO 6 Ca 0.48 1.21 0.00 0.00 0.04 0.00 0.00 61.00 62.73 2ju4 s PRO 6 Cb -0.33 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.17 2ju4 s PRO 6 CO 0.74 -0.77 0.00 0.36 0.04 0.00 0.00 177.00 177.38 2ju4 n LYS 7 N -1.93 0.00 -2.15 4.56 2.85 -1.26 -5.12 118.16 115.11 2ju4 n LYS 7 Ca 0.09 0.00 -0.42 0.00 -1.05 0.00 0.00 58.31 56.93 2ju4 n LYS 7 Cb 0.53 0.00 -0.03 0.00 -0.65 0.00 0.00 35.03 34.88 2ju4 n LYS 7 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2ju4 s ALA 8 N 0.00 3.60 0.01 0.58 0.00 -1.26 -5.15 121.76 119.54 2ju4 s ALA 8 Ca 0.00 1.09 -0.17 0.00 0.00 0.00 0.00 51.96 52.88 2ju4 s ALA 8 Cb 0.00 -3.56 -0.10 0.00 0.00 0.00 0.00 23.12 19.46 2ju4 s ALA 8 CO 0.00 -0.72 0.99 1.05 0.00 0.00 0.00 175.76 177.08 2ju4 h GLU 9 N 7.12 -0.60 0.00 0.00 9.09 -2.05 -3.53 114.58 124.62 2ju4 h GLU 9 Ca -0.41 0.04 0.00 0.00 0.05 0.00 0.00 59.36 59.04 2ju4 h GLU 9 Cb 1.20 0.14 0.00 0.00 -1.65 0.00 0.00 28.75 28.44 2ju4 h GLU 9 CO 0.88 -0.40 0.00 -2.13 0.05 0.00 0.00 179.01 177.41 2ju4 n ARG 11 N -4.15 0.00 0.00 1.06 0.63 -1.26 -5.17 116.66 107.77 2ju4 n ARG 11 Ca -0.08 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.85 2ju4 n ARG 11 Cb 0.25 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.16 2ju4 n ARG 11 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 2ju4 n SER 12 N -1.67 0.00 -4.65 6.15 2.88 -1.26 -5.13 113.62 109.94 2ju4 n SER 12 Ca 0.00 0.00 -0.31 0.00 -1.33 0.00 0.00 58.87 57.23 2ju4 n SER 12 Cb 0.00 0.00 0.17 0.00 -0.75 0.00 0.00 64.21 63.63 2ju4 n SER 12 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2ju4 n ALA 13 N 0.00 -0.97 -1.00 -1.46 0.00 -1.26 -5.01 120.51 110.81 2ju4 n ALA 13 Ca 0.00 -0.60 0.00 0.00 0.00 0.00 0.00 53.44 52.84 2ju4 n ALA 13 Cb 0.00 -2.18 0.00 0.00 0.00 0.00 0.00 19.45 17.27 2ju4 n ALA 13 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2ju4 n THR 14 N -4.30 0.00 0.09 0.00 -2.24 -1.26 -5.07 114.28 101.50 2ju4 n THR 14 Ca 0.11 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.89 2ju4 n THR 14 Cb 0.52 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.75 2ju4 n THR 14 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 2ju4 n ARG 15 N 0.00 0.00 -2.74 -0.78 0.00 -1.26 -5.08 116.66 106.81 2ju4 n ARG 15 Ca 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 57.85 57.81 2ju4 n ARG 15 Cb 0.00 0.00 0.02 0.00 0.00 0.00 0.00 32.46 32.48 2ju4 n ARG 15 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.63 179.18 2ju4 n VAL 16 N -2.86 0.00 0.00 5.15 3.14 -1.26 -4.83 118.33 117.67 2ju4 n VAL 16 Ca 0.00 -0.84 0.00 0.00 -2.96 0.00 0.00 64.34 60.54 2ju4 n VAL 16 Cb 0.00 0.94 0.00 0.00 -1.06 0.00 0.00 33.84 33.72 2ju4 n VAL 16 CO 0.00 0.00 0.00 0.23 -6.46 0.00 0.00 176.83 170.60 2ju4 n MET 17 N 2.76 0.00 0.00 1.45 2.81 -1.26 -3.88 117.12 118.99 2ju4 n MET 17 Ca 0.16 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.05 2ju4 n MET 17 Cb 0.59 0.00 0.00 0.00 -0.71 0.00 0.00 33.22 33.10 2ju4 n MET 17 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2ju4 n GLY 18 N 0.00 -1.34 0.44 3.03 0.00 -1.26 -5.00 105.19 101.06 2ju4 n GLY 18 Ca 0.00 0.46 -0.14 0.00 0.00 0.00 0.00 46.02 46.34 2ju4 n GLY 18 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2ju4 h GLY 19 N 0.00 -1.07 -4.45 -0.02 0.00 -2.05 -3.35 103.07 92.13 2ju4 h GLY 19 Ca 0.00 0.71 0.00 0.00 0.00 0.00 0.00 47.33 48.04 2ju4 h GLY 19 CO 0.00 -0.16 0.00 -1.05 0.00 0.00 0.00 176.54 175.33 2ju4 n PRO 20 N -5.28 0.00 -3.86 4.80 -0.02 -1.26 -4.89 135.00 124.48 2ju4 n PRO 20 Ca -0.04 0.00 -0.29 0.00 -2.02 0.00 0.00 63.50 61.15 2ju4 n PRO 20 Cb 0.34 -0.85 -0.16 0.00 -0.02 0.00 0.00 33.50 32.80 2ju4 n PRO 20 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 2ju4 s THR 22 N 0.67 1.09 0.54 3.45 2.01 -1.26 -5.30 115.64 116.84 2ju4 s THR 22 Ca 0.00 -0.80 -0.12 0.00 0.31 0.00 0.00 61.69 61.08 2ju4 s THR 22 Cb 0.00 -1.38 -0.05 0.00 0.01 0.00 0.00 72.50 71.07 2ju4 s THR 22 CO 0.00 -0.04 0.95 -2.16 -0.69 0.00 0.00 174.62 172.68 2ju4 s PRO 23 N 1.62 3.72 0.38 4.92 0.04 -1.26 -4.85 135.00 139.57 2ju4 s PRO 23 Ca -0.02 0.70 0.00 0.00 0.04 0.00 0.00 61.00 61.72 2ju4 s PRO 23 Cb -0.17 -2.18 0.00 0.00 0.04 0.00 0.00 34.50 32.19 2ju4 s PRO 23 CO -0.07 -0.36 0.00 -2.13 0.04 0.00 0.00 177.00 174.48 2ju4 n ARG 24 N -2.14 -5.16 0.08 4.56 0.00 -0.82 -5.03 116.66 108.15 2ju4 n ARG 24 Ca 0.05 3.72 0.00 0.00 -0.00 0.00 0.00 57.85 61.62 2ju4 n ARG 24 Cb 0.54 -4.13 0.00 0.00 0.00 0.00 0.00 32.46 28.87 2ju4 n ARG 24 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 2ju4 n LYS 25 N 0.51 0.00 -1.37 -0.14 4.01 -1.26 -5.08 118.16 114.83 2ju4 n LYS 25 Ca 0.00 0.00 -0.01 0.00 -0.51 0.00 0.00 58.31 57.79 2ju4 n LYS 25 Cb 0.00 -0.17 0.00 0.00 -0.51 0.00 0.00 35.03 34.35 2ju4 n LYS 25 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2ju4 n GLY 26 N 2.13 2.47 3.34 0.72 0.00 -1.26 -5.15 105.19 107.44 2ju4 n GLY 26 Ca 0.00 -1.19 -0.35 0.00 0.00 0.00 0.00 46.02 44.48 2ju4 n GLY 26 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2ju4 n PRO 27 N -0.02 0.04 -1.38 1.61 -0.02 -1.26 -4.81 135.00 129.15 2ju4 n PRO 27 Ca -0.00 0.05 -0.45 0.00 -2.02 0.00 0.00 63.50 61.07 2ju4 n PRO 27 Cb 0.03 -1.60 -0.02 0.00 -0.02 0.00 0.00 33.50 31.89 2ju4 n PRO 27 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2ju4 n PRO 28 N -0.20 0.12 -3.69 0.52 -0.02 -1.26 -5.04 135.00 125.43 2ju4 n PRO 28 Ca 0.06 0.04 -0.12 0.00 -2.02 0.00 0.00 63.50 61.47 2ju4 n PRO 28 Cb 0.52 -1.09 -0.12 0.00 -0.02 0.00 0.00 33.50 32.79 2ju4 n PRO 28 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2ju4 s LYS 29 N -1.08 0.23 0.00 -0.52 1.02 -1.26 -5.12 119.74 113.02 2ju4 s LYS 29 Ca 0.62 0.73 0.00 0.00 0.02 0.00 0.00 55.97 57.34 2ju4 s LYS 29 Cb -0.79 -0.01 0.00 0.00 -0.52 0.00 0.00 37.83 36.52 2ju4 s LYS 29 CO 0.59 -0.22 0.00 1.63 -0.92 0.00 0.00 175.35 176.43 2ju4 n LYS 31 N 4.82 0.00 -0.29 1.68 4.76 -1.26 -3.72 118.16 124.15 2ju4 n LYS 31 Ca -0.15 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.29 2ju4 n LYS 31 Cb 0.52 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.71 2ju4 n LYS 31 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 2ju4 n GLN 32 N 0.00 2.21 -3.10 1.97 6.02 -1.26 -5.12 117.38 118.10 2ju4 n GLN 32 Ca 0.00 0.00 0.05 0.00 -0.01 0.00 0.00 57.00 57.04 2ju4 n GLN 32 Cb 0.00 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.26 2ju4 n GLN 32 CO 0.00 0.00 0.00 -0.98 -1.01 0.00 0.00 177.06 175.07 2ju4 s ARG 33 N 1.20 0.23 -0.30 -1.09 1.70 -1.26 -4.92 118.95 114.50 2ju4 s ARG 33 Ca 0.00 0.15 -0.13 0.00 -0.47 0.00 0.00 55.73 55.28 2ju4 s ARG 33 Cb 0.00 0.08 0.17 0.00 -0.57 0.00 0.00 34.95 34.63 2ju4 s ARG 33 CO 0.00 -0.41 0.95 -1.14 -1.08 0.00 0.00 175.30 173.62 2ju4 s GLN 34 N 2.75 0.31 0.00 3.89 0.74 -1.11 -3.92 119.66 122.32 2ju4 s GLN 34 Ca 0.23 0.71 0.00 0.00 0.05 0.00 0.00 55.36 56.35 2ju4 s GLN 34 Cb -0.02 0.42 0.00 0.00 1.10 0.00 0.00 33.01 34.51 2ju4 s GLN 34 CO -0.22 -0.17 0.07 2.41 -0.55 0.00 0.00 175.29 176.83 2ju4 n THR 35 N 5.14 0.00 -1.94 -0.34 -1.04 -1.26 -4.65 114.28 110.19 2ju4 n THR 35 Ca -0.08 0.00 -0.21 0.00 -2.04 0.00 0.00 64.05 61.72 2ju4 n THR 35 Cb 0.52 0.00 -0.06 0.00 -1.82 0.00 0.00 70.33 68.98 2ju4 n THR 35 CO 0.00 0.00 0.00 -1.14 -0.64 0.00 0.00 175.07 173.29 2ju4 n ARG 36 N 0.00 -1.56 -3.08 -2.82 3.00 -1.26 -4.87 116.66 106.07 2ju4 n ARG 36 Ca 0.00 1.13 0.00 0.00 -0.00 0.00 0.00 57.85 58.98 2ju4 n ARG 36 Cb 0.34 -5.64 0.00 0.00 0.00 0.00 0.00 32.46 27.16 2ju4 n ARG 36 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.63 178.67 2ju4 n GLN 37 N -2.64 -0.46 -0.01 -0.14 1.13 -1.26 -4.91 117.38 109.10 2ju4 n GLN 37 Ca -0.22 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 54.84 2ju4 n GLN 37 Cb 0.68 0.00 -0.12 0.00 0.11 0.00 0.00 30.24 30.92 2ju4 n GLN 37 CO 0.00 0.00 0.00 0.36 -1.44 0.00 0.00 177.06 175.98 2ju4 n LYS 39 N 0.00 0.64 0.00 -1.09 2.85 -1.26 -3.65 118.16 115.65 2ju4 n LYS 39 Ca 0.00 0.08 0.00 0.00 -1.05 0.00 0.00 58.31 57.34 2ju4 n LYS 39 Cb 0.00 -1.68 0.00 0.00 -0.65 0.00 0.00 35.03 32.70 2ju4 n LYS 39 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 177.40 176.22 2ju4 n SER 40 N -2.72 0.00 -3.68 -5.58 3.41 -1.26 -5.07 113.62 98.72 2ju4 n SER 40 Ca -0.14 0.00 -0.28 0.00 -0.26 0.00 0.00 58.87 58.19 2ju4 n SER 40 Cb 0.85 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 64.68 2ju4 n SER 40 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2ju4 s LYS 41 N 0.00 1.58 0.59 4.33 -0.14 -1.26 -5.11 119.74 119.73 2ju4 s LYS 41 Ca 0.00 -2.51 -0.10 0.00 -1.36 0.00 0.00 55.97 52.01 2ju4 s LYS 41 Cb 0.00 -2.44 -0.04 0.00 -1.68 0.00 0.00 37.83 33.67 2ju4 s LYS 41 CO 0.00 -1.27 0.98 -1.25 -0.76 0.00 0.00 175.35 173.05 2ju4 s PRO 42 N -0.37 3.53 0.13 -1.68 0.04 -1.26 -5.03 135.00 130.36 2ju4 s PRO 42 Ca 0.25 0.60 -0.31 0.00 0.04 0.00 0.00 61.00 61.58 2ju4 s PRO 42 Cb -0.09 -2.14 -0.07 0.00 0.04 0.00 0.00 34.50 32.23 2ju4 s PRO 42 CO -0.12 -0.52 1.27 -1.25 0.04 0.00 0.00 177.00 176.42 2ju4 s PRO 43 N -5.09 4.41 0.10 0.56 0.04 -1.26 -4.91 135.00 128.84 2ju4 s PRO 43 Ca 0.53 1.92 0.23 0.00 0.04 0.00 0.00 61.00 63.73 2ju4 s PRO 43 Cb -0.11 -3.27 0.93 0.00 0.04 0.00 0.00 34.50 32.09 2ju4 s PRO 43 CO 0.52 -0.27 1.73 1.17 0.04 0.00 0.00 177.00 180.19 2ju4 n LYS 44 N 3.41 0.10 0.00 4.56 4.81 -1.26 -4.15 118.16 125.63 2ju4 n LYS 44 Ca 0.08 0.20 0.00 0.00 -0.87 0.00 0.00 58.31 57.72 2ju4 n LYS 44 Cb 0.44 -1.64 0.00 0.00 0.02 0.00 0.00 35.03 33.85 2ju4 n LYS 44 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 2ju4 n LYS 45 N -1.82 0.00 0.00 1.64 5.02 -1.26 -4.98 118.16 116.75 2ju4 n LYS 45 Ca 0.05 0.17 0.00 0.00 -2.02 0.00 0.00 58.31 56.50 2ju4 n LYS 45 Cb 0.29 -0.87 0.00 0.00 -0.02 0.00 0.00 35.03 34.43 2ju4 n LYS 45 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2ju4 n GLY 46 N -0.54 -1.45 3.61 0.72 0.00 -1.26 -5.10 105.19 101.17 2ju4 n GLY 46 Ca 0.00 0.54 -0.56 0.00 0.00 0.00 0.00 46.02 45.99 2ju4 n GLY 46 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 2ju4 n VAL 47 N 0.00 0.25 -3.59 1.61 3.14 -1.26 -4.91 118.33 113.57 2ju4 n VAL 47 Ca 0.00 -0.09 -0.26 0.00 -2.96 0.00 0.00 64.34 61.03 2ju4 n VAL 47 Cb 0.00 -1.24 -0.16 0.00 -1.06 0.00 0.00 33.84 31.37 2ju4 n VAL 47 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2ju4 s GLN 48 N 4.36 0.09 -0.47 1.45 -2.07 -1.26 -4.93 119.66 116.83 2ju4 s GLN 48 Ca 1.03 -0.13 0.06 0.00 -1.82 0.00 0.00 55.36 54.50 2ju4 s GLN 48 Cb -1.07 -1.67 0.27 0.00 -1.09 0.00 0.00 33.01 29.45 2ju4 s GLN 48 CO 0.63 -0.73 0.94 0.41 -1.32 0.00 0.00 175.29 175.22 2ju4 n GLY 49 N 5.28 0.46 0.00 2.60 0.00 -1.26 -4.91 105.19 107.35 2ju4 n GLY 49 Ca -0.07 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 45.92 2ju4 n GLY 49 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ju4 n GLY 51 N 1.17 2.00 2.69 -0.02 0.00 -1.25 -4.82 105.19 104.97 2ju4 n GLY 51 Ca 0.09 -0.62 -0.06 0.00 0.00 0.00 0.00 46.02 45.43 2ju4 n GLY 51 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2ju4 n ASP 52 N 0.00 -1.63 -0.38 1.61 -0.08 -1.24 -2.76 116.55 112.07 2ju4 n ASP 52 Ca 0.00 -2.43 0.00 0.00 -1.51 0.00 0.00 54.79 50.85 2ju4 n ASP 52 Cb 0.00 0.87 0.00 0.00 2.34 0.00 0.00 41.12 44.33 2ju4 n ASP 52 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65 2ju4 n ASP 53 N -0.72 0.42 -4.17 1.67 -0.08 -1.26 -4.47 116.55 107.95 2ju4 n ASP 53 Ca -0.05 -1.11 -0.39 0.00 -1.51 0.00 0.00 54.79 51.74 2ju4 n ASP 53 Cb 0.85 -0.21 -0.10 0.00 2.34 0.00 0.00 41.12 44.00 2ju4 n ASP 53 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 2ju4 s ILE 54 N -1.24 3.78 0.00 5.18 -1.09 -1.26 -4.96 121.20 121.61 2ju4 s ILE 54 Ca 0.00 -1.98 -0.00 0.00 -2.23 0.00 0.00 60.65 56.44 2ju4 s ILE 54 Cb 0.00 -3.53 -0.02 0.00 -1.58 0.00 0.00 42.46 37.33 2ju4 s ILE 54 CO 0.00 -0.75 2.07 -0.81 -1.23 0.00 0.00 174.94 174.23 2ju4 n PRO 55 N 4.68 1.05 0.00 2.79 -0.04 -1.26 -4.62 135.00 137.60 2ju4 n PRO 55 Ca -0.04 -0.08 0.00 0.00 -0.04 0.00 0.00 63.50 63.34 2ju4 n PRO 55 Cb 0.41 -1.09 0.00 0.00 -0.04 0.00 0.00 33.50 32.78 2ju4 n PRO 55 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2ju4 n GLY 56 N 1.60 -2.95 1.87 0.55 0.00 -1.26 -4.87 105.19 100.11 2ju4 n GLY 56 Ca 0.03 0.05 -0.01 0.00 0.00 0.00 0.00 46.02 46.10 2ju4 n GLY 56 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2ju4 n MET 57 N -0.71 0.13 0.00 1.61 1.56 -1.26 -5.04 117.12 113.42 2ju4 n MET 57 Ca 0.00 -0.24 0.00 0.00 -0.27 0.00 0.00 57.70 57.19 2ju4 n MET 57 Cb 0.00 0.03 0.00 0.00 2.15 0.00 0.00 33.22 35.40 2ju4 n MET 57 CO 0.00 0.00 0.00 0.39 -0.73 0.00 0.00 175.97 175.63 2ju4 n GLU 58 N -0.24 0.00 0.00 2.12 -0.58 -1.26 -5.03 120.64 115.65 2ju4 n GLU 58 Ca -0.08 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.66 2ju4 n GLU 58 Cb 0.56 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.43 2ju4 n GLU 58 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2ju4 n GLY 59 N 0.00 2.49 0.00 0.62 0.00 -1.24 -4.90 105.19 102.16 2ju4 n GLY 59 Ca 0.00 -1.63 0.00 0.00 0.00 0.00 0.00 46.02 44.39 2ju4 n GLY 59 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ju4 n GLY 61 N -1.78 0.36 2.04 -0.02 0.00 -1.26 -4.84 105.19 99.69 2ju4 n GLY 61 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2ju4 n GLY 61 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2ju4 n THR 62 N -0.60 0.00 -0.28 2.61 5.66 -1.26 -1.95 114.28 118.46 2ju4 n THR 62 Ca 0.00 0.00 0.04 0.00 -3.05 0.00 0.00 64.05 61.04 2ju4 n THR 62 Cb 0.00 -0.36 0.18 0.00 -1.55 0.00 0.00 70.33 68.60 2ju4 n THR 62 CO 0.00 0.00 0.00 -0.78 -3.05 0.00 0.00 175.07 171.24 2ju4 h ASP 63 N 0.00 0.60 0.10 1.09 1.82 -2.00 -2.60 116.42 115.43 2ju4 h ASP 63 Ca 0.00 0.06 -0.00 0.00 -0.39 0.00 0.00 57.03 56.70 2ju4 h ASP 63 Cb 0.00 -0.05 0.00 0.00 0.68 0.00 0.00 39.33 39.96 2ju4 h ASP 63 CO 0.00 0.32 -0.05 -0.29 -1.61 0.00 0.00 179.24 177.62 2ju4 h ILE 64 N 0.72 1.13 -1.33 2.25 2.10 -1.87 1.94 117.51 122.44 2ju4 h ILE 64 Ca 0.40 -1.21 0.39 0.00 1.08 0.00 0.00 64.86 65.52 2ju4 h ILE 64 Cb 0.43 1.86 -0.05 0.00 -1.09 0.00 0.00 36.82 37.97 2ju4 h ILE 64 CO -0.28 0.28 1.04 0.41 -1.08 0.00 0.00 178.15 178.52 2ju4 n THR 65 N -4.88 0.00 0.00 2.19 -1.04 -0.99 -1.40 114.28 108.16 2ju4 n THR 65 Ca -0.08 1.08 0.00 0.00 -2.04 0.00 0.00 64.05 63.01 2ju4 n THR 65 Cb 0.28 -1.84 0.00 0.00 -1.82 0.00 0.00 70.33 66.95 2ju4 n THR 65 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 2ju4 n VAL 66 N -3.29 0.00 -4.16 12.58 0.24 -1.17 -5.09 118.33 117.45 2ju4 n VAL 66 Ca 0.30 0.00 -0.16 0.00 -2.04 0.00 0.00 64.34 62.44 2ju4 n VAL 66 Cb 1.44 -0.55 -0.13 0.00 -1.47 0.00 0.00 33.84 33.14 2ju4 n VAL 66 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 2ju4 s ILE 67 N -1.76 0.69 0.16 1.34 1.01 0.66 -5.06 121.20 118.23 2ju4 s ILE 67 Ca 0.00 -0.88 0.01 0.00 0.00 0.00 0.00 60.65 59.78 2ju4 s ILE 67 Cb 0.00 -0.68 -0.16 0.00 0.01 0.00 0.00 42.46 41.63 2ju4 s ILE 67 CO 0.00 -0.16 1.36 -0.65 0.00 0.00 0.00 174.94 175.49 2ju4 h PRO 69 N 4.94 0.22 0.58 2.79 0.11 -1.93 -3.01 132.00 135.71 2ju4 h PRO 69 Ca -0.35 -0.25 -0.03 0.00 0.11 0.00 0.00 66.00 65.48 2ju4 h PRO 69 Cb 1.19 0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.38 2ju4 h PRO 69 CO 0.44 0.98 -0.30 2.35 -0.21 0.00 0.00 178.00 181.26 2ju4 h TRP 70 N 0.12 -0.78 -0.56 0.65 7.01 -2.00 -2.88 115.95 117.52 2ju4 h TRP 70 Ca -0.05 -0.02 0.10 0.00 2.11 0.00 0.00 58.89 61.03 2ju4 h TRP 70 Cb 1.53 0.26 -0.08 0.00 -2.10 0.00 0.00 29.16 28.77 2ju4 h TRP 70 CO 0.03 -0.47 0.11 0.93 -2.79 0.00 0.00 178.44 176.25 2ju4 h GLU 71 N -0.81 0.23 -1.01 2.65 4.39 -1.97 0.66 114.58 118.73 2ju4 h GLU 71 Ca -0.08 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.61 2ju4 h GLU 71 Cb 0.63 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.23 2ju4 h GLU 71 CO 0.12 0.15 0.00 0.00 -1.16 0.00 0.00 179.01 178.12 2ju4 n ALA 72 N -2.58 2.32 -1.99 3.43 0.00 -1.09 -4.69 120.51 115.91 2ju4 n ALA 72 Ca 0.07 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.31 2ju4 n ALA 72 Cb 0.29 -1.00 0.04 0.00 0.00 0.00 0.00 19.45 18.78 2ju4 n ALA 72 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 2ju4 s ASN 74 N 0.45 5.26 0.76 0.00 3.84 0.23 -5.09 114.94 120.39 2ju4 s ASN 74 Ca 0.00 -0.26 -0.05 0.00 0.21 0.00 0.00 52.86 52.76 2ju4 s ASN 74 Cb 0.00 -0.59 0.13 0.00 -0.55 0.00 0.00 41.25 40.24 2ju4 s ASN 74 CO 0.00 -1.13 1.05 -1.38 -2.79 0.00 0.00 177.10 172.85 2ju4 s HIS 75 N -2.67 1.89 0.00 0.43 -3.43 -1.26 -4.77 115.29 105.47 2ju4 s HIS 75 Ca 0.58 -0.02 0.00 0.00 -0.80 0.00 0.00 55.06 54.82 2ju4 s HIS 75 Cb -0.09 -3.24 0.00 0.00 -1.43 0.00 0.00 32.58 27.82 2ju4 s HIS 75 CO 0.38 -1.80 0.00 -0.85 -2.00 0.00 0.00 174.74 170.47 2ju4 n GLU 77 N -3.01 0.00 0.20 -0.38 0.00 -1.26 -4.94 120.64 111.25 2ju4 n GLU 77 Ca 0.13 0.00 -0.12 0.00 0.00 0.00 0.00 57.16 57.18 2ju4 n GLU 77 Cb 0.60 -1.24 -0.06 0.00 0.00 0.00 0.00 31.44 30.74 2ju4 n GLU 77 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.13 178.38 2ju4 h LEU 78 N 0.00 -0.90 0.00 -1.84 7.12 -2.01 -3.43 115.31 114.25 2ju4 h LEU 78 Ca 0.00 0.07 -0.38 0.00 0.13 0.00 0.00 57.88 57.70 2ju4 h LEU 78 Cb 0.00 0.30 0.08 0.00 -0.53 0.00 0.00 40.66 40.51 2ju4 h LEU 78 CO 0.00 -0.44 0.14 1.41 -0.13 0.00 0.00 178.44 179.42 2ju4 n HIS 79 N -4.38 -3.16 0.00 1.25 -0.00 -1.26 -5.09 115.22 102.58 2ju4 n HIS 79 Ca -0.08 -1.40 0.00 0.00 -0.00 0.00 0.00 57.72 56.24 2ju4 n HIS 79 Cb 0.30 -0.65 0.00 0.00 -0.00 0.00 0.00 29.99 29.64 2ju4 n HIS 79 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.34 176.73 2ju4 n GLU 80 N -2.68 0.00 0.00 -0.41 1.02 -1.26 -4.75 120.64 112.57 2ju4 n GLU 80 Ca 0.14 0.00 0.12 0.00 -0.02 0.00 0.00 57.16 57.40 2ju4 n GLU 80 Cb 0.49 0.00 0.62 0.00 -0.02 0.00 0.00 31.44 32.54 2ju4 n GLU 80 CO 0.00 0.00 0.00 1.47 1.18 0.00 0.00 177.13 179.78 2ju4 n LEU 81 N 0.00 0.00 0.00 -4.62 -0.00 -1.26 -3.92 117.00 107.20 2ju4 n LEU 81 Ca 0.00 0.28 0.00 0.00 -0.00 0.00 0.00 56.01 56.29 2ju4 n LEU 81 Cb 0.00 -0.28 0.00 0.00 -0.00 0.00 0.00 43.42 43.14 2ju4 n LEU 81 CO 0.00 -0.05 0.30 0.00 -0.00 0.00 0.00 177.39 177.63 2ju4 n ALA 82 N -1.28 -0.30 -3.21 1.47 0.00 -1.26 -4.81 120.51 111.12 2ju4 n ALA 82 Ca 0.12 0.00 -0.19 0.00 0.00 0.00 0.00 53.44 53.37 2ju4 n ALA 82 Cb 0.19 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.66 2ju4 n ALA 82 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 2ju4 n GLN 83 N -2.00 -1.79 -0.90 0.00 7.27 -1.25 -0.04 117.38 118.67 2ju4 n GLN 83 Ca 0.00 1.56 -0.05 0.00 0.07 0.00 0.00 57.00 58.58 2ju4 n GLN 83 Cb 0.00 -2.87 -0.02 0.00 2.41 0.00 0.00 30.24 29.76 2ju4 n GLN 83 CO 0.00 0.00 0.00 0.66 0.07 0.00 0.00 177.06 177.79 2ju4 n TYR 84 N 0.26 -0.14 0.00 3.69 4.01 -1.26 -2.36 117.16 121.35 2ju4 n TYR 84 Ca -0.02 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.72 2ju4 n TYR 84 Cb 0.52 -1.85 0.00 0.00 -0.31 0.00 0.00 39.34 37.70 2ju4 n TYR 84 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2ju4 n GLY 85 N 0.29 2.19 0.00 2.72 0.00 0.95 -5.28 105.19 106.06 2ju4 n GLY 85 Ca -0.05 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.60 2ju4 n GLY 85 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61