#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 -0.06 -4.90 3.17 6.94 -1.26 -4.62 115.26 114.54 2ju4 n ASN 2 Ca 0.00 0.00 -0.29 0.00 -0.02 0.00 0.00 54.58 54.27 2ju4 n ASN 2 Cb 0.00 0.00 0.04 0.00 -2.36 0.00 0.00 39.78 37.46 2ju4 n ASN 2 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 2ju4 s LEU 3 N 0.00 3.06 0.62 -4.53 1.02 -1.26 -5.02 118.68 112.57 2ju4 s LEU 3 Ca 0.00 0.96 -0.18 0.00 0.02 0.00 0.00 54.13 54.93 2ju4 s LEU 3 Cb 0.00 -3.77 -0.02 0.00 0.02 0.00 0.00 46.19 42.41 2ju4 s LEU 3 CO 0.00 -1.20 1.20 -1.61 0.02 0.00 0.00 176.35 174.76 2ju4 s GLU 4 N -5.19 2.84 -0.47 1.70 2.02 -1.26 -4.82 118.70 113.52 2ju4 s GLU 4 Ca 0.56 1.79 -0.44 0.00 0.02 0.00 0.00 54.97 56.90 2ju4 s GLU 4 Cb -0.11 -1.92 -0.19 0.00 0.10 0.00 0.00 34.13 32.02 2ju4 s GLU 4 CO 0.49 -1.30 1.51 -2.30 0.02 0.00 0.00 175.26 173.67 2ju4 n PRO 5 N -1.80 0.00 -1.87 0.39 -0.02 -1.26 -4.91 135.00 125.52 2ju4 n PRO 5 Ca 0.13 0.00 -0.31 0.00 -2.02 0.00 0.00 63.50 61.30 2ju4 n PRO 5 Cb 0.50 -1.41 0.01 0.00 -0.02 0.00 0.00 33.50 32.58 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 2.82 3.47 -1.42 0.52 0.04 -1.26 -4.93 135.00 134.24 2ju4 s PRO 6 Ca 0.99 0.85 -0.13 0.00 0.04 0.00 0.00 61.00 62.75 2ju4 s PRO 6 Cb -1.41 -2.06 -0.03 0.00 0.04 0.00 0.00 34.50 31.04 2ju4 s PRO 6 CO 0.77 -0.67 2.44 1.63 0.04 0.00 0.00 177.00 181.21 2ju4 n LYS 7 N -2.66 2.97 -1.88 4.56 5.02 -1.26 -4.81 118.16 120.11 2ju4 n LYS 7 Ca 0.07 -2.33 -0.42 0.00 -2.02 0.00 0.00 58.31 53.60 2ju4 n LYS 7 Cb 0.54 -3.05 -0.00 0.00 -0.02 0.00 0.00 35.03 32.50 2ju4 n LYS 7 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2ju4 n ALA 8 N 5.27 5.62 -2.22 7.82 0.00 -1.26 -5.08 120.51 130.65 2ju4 n ALA 8 Ca 0.60 -3.99 0.00 0.00 0.00 0.00 0.00 53.44 50.06 2ju4 n ALA 8 Cb 0.32 -3.37 0.00 0.00 0.00 0.00 0.00 19.45 16.41 2ju4 n ALA 8 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2ju4 n GLU 9 N 5.30 0.00 0.00 0.00 0.00 -1.26 -5.28 120.64 119.40 2ju4 n GLU 9 Ca 0.50 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.66 2ju4 n GLU 9 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.81 2ju4 n GLU 9 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.13 175.00 2ju4 n ARG 11 N 0.00 2.90 -0.31 5.31 0.00 -1.26 -4.89 116.66 118.41 2ju4 n ARG 11 Ca 0.00 0.00 0.14 0.00 -0.00 0.00 0.00 57.85 57.99 2ju4 n ARG 11 Cb 0.00 -0.73 0.32 0.00 0.00 0.00 0.00 32.46 32.05 2ju4 n ARG 11 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.63 178.40 2ju4 h SER 12 N 0.00 0.23 -2.42 6.15 0.02 -2.07 -3.40 113.55 112.06 2ju4 h SER 12 Ca 0.00 0.17 -0.35 0.00 -0.84 0.00 0.00 61.79 60.77 2ju4 h SER 12 Cb 0.00 0.18 0.19 0.00 0.14 0.00 0.00 62.40 62.92 2ju4 h SER 12 CO 0.00 -0.08 -0.49 0.00 -1.14 0.00 0.00 176.83 175.12 2ju4 n ALA 13 N -2.55 -3.10 -1.00 3.77 0.00 -1.26 -4.98 120.51 111.39 2ju4 n ALA 13 Ca 0.23 -1.35 0.00 0.00 0.00 0.00 0.00 53.44 52.32 2ju4 n ALA 13 Cb 0.70 -1.37 0.00 0.00 0.00 0.00 0.00 19.45 18.79 2ju4 n ALA 13 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2ju4 n THR 14 N -4.82 0.00 0.47 0.00 -1.04 -1.26 -4.97 114.28 102.67 2ju4 n THR 14 Ca 0.05 0.00 0.06 0.00 -2.04 0.00 0.00 64.05 62.12 2ju4 n THR 14 Cb 0.52 0.00 0.06 0.00 -1.82 0.00 0.00 70.33 69.09 2ju4 n THR 14 CO 0.00 0.00 0.00 -2.11 -0.64 0.00 0.00 175.07 172.32 2ju4 n ARG 15 N -0.66 0.86 -1.09 -2.82 1.85 -1.26 -4.63 116.66 108.90 2ju4 n ARG 15 Ca 0.00 -1.30 -0.16 0.00 -1.00 0.00 0.00 57.85 55.40 2ju4 n ARG 15 Cb 0.00 -1.24 -0.10 0.00 -1.05 0.00 0.00 32.46 30.07 2ju4 n ARG 15 CO 0.00 0.00 0.00 0.28 -0.01 0.00 0.00 177.63 177.90 2ju4 n VAL 16 N 0.69 2.98 -3.61 8.89 0.31 -1.26 -4.79 118.33 121.54 2ju4 n VAL 16 Ca 0.08 -1.88 -0.08 0.00 -0.01 0.00 0.00 64.34 62.45 2ju4 n VAL 16 Cb 0.32 -1.77 -0.06 0.00 -0.91 0.00 0.00 33.84 31.43 2ju4 n VAL 16 CO 0.00 0.00 0.00 -0.32 -1.32 0.00 0.00 176.83 175.19 2ju4 s MET 17 N -0.18 0.41 0.54 5.55 -2.45 -1.26 -5.11 119.30 116.79 2ju4 s MET 17 Ca 0.55 0.21 0.00 0.00 -1.25 0.00 0.00 55.69 55.20 2ju4 s MET 17 Cb 0.30 0.19 0.00 0.00 1.25 0.00 0.00 34.83 36.58 2ju4 s MET 17 CO -0.07 -0.10 0.00 0.41 1.05 0.00 0.00 175.02 176.31 2ju4 n GLY 18 N 1.13 -1.89 0.00 2.11 0.00 -1.26 -5.06 105.19 100.22 2ju4 n GLY 18 Ca -0.09 -1.73 0.00 0.00 0.00 0.00 0.00 46.02 44.20 2ju4 n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ju4 n GLY 19 N 0.00 -1.31 3.37 -0.02 0.00 -1.26 -5.15 105.19 100.82 2ju4 n GLY 19 Ca 0.00 -1.59 -0.44 0.00 0.00 0.00 0.00 46.02 43.99 2ju4 n GLY 19 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2ju4 n PRO 20 N -1.34 0.17 0.00 1.61 -0.02 -1.26 -5.20 135.00 128.97 2ju4 n PRO 20 Ca 0.00 0.06 0.00 0.00 -2.02 0.00 0.00 63.50 61.54 2ju4 n PRO 20 Cb 0.00 -1.14 0.00 0.00 -0.02 0.00 0.00 33.50 32.34 2ju4 n PRO 20 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2ju4 n THR 22 N -0.65 0.00 -0.63 3.45 -2.24 -1.26 -5.26 114.28 107.69 2ju4 n THR 22 Ca 0.13 0.00 -0.27 0.00 -2.27 0.00 0.00 64.05 61.64 2ju4 n THR 22 Cb 0.35 0.00 0.15 0.00 -2.10 0.00 0.00 70.33 68.74 2ju4 n THR 22 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 2ju4 n PRO 23 N 0.00 -1.82 -3.59 -0.78 -0.02 -1.26 -5.02 135.00 122.51 2ju4 n PRO 23 Ca 0.00 -0.53 -0.21 0.00 -2.02 0.00 0.00 63.50 60.74 2ju4 n PRO 23 Cb 0.00 -1.54 -0.16 0.00 -0.02 0.00 0.00 33.50 31.78 2ju4 n PRO 23 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2ju4 s ARG 24 N -3.35 0.08 -1.31 -0.52 0.52 -1.26 -4.82 118.95 108.29 2ju4 s ARG 24 Ca 0.46 0.16 0.00 0.00 -0.52 0.00 0.00 55.73 55.83 2ju4 s ARG 24 Cb -0.07 -1.24 0.00 0.00 0.52 0.00 0.00 34.95 34.16 2ju4 s ARG 24 CO 0.52 -0.57 0.00 1.63 0.02 0.00 0.00 175.30 176.90 2ju4 n LYS 25 N 5.30 -1.65 -1.40 3.54 4.76 -1.26 -4.53 118.16 122.92 2ju4 n LYS 25 Ca -0.06 0.74 0.17 0.00 -2.87 0.00 0.00 58.31 56.29 2ju4 n LYS 25 Cb 0.49 -5.13 -0.07 0.00 -1.84 0.00 0.00 35.03 28.48 2ju4 n LYS 25 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2ju4 n GLY 26 N -0.49 -2.66 3.18 0.72 0.00 -1.26 -4.79 105.19 99.89 2ju4 n GLY 26 Ca -0.15 -0.98 -0.36 0.00 0.00 0.00 0.00 46.02 44.54 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 -4.20 -0.04 -0.96 1.61 -0.02 -1.26 -4.85 135.00 125.28 2ju4 n PRO 27 Ca -0.05 0.00 -0.35 0.00 -2.02 0.00 0.00 63.50 61.08 2ju4 n PRO 27 Cb 0.66 -1.31 0.06 0.00 -0.02 0.00 0.00 33.50 32.89 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 0.97 -0.06 -3.45 0.52 -0.02 -1.26 -5.12 135.00 126.58 2ju4 n PRO 28 Ca 0.03 -0.01 -0.38 0.00 -2.02 0.00 0.00 63.50 61.12 2ju4 n PRO 28 Cb 0.54 -1.16 -0.06 0.00 -0.02 0.00 0.00 33.50 32.80 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 -2.31 4.03 -0.64 -0.52 1.02 -1.26 -5.17 119.74 114.90 2ju4 s LYS 29 Ca 0.43 0.44 0.00 0.00 0.02 0.00 0.00 55.97 56.87 2ju4 s LYS 29 Cb -0.18 -3.26 0.00 0.00 -0.52 0.00 0.00 37.83 33.86 2ju4 s LYS 29 CO 0.80 0.59 0.00 1.63 -0.92 0.00 0.00 175.35 177.45 2ju4 n LYS 31 N 2.16 -0.80 -2.13 1.68 4.76 -1.26 -4.86 118.16 117.71 2ju4 n LYS 31 Ca -0.12 0.61 -0.02 0.00 -2.87 0.00 0.00 58.31 55.91 2ju4 n LYS 31 Cb 0.52 -4.45 0.04 0.00 -1.84 0.00 0.00 35.03 29.31 2ju4 n LYS 31 CO 0.00 0.00 0.00 0.94 -1.37 0.00 0.00 177.40 176.97 2ju4 n GLN 32 N -2.07 0.51 -1.59 1.97 7.27 -1.26 -5.11 117.38 117.11 2ju4 n GLN 32 Ca -0.06 -0.60 -0.53 0.00 0.07 0.00 0.00 57.00 55.87 2ju4 n GLN 32 Cb 0.29 0.12 -0.07 0.00 2.41 0.00 0.00 30.24 32.99 2ju4 n GLN 32 CO 0.00 0.00 0.00 -2.13 0.07 0.00 0.00 177.06 175.00 2ju4 n ARG 33 N -0.59 1.28 0.00 3.69 3.00 -1.26 -4.59 116.66 118.19 2ju4 n ARG 33 Ca -0.10 0.43 0.00 0.00 -0.00 0.00 0.00 57.85 58.18 2ju4 n ARG 33 Cb 0.66 -2.32 0.00 0.00 0.00 0.00 0.00 32.46 30.80 2ju4 n ARG 33 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.63 178.57 2ju4 n GLN 34 N 6.77 0.00 -2.19 -0.14 -0.06 -1.26 -5.03 117.38 115.46 2ju4 n GLN 34 Ca 0.32 0.00 -0.02 0.00 -2.00 0.00 0.00 57.00 55.30 2ju4 n GLN 34 Cb 0.19 0.00 0.06 0.00 -4.06 0.00 0.00 30.24 26.43 2ju4 n GLN 34 CO 0.00 0.00 0.00 0.25 -0.20 0.00 0.00 177.06 177.11 2ju4 n THR 35 N -0.70 0.21 0.83 1.69 -2.24 -1.26 -4.90 114.28 107.91 2ju4 n THR 35 Ca 0.00 -1.07 0.11 0.00 -2.27 0.00 0.00 64.05 60.82 2ju4 n THR 35 Cb 0.00 0.93 0.11 0.00 -2.10 0.00 0.00 70.33 69.27 2ju4 n THR 35 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2ju4 n ARG 36 N -0.85 0.11 -3.10 -0.78 3.00 -1.26 -4.88 116.66 108.90 2ju4 n ARG 36 Ca -0.14 0.01 -0.21 0.00 -0.01 0.00 0.00 57.85 57.49 2ju4 n ARG 36 Cb 0.84 -1.54 -0.03 0.00 0.00 0.00 0.00 32.46 31.73 2ju4 n ARG 36 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.63 178.57 2ju4 n GLN 37 N -1.69 1.81 0.00 5.56 7.27 -1.26 -5.11 117.38 123.96 2ju4 n GLN 37 Ca 0.04 -3.93 0.00 0.00 0.07 0.00 0.00 57.00 53.18 2ju4 n GLN 37 Cb 0.37 -1.90 0.00 0.00 2.41 0.00 0.00 30.24 31.12 2ju4 n GLN 37 CO 0.00 0.00 0.00 0.36 0.07 0.00 0.00 177.06 177.49 2ju4 n LYS 39 N 0.10 0.00 0.00 3.69 2.85 -1.26 -5.21 118.16 118.33 2ju4 n LYS 39 Ca 0.27 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.53 2ju4 n LYS 39 Cb 0.56 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.94 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 0.00 0.00 -4.38 -5.58 3.41 -1.26 -5.14 113.62 100.66 2ju4 n SER 40 Ca 0.00 0.00 -0.26 0.00 -0.26 0.00 0.00 58.87 58.35 2ju4 n SER 40 Cb 0.00 0.00 -0.12 0.00 -0.26 0.00 0.00 64.21 63.83 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 1.40 0.72 4.33 1.02 -1.26 -5.11 119.74 120.84 2ju4 s LYS 41 Ca 0.00 -1.41 -0.15 0.00 0.02 0.00 0.00 55.97 54.42 2ju4 s LYS 41 Cb 0.00 -1.72 -0.13 0.00 -0.52 0.00 0.00 37.83 35.46 2ju4 s LYS 41 CO 0.00 0.38 -0.49 -2.30 -0.92 0.00 0.00 175.35 172.02 2ju4 n PRO 42 N 0.55 0.00 -2.26 -1.68 -0.02 -1.26 -4.84 135.00 125.49 2ju4 n PRO 42 Ca -0.15 0.00 -0.41 0.00 -2.02 0.00 0.00 63.50 60.92 2ju4 n PRO 42 Cb 0.55 -0.89 -0.03 0.00 -0.02 0.00 0.00 33.50 33.11 2ju4 n PRO 42 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2ju4 s PRO 43 N -1.44 4.44 0.00 0.52 0.04 -1.26 -4.82 135.00 132.48 2ju4 s PRO 43 Ca 0.41 2.02 0.00 0.00 0.04 0.00 0.00 61.00 63.47 2ju4 s PRO 43 Cb -0.27 -3.18 0.00 0.00 0.04 0.00 0.00 34.50 31.10 2ju4 s PRO 43 CO 0.68 -0.14 0.00 1.17 0.04 0.00 0.00 177.00 178.75 2ju4 n LYS 44 N 2.03 0.00 -3.65 4.56 4.81 -1.26 -5.07 118.16 119.58 2ju4 n LYS 44 Ca 0.03 0.00 -0.11 0.00 -0.87 0.00 0.00 58.31 57.36 2ju4 n LYS 44 Cb 0.43 0.00 -0.08 0.00 0.02 0.00 0.00 35.03 35.41 2ju4 n LYS 44 CO 0.00 0.00 0.00 0.21 1.17 0.00 0.00 177.40 178.78 2ju4 s LYS 45 N 3.58 0.72 1.02 1.64 2.36 -1.26 -4.51 119.74 123.28 2ju4 s LYS 45 Ca 0.00 1.01 0.00 0.00 -2.55 0.00 0.00 55.97 54.43 2ju4 s LYS 45 Cb 0.00 0.26 0.00 0.00 -1.05 0.00 0.00 37.83 37.04 2ju4 s LYS 45 CO 0.00 -0.12 0.00 0.41 1.55 0.00 0.00 175.35 177.19 2ju4 n GLY 46 N 3.39 2.33 0.42 5.54 0.00 -0.27 -4.33 105.19 112.27 2ju4 n GLY 46 Ca -0.17 -0.01 -0.13 0.00 0.00 0.00 0.00 46.02 45.72 2ju4 n GLY 46 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2ju4 h VAL 47 N 0.00 0.08 0.00 1.61 2.07 -2.01 -3.30 116.25 114.70 2ju4 h VAL 47 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 2ju4 h VAL 47 Cb 0.00 0.08 0.00 0.00 -1.52 0.00 0.00 31.29 29.85 2ju4 h VAL 47 CO 0.00 0.00 0.00 1.67 0.02 0.00 0.00 177.57 179.26 2ju4 n GLN 48 N -5.42 0.00 0.00 1.57 0.00 -1.26 -5.11 117.38 107.16 2ju4 n GLN 48 Ca -0.03 0.26 0.00 0.00 -0.00 0.00 0.00 57.00 57.23 2ju4 n GLN 48 Cb 0.36 -0.85 0.00 0.00 0.00 0.00 0.00 30.24 29.76 2ju4 n GLN 48 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2ju4 n GLY 49 N 1.74 -0.39 0.00 1.69 0.00 -1.25 -5.00 105.19 101.99 2ju4 n GLY 49 Ca 0.00 0.51 0.00 0.00 0.00 0.00 0.00 46.02 46.53 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 0.00 -1.71 0.00 -0.02 0.00 -1.26 -1.12 105.19 101.08 2ju4 n GLY 51 Ca 0.00 0.76 0.00 0.00 0.00 0.00 0.00 46.02 46.78 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 0.00 0.15 1.61 2.03 -1.26 -5.07 116.55 114.02 2ju4 n ASP 52 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 2ju4 n ASP 52 Cb 0.00 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.40 2ju4 n ASP 52 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 2ju4 n ASP 53 N 0.00 -2.37 -3.49 1.67 5.68 -1.26 -5.03 116.55 111.75 2ju4 n ASP 53 Ca 0.00 0.58 -0.27 0.00 -0.50 0.00 0.00 54.79 54.60 2ju4 n ASP 53 Cb 0.00 2.35 -0.10 0.00 -1.14 0.00 0.00 41.12 42.23 2ju4 n ASP 53 CO 0.00 0.00 0.00 -0.38 -1.33 0.00 0.00 177.20 175.49 2ju4 n ILE 54 N -3.17 -0.52 -0.71 2.12 5.41 -1.26 -5.12 119.36 116.10 2ju4 n ILE 54 Ca 0.00 -3.79 -0.32 0.00 1.00 0.00 0.00 62.75 59.64 2ju4 n ILE 54 Cb 0.00 -1.79 0.16 0.00 -0.71 0.00 0.00 39.64 37.30 2ju4 n ILE 54 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 2ju4 n PRO 55 N 2.54 -0.86 -0.84 0.38 -0.02 -1.26 -3.66 135.00 131.27 2ju4 n PRO 55 Ca 0.27 -0.21 0.00 0.00 -2.02 0.00 0.00 63.50 61.54 2ju4 n PRO 55 Cb 0.45 -1.96 0.00 0.00 -0.02 0.00 0.00 33.50 31.98 2ju4 n PRO 55 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ju4 n GLY 56 N 1.33 0.54 0.00 -1.23 0.00 -1.26 -4.74 105.19 99.83 2ju4 n GLY 56 Ca 0.06 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.74 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 -2.84 1.01 0.00 1.61 0.00 -1.24 -4.96 117.12 110.70 2ju4 n MET 57 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.70 2ju4 n MET 57 Cb 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 33.22 33.14 2ju4 n MET 57 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 175.97 175.12 2ju4 n GLU 58 N 0.00 0.00 0.06 2.12 0.28 -1.26 -5.12 120.64 116.72 2ju4 n GLU 58 Ca 0.00 0.00 -0.03 0.00 -0.16 0.00 0.00 57.16 56.97 2ju4 n GLU 58 Cb 0.00 0.00 -0.08 0.00 1.43 0.00 0.00 31.44 32.79 2ju4 n GLU 58 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 177.13 177.75 2ju4 h GLY 59 N 0.00 0.00 0.00 -1.84 0.00 -1.88 -3.50 103.07 95.85 2ju4 h GLY 59 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2ju4 h GLY 59 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 2ju4 n GLY 61 N 1.36 1.24 0.08 4.60 0.00 -1.26 -4.97 105.19 106.25 2ju4 n GLY 61 Ca -0.04 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.90 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 0.00 1.46 0.51 2.61 5.66 -1.26 -2.90 114.28 120.35 2ju4 n THR 62 Ca 0.00 0.17 0.00 0.00 -3.05 0.00 0.00 64.05 61.17 2ju4 n THR 62 Cb 0.00 -2.35 0.00 0.00 -1.55 0.00 0.00 70.33 66.43 2ju4 n THR 62 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 2ju4 n ASP 63 N -4.47 0.83 0.00 1.09 9.92 -1.26 -2.30 116.55 120.36 2ju4 n ASP 63 Ca -0.12 -1.02 0.00 0.00 -0.53 0.00 0.00 54.79 53.12 2ju4 n ASP 63 Cb 0.45 -0.25 0.00 0.00 -0.64 0.00 0.00 41.12 40.67 2ju4 n ASP 63 CO 0.00 0.00 0.00 -0.38 0.13 0.00 0.00 177.20 176.95 2ju4 n ILE 64 N 0.40 0.00 0.10 0.53 5.41 -1.20 -4.38 119.36 120.23 2ju4 n ILE 64 Ca 0.00 0.00 -0.04 0.00 1.00 0.00 0.00 62.75 63.71 2ju4 n ILE 64 Cb 0.17 -0.38 0.10 0.00 -0.71 0.00 0.00 39.64 38.81 2ju4 n ILE 64 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 176.55 177.29 2ju4 h THR 65 N 0.00 1.46 0.00 1.39 2.02 -1.48 -3.36 112.91 112.95 2ju4 h THR 65 Ca 0.00 -2.29 -0.44 0.00 0.77 0.00 0.00 66.41 64.46 2ju4 h THR 65 Cb 0.05 2.22 -0.07 0.00 -1.74 0.00 0.00 68.15 68.62 2ju4 h THR 65 CO 0.00 0.66 -2.41 0.52 0.37 0.00 0.00 175.52 174.67 2ju4 n VAL 66 N -3.76 1.53 -4.33 3.16 0.31 -0.97 -5.07 118.33 109.19 2ju4 n VAL 66 Ca -0.02 -0.34 -0.17 0.00 -0.01 0.00 0.00 64.34 63.79 2ju4 n VAL 66 Cb 0.68 -1.91 -0.10 0.00 -0.91 0.00 0.00 33.84 31.61 2ju4 n VAL 66 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 2ju4 s ILE 67 N -2.51 0.53 -0.07 2.52 1.01 -1.22 -5.08 121.20 116.38 2ju4 s ILE 67 Ca -0.38 -2.00 0.21 0.00 0.00 0.00 0.00 60.65 58.48 2ju4 s ILE 67 Cb 0.14 -2.61 -0.31 0.00 0.01 0.00 0.00 42.46 39.69 2ju4 s ILE 67 CO 0.50 0.00 0.43 -2.65 0.00 0.00 0.00 174.94 173.21 2ju4 n PRO 69 N -0.51 0.66 0.22 2.79 -0.02 -1.26 -3.26 135.00 133.63 2ju4 n PRO 69 Ca -0.00 -0.15 0.06 0.00 -2.02 0.00 0.00 63.50 61.39 2ju4 n PRO 69 Cb 0.66 -1.54 0.51 0.00 -0.02 0.00 0.00 33.50 33.11 2ju4 n PRO 69 CO 0.00 0.00 0.00 2.35 1.98 0.00 0.00 175.50 179.83 2ju4 h TRP 70 N 0.00 0.00 0.00 6.00 7.01 -1.99 -3.33 115.95 123.65 2ju4 h TRP 70 Ca -0.11 0.00 0.00 0.00 2.11 0.00 0.00 58.89 60.89 2ju4 h TRP 70 Cb 1.25 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 28.31 2ju4 h TRP 70 CO 0.00 0.19 0.00 0.39 -2.79 0.00 0.00 178.44 176.23 2ju4 n GLU 71 N -4.27 0.00 -1.68 2.65 1.02 -1.26 -5.03 120.64 112.07 2ju4 n GLU 71 Ca -0.02 0.00 -0.30 0.00 -0.02 0.00 0.00 57.16 56.82 2ju4 n GLU 71 Cb 0.25 -0.62 0.19 0.00 -0.02 0.00 0.00 31.44 31.25 2ju4 n GLU 71 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2ju4 s ALA 72 N -3.42 1.81 0.00 0.62 0.00 -1.25 -5.12 121.76 114.41 2ju4 s ALA 72 Ca 0.00 -1.04 0.00 0.00 0.00 0.00 0.00 51.96 50.92 2ju4 s ALA 72 Cb 0.00 -2.84 0.00 0.00 0.00 0.00 0.00 23.12 20.28 2ju4 s ALA 72 CO 0.00 -2.66 0.00 -1.71 0.00 0.00 0.00 175.76 171.39 2ju4 n ASN 74 N -3.99 0.00 -3.51 0.00 2.85 -1.26 -4.96 115.26 104.39 2ju4 n ASN 74 Ca 0.13 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.60 2ju4 n ASN 74 Cb 0.60 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.62 2ju4 n ASN 74 CO 0.00 0.00 0.00 1.57 -2.11 0.00 0.00 177.26 176.72 2ju4 n HIS 75 N 0.00 -0.09 0.00 1.20 -0.00 -1.26 -5.10 115.22 109.97 2ju4 n HIS 75 Ca 0.00 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.18 2ju4 n HIS 75 Cb 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 29.87 2ju4 n HIS 75 CO 0.00 0.00 0.00 -1.91 0.46 0.00 0.00 176.34 174.89 2ju4 n GLU 77 N 0.00 0.00 -3.38 1.57 2.13 -1.26 -5.00 120.64 114.70 2ju4 n GLU 77 Ca 0.00 0.05 -0.21 0.00 0.66 0.00 0.00 57.16 57.66 2ju4 n GLU 77 Cb 0.00 -0.37 -0.00 0.00 0.27 0.00 0.00 31.44 31.34 2ju4 n GLU 77 CO 0.00 0.00 0.00 1.28 -0.41 0.00 0.00 177.13 178.00 2ju4 n LEU 78 N -1.15 0.00 -3.41 4.31 4.77 -1.26 -4.79 117.00 115.47 2ju4 n LEU 78 Ca 0.00 -2.30 -0.21 0.00 -0.03 0.00 0.00 56.01 53.47 2ju4 n LEU 78 Cb 0.00 -0.03 0.06 0.00 -2.33 0.00 0.00 43.42 41.12 2ju4 n LEU 78 CO 0.00 -0.52 -0.00 1.41 -1.33 0.00 0.00 177.39 176.95 2ju4 n HIS 79 N -1.52 -2.26 0.31 -1.77 8.25 -1.26 -4.91 115.22 112.06 2ju4 n HIS 79 Ca -0.02 0.74 0.11 0.00 -0.26 0.00 0.00 57.72 58.29 2ju4 n HIS 79 Cb 0.50 -3.98 -0.03 0.00 1.12 0.00 0.00 29.99 27.61 2ju4 n HIS 79 CO 0.00 0.00 0.00 -0.85 0.64 0.00 0.00 176.34 176.13 2ju4 n GLU 80 N -3.62 0.46 0.22 -0.41 0.28 -1.26 -3.91 120.64 112.40 2ju4 n GLU 80 Ca -0.10 -0.01 0.15 0.00 -0.16 0.00 0.00 57.16 57.04 2ju4 n GLU 80 Cb 0.62 -1.64 0.50 0.00 1.43 0.00 0.00 31.44 32.34 2ju4 n GLU 80 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 177.13 176.90 2ju4 h LEU 81 N 0.00 0.00 -0.25 -1.84 -0.00 -2.01 -3.00 115.31 108.22 2ju4 h LEU 81 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.88 2ju4 h LEU 81 Cb 0.87 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.53 2ju4 h LEU 81 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 178.44 178.44 2ju4 n ALA 82 N -2.01 1.80 0.15 1.53 0.00 -1.25 -2.64 120.51 118.08 2ju4 n ALA 82 Ca 0.02 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.49 2ju4 n ALA 82 Cb 0.36 -1.00 0.04 0.00 0.00 0.00 0.00 19.45 18.85 2ju4 n ALA 82 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 2ju4 h GLN 83 N 0.15 0.00 0.00 0.00 4.15 -1.82 -3.14 115.11 114.45 2ju4 h GLN 83 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 2ju4 h GLN 83 Cb 0.05 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.74 2ju4 h GLN 83 CO 0.00 0.47 0.00 1.88 -1.93 0.00 0.00 178.83 179.25 2ju4 h TYR 84 N 0.00 0.00 0.00 3.99 -1.99 -1.80 -3.46 116.97 113.71 2ju4 h TYR 84 Ca -0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 2ju4 h TYR 84 Cb 1.35 0.00 0.00 0.00 2.00 0.00 0.00 36.73 40.08 2ju4 h TYR 84 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 178.16 178.57 2ju4 n GLY 85 N 0.42 0.64 0.00 3.88 0.00 -1.19 -5.25 105.19 103.69 2ju4 n GLY 85 Ca 0.02 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.10 2ju4 n GLY 85 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83