#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ju4 s ASN 2 N 0.00 -0.12 0.76 6.12 3.84 -1.26 -5.17 114.94 119.11 2ju4 s ASN 2 Ca 0.00 -0.56 -0.06 0.00 0.21 0.00 0.00 52.86 52.45 2ju4 s ASN 2 Cb 0.00 0.54 0.11 0.00 -0.55 0.00 0.00 41.25 41.36 2ju4 s ASN 2 CO 0.00 -1.03 1.07 -0.76 -2.79 0.00 0.00 177.10 173.59 2ju4 s LEU 3 N -3.07 2.87 -0.03 3.21 2.01 -1.26 -5.10 118.68 117.32 2ju4 s LEU 3 Ca 0.15 0.12 0.04 0.00 0.01 0.00 0.00 54.13 54.44 2ju4 s LEU 3 Cb -0.02 -2.54 -0.00 0.00 0.01 0.00 0.00 46.19 43.64 2ju4 s LEU 3 CO 0.04 -1.93 -0.13 -1.61 1.01 0.00 0.00 176.35 173.74 2ju4 s GLU 4 N -5.34 1.27 0.35 1.70 0.41 -1.26 -5.11 118.70 110.73 2ju4 s GLU 4 Ca 0.65 -0.46 -0.23 0.00 -0.41 0.00 0.00 54.97 54.52 2ju4 s GLU 4 Cb -0.07 -1.16 -0.15 0.00 -1.78 0.00 0.00 34.13 30.96 2ju4 s GLU 4 CO 0.46 0.21 0.29 -2.30 -0.49 0.00 0.00 175.26 173.43 2ju4 n PRO 5 N 3.09 0.12 -2.50 0.39 -0.02 -1.26 -4.91 135.00 129.90 2ju4 n PRO 5 Ca -0.17 0.04 -0.34 0.00 -2.02 0.00 0.00 63.50 61.02 2ju4 n PRO 5 Cb 0.54 -1.10 -0.03 0.00 -0.02 0.00 0.00 33.50 32.89 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 -1.10 3.78 0.11 0.52 0.04 -1.26 -4.98 135.00 132.11 2ju4 s PRO 6 Ca 0.61 1.32 -0.31 0.00 0.04 0.00 0.00 61.00 62.66 2ju4 s PRO 6 Cb -0.71 -2.09 -0.09 0.00 0.04 0.00 0.00 34.50 31.65 2ju4 s PRO 6 CO 0.60 -0.45 1.59 -1.59 0.04 0.00 0.00 177.00 177.20 2ju4 s LYS 7 N -3.34 4.21 0.18 4.56 -2.85 -1.26 -4.78 119.74 116.47 2ju4 s LYS 7 Ca 0.66 2.32 0.00 0.00 -1.00 0.00 0.00 55.97 57.95 2ju4 s LYS 7 Cb -0.16 -3.37 0.00 0.00 -2.06 0.00 0.00 37.83 32.24 2ju4 s LYS 7 CO 0.22 -0.65 0.00 0.00 0.10 0.00 0.00 175.35 175.01 2ju4 n ALA 8 N 4.75 1.79 0.00 0.59 0.00 -1.26 -5.10 120.51 121.28 2ju4 n ALA 8 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.59 2ju4 n ALA 8 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.85 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 -2.96 0.00 0.00 0.00 4.07 -1.26 -5.03 120.64 115.45 2ju4 n GLU 9 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 2ju4 n GLU 9 Cb 0.00 -0.97 0.00 0.00 -0.06 0.00 0.00 31.44 30.41 2ju4 n GLU 9 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 2ju4 n ARG 11 N 0.00 0.00 -0.29 5.31 5.12 -1.26 -5.24 116.66 120.30 2ju4 n ARG 11 Ca 0.00 0.00 -0.21 0.00 -1.93 0.00 0.00 57.85 55.71 2ju4 n ARG 11 Cb 0.00 0.00 0.20 0.00 -1.16 0.00 0.00 32.46 31.50 2ju4 n ARG 11 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 2ju4 n SER 12 N 0.00 -3.45 -3.12 0.55 2.88 -1.26 -4.99 113.62 104.23 2ju4 n SER 12 Ca 0.00 -0.60 -0.21 0.00 -1.33 0.00 0.00 58.87 56.73 2ju4 n SER 12 Cb 0.00 -0.77 -0.05 0.00 -0.75 0.00 0.00 64.21 62.64 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 -4.85 1.79 -2.55 -1.46 0.00 -1.26 -4.94 120.51 107.24 2ju4 n ALA 13 Ca -0.13 -3.04 -0.09 0.00 0.00 0.00 0.00 53.44 50.18 2ju4 n ALA 13 Cb 0.41 -0.90 0.04 0.00 0.00 0.00 0.00 19.45 19.00 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 1.53 -5.43 -0.38 0.00 -1.04 -1.26 -4.96 114.28 102.75 2ju4 n THR 14 Ca 0.19 -0.72 0.00 0.00 -2.04 0.00 0.00 64.05 61.49 2ju4 n THR 14 Cb 0.54 -4.89 0.00 0.00 -1.82 0.00 0.00 70.33 64.16 2ju4 n THR 14 CO 0.00 0.00 0.00 -1.14 -0.64 0.00 0.00 175.07 173.29 2ju4 n ARG 15 N -2.54 0.77 0.00 -2.82 3.00 -1.26 -5.02 116.66 108.79 2ju4 n ARG 15 Ca -0.06 -0.77 0.00 0.00 -0.00 0.00 0.00 57.85 57.03 2ju4 n ARG 15 Cb 0.57 -0.81 0.00 0.00 0.00 0.00 0.00 32.46 32.22 2ju4 n ARG 15 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.63 177.91 2ju4 n VAL 16 N -0.17 0.00 -1.82 5.15 0.31 -1.26 -5.01 118.33 115.52 2ju4 n VAL 16 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2ju4 n VAL 16 Cb 0.23 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.16 2ju4 n VAL 16 CO 0.00 0.00 0.00 0.80 -1.32 0.00 0.00 176.83 176.31 2ju4 n MET 17 N 0.00 0.00 -1.82 5.55 1.56 -1.26 -5.01 117.12 116.14 2ju4 n MET 17 Ca 0.00 0.00 -0.42 0.00 -0.27 0.00 0.00 57.70 57.01 2ju4 n MET 17 Cb 0.00 0.00 0.00 0.00 2.15 0.00 0.00 33.22 35.37 2ju4 n MET 17 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 2ju4 n GLY 18 N 0.00 4.23 0.00 -5.12 0.00 -1.26 -4.95 105.19 98.09 2ju4 n GLY 18 Ca 0.00 -1.58 0.00 0.00 0.00 0.00 0.00 46.02 44.44 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 4.23 -3.14 3.33 -0.02 0.00 -1.26 -5.12 105.19 103.21 2ju4 n GLY 19 Ca 0.52 -1.06 -0.37 0.00 0.00 0.00 0.00 46.02 45.11 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 -0.47 0.16 -3.63 1.61 -0.02 -1.26 -5.23 135.00 126.16 2ju4 n PRO 20 Ca 0.00 0.08 -0.06 0.00 -2.02 0.00 0.00 63.50 61.49 2ju4 n PRO 20 Cb 0.00 -1.47 -0.06 0.00 -0.02 0.00 0.00 33.50 31.95 2ju4 n PRO 20 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 2ju4 s THR 22 N -1.96 0.00 0.22 3.45 -1.32 -1.26 -5.26 115.64 109.52 2ju4 s THR 22 Ca 0.59 0.00 -0.24 0.00 -1.21 0.00 0.00 61.69 60.83 2ju4 s THR 22 Cb -0.36 -1.00 -0.15 0.00 -1.51 0.00 0.00 72.50 69.48 2ju4 s THR 22 CO 0.64 0.00 0.37 -2.65 -2.21 0.00 0.00 174.62 170.77 2ju4 n PRO 23 N 1.52 0.00 -2.72 7.08 -0.02 -1.26 -4.95 135.00 134.65 2ju4 n PRO 23 Ca -0.10 0.00 -0.05 0.00 -2.02 0.00 0.00 63.50 61.33 2ju4 n PRO 23 Cb 0.57 -0.89 0.04 0.00 -0.02 0.00 0.00 33.50 33.20 2ju4 n PRO 23 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 2ju4 n ARG 24 N 0.97 0.46 -0.29 -0.52 1.85 -1.26 -4.98 116.66 112.89 2ju4 n ARG 24 Ca 0.15 -1.46 -0.00 0.00 -1.00 0.00 0.00 57.85 55.53 2ju4 n ARG 24 Cb 0.26 -0.95 0.10 0.00 -1.05 0.00 0.00 32.46 30.82 2ju4 n ARG 24 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 2ju4 n LYS 25 N 2.19 1.92 0.09 2.89 4.76 -1.26 -4.43 118.16 124.32 2ju4 n LYS 25 Ca 0.11 -0.90 -0.11 0.00 -2.87 0.00 0.00 58.31 54.54 2ju4 n LYS 25 Cb 0.63 -1.62 -0.07 0.00 -1.84 0.00 0.00 35.03 32.13 2ju4 n LYS 25 CO 0.00 0.00 0.00 0.78 -1.37 0.00 0.00 177.40 176.81 2ju4 h GLY 26 N 4.28 -1.17 -5.25 0.72 0.00 -2.01 -3.43 103.07 96.21 2ju4 h GLY 26 Ca 0.05 0.59 -0.69 0.00 0.00 0.00 0.00 47.33 47.28 2ju4 h GLY 26 CO 0.19 -0.34 -0.11 -1.05 0.00 0.00 0.00 176.54 175.24 2ju4 n PRO 27 N -4.45 0.41 -1.48 4.80 -0.02 -1.26 -4.76 135.00 128.23 2ju4 n PRO 27 Ca -0.06 0.15 -0.55 0.00 -2.02 0.00 0.00 63.50 61.02 2ju4 n PRO 27 Cb 0.28 -1.44 -0.06 0.00 -0.02 0.00 0.00 33.50 32.26 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 1.32 0.15 0.08 0.52 -0.02 -1.26 -5.11 135.00 130.68 2ju4 n PRO 28 Ca 0.17 0.05 -0.16 0.00 -2.02 0.00 0.00 63.50 61.55 2ju4 n PRO 28 Cb 0.21 -1.42 -0.08 0.00 -0.02 0.00 0.00 33.50 32.19 2ju4 n PRO 28 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 2ju4 h LYS 29 N 2.54 0.44 -5.23 -0.52 2.10 -1.86 -3.54 116.57 110.50 2ju4 h LYS 29 Ca -0.44 -0.53 -0.67 0.00 -2.00 0.00 0.00 60.65 57.01 2ju4 h LYS 29 Cb 1.42 0.17 -0.33 0.00 -0.90 0.00 0.00 32.23 32.59 2ju4 h LYS 29 CO 0.64 1.19 -0.86 0.15 -2.00 0.00 0.00 179.45 178.57 2ju4 s LYS 31 N -3.10 3.07 0.00 0.07 1.02 -1.26 -4.99 119.74 114.55 2ju4 s LYS 31 Ca -0.06 -0.84 0.00 0.00 0.02 0.00 0.00 55.97 55.09 2ju4 s LYS 31 Cb 0.08 -2.45 0.00 0.00 -0.52 0.00 0.00 37.83 34.94 2ju4 s LYS 31 CO 0.88 0.03 0.00 0.94 -0.92 0.00 0.00 175.35 176.29 2ju4 n GLN 32 N 3.95 0.00 -5.01 1.68 0.00 -1.26 -5.13 117.38 111.62 2ju4 n GLN 32 Ca -0.20 0.00 -0.28 0.00 -0.00 0.00 0.00 57.00 56.52 2ju4 n GLN 32 Cb 0.52 0.00 -0.16 0.00 0.00 0.00 0.00 30.24 30.60 2ju4 n GLN 32 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.06 178.09 2ju4 s ARG 33 N 0.00 2.03 0.02 3.69 3.00 -1.26 -5.06 118.95 121.37 2ju4 s ARG 33 Ca 0.00 -0.73 -0.05 0.00 0.00 0.00 0.00 55.73 54.95 2ju4 s ARG 33 Cb 0.00 -1.77 -0.02 0.00 0.00 0.00 0.00 34.95 33.16 2ju4 s ARG 33 CO 0.00 0.32 1.08 1.96 0.00 0.00 0.00 175.30 178.66 2ju4 h GLN 34 N 6.10 -0.10 0.00 3.54 4.20 -2.00 -3.43 115.11 123.42 2ju4 h GLN 34 Ca -0.33 0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.38 2ju4 h GLN 34 Cb 1.17 0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.97 2ju4 h GLN 34 CO 0.48 -0.07 -0.10 0.25 -0.67 0.00 0.00 178.83 178.72 2ju4 n THR 35 N -2.95 0.76 -1.04 -0.54 -2.24 -1.26 -5.02 114.28 101.99 2ju4 n THR 35 Ca -0.01 0.25 0.00 0.00 -2.27 0.00 0.00 64.05 62.02 2ju4 n THR 35 Cb 0.06 -1.27 0.00 0.00 -2.10 0.00 0.00 70.33 67.02 2ju4 n THR 35 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 2ju4 n ARG 36 N -3.41 0.00 -1.70 -0.78 0.63 -1.26 -5.18 116.66 104.97 2ju4 n ARG 36 Ca 0.00 0.00 -0.44 0.00 -0.92 0.00 0.00 57.85 56.49 2ju4 n ARG 36 Cb 0.05 0.00 -0.02 0.00 0.45 0.00 0.00 32.46 32.94 2ju4 n ARG 36 CO 0.00 0.00 0.00 0.94 -2.51 0.00 0.00 177.63 176.06 2ju4 n GLN 37 N 0.00 2.30 -0.31 -0.14 -0.06 -1.26 -5.19 117.38 112.72 2ju4 n GLN 37 Ca 0.00 0.82 0.00 0.00 -2.00 0.00 0.00 57.00 55.82 2ju4 n GLN 37 Cb 0.03 -2.54 0.00 0.00 -4.06 0.00 0.00 30.24 23.67 2ju4 n GLN 37 CO 0.00 0.00 0.00 1.17 -0.20 0.00 0.00 177.06 178.03 2ju4 n LYS 39 N 2.34 0.00 0.00 3.69 4.81 -1.26 -5.01 118.16 122.73 2ju4 n LYS 39 Ca 0.11 0.25 0.00 0.00 -0.87 0.00 0.00 58.31 57.81 2ju4 n LYS 39 Cb 0.33 -0.06 0.00 0.00 0.02 0.00 0.00 35.03 35.32 2ju4 n LYS 39 CO 0.00 0.00 0.00 -1.13 1.17 0.00 0.00 177.40 177.44 2ju4 n SER 40 N 0.00 0.00 -4.84 3.14 3.41 -1.26 -5.13 113.62 108.94 2ju4 n SER 40 Ca 0.00 0.00 -0.31 0.00 -0.26 0.00 0.00 58.87 58.30 2ju4 n SER 40 Cb 0.00 0.00 0.05 0.00 -0.26 0.00 0.00 64.21 64.00 2ju4 n SER 40 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 175.04 173.29 2ju4 s LYS 41 N 1.21 2.90 1.10 4.33 0.00 -1.26 -5.05 119.74 122.97 2ju4 s LYS 41 Ca 0.00 0.75 -0.16 0.00 0.00 0.00 0.00 55.97 56.56 2ju4 s LYS 41 Cb 0.00 -2.00 0.24 0.00 0.00 0.00 0.00 37.83 36.07 2ju4 s LYS 41 CO 0.00 -1.08 1.12 -2.14 0.00 0.00 0.00 175.35 173.26 2ju4 s PRO 42 N -5.16 -0.39 0.14 1.78 0.02 -1.26 -5.01 135.00 125.12 2ju4 s PRO 42 Ca 0.58 0.11 -0.28 0.00 0.02 0.00 0.00 61.00 61.43 2ju4 s PRO 42 Cb -0.13 -1.68 -0.07 0.00 0.02 0.00 0.00 34.50 32.64 2ju4 s PRO 42 CO 0.54 -3.19 0.88 -1.25 -0.33 0.00 0.00 177.00 173.65 2ju4 s PRO 43 N -5.30 4.68 0.00 5.54 0.04 -1.26 -5.04 135.00 133.66 2ju4 s PRO 43 Ca 0.69 1.33 0.00 0.00 0.04 0.00 0.00 61.00 63.06 2ju4 s PRO 43 Cb -0.12 -3.33 0.00 0.00 0.04 0.00 0.00 34.50 31.09 2ju4 s PRO 43 CO 0.56 0.37 0.00 1.63 0.04 0.00 0.00 177.00 179.60 2ju4 n LYS 44 N 2.24 0.00 -2.87 4.56 5.02 -1.26 -5.04 118.16 120.80 2ju4 n LYS 44 Ca -0.01 0.00 -0.00 0.00 -2.02 0.00 0.00 58.31 56.28 2ju4 n LYS 44 Cb 0.49 0.00 0.01 0.00 -0.02 0.00 0.00 35.03 35.50 2ju4 n LYS 44 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 2ju4 s LYS 45 N 0.88 0.48 0.00 1.97 2.20 -1.26 -5.00 119.74 119.01 2ju4 s LYS 45 Ca 0.00 -0.27 0.00 0.00 -0.36 0.00 0.00 55.97 55.34 2ju4 s LYS 45 Cb 0.00 0.03 0.00 0.00 -1.51 0.00 0.00 37.83 36.35 2ju4 s LYS 45 CO 0.00 -0.65 0.00 0.41 -0.36 0.00 0.00 175.35 174.75 2ju4 n GLY 46 N 3.60 0.38 2.98 5.54 0.00 -1.26 -4.86 105.19 111.58 2ju4 n GLY 46 Ca 0.10 -0.01 -0.52 0.00 0.00 0.00 0.00 46.02 45.59 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 0.00 -1.66 1.61 3.14 -1.26 -4.69 118.33 115.48 2ju4 n VAL 47 Ca 0.00 0.00 -0.51 0.00 -2.96 0.00 0.00 64.34 60.87 2ju4 n VAL 47 Cb 0.00 -0.23 -0.05 0.00 -1.06 0.00 0.00 33.84 32.50 2ju4 n VAL 47 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2ju4 n GLN 48 N 2.37 1.65 -0.58 1.45 -0.00 -1.26 -4.92 117.38 116.10 2ju4 n GLN 48 Ca 0.21 0.60 0.01 0.00 -0.00 0.00 0.00 57.00 57.83 2ju4 n GLN 48 Cb 0.00 -2.33 0.22 0.00 -0.00 0.00 0.00 30.24 28.13 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 3.52 2.58 0.25 2.61 0.00 -1.26 -4.92 105.19 107.96 2ju4 n GLY 49 Ca 0.21 -0.57 0.08 0.00 0.00 0.00 0.00 46.02 45.74 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 0.23 4.50 2.93 -0.02 0.00 -1.26 -5.19 105.19 106.38 2ju4 n GLY 51 Ca 0.20 -1.08 -0.21 0.00 0.00 0.00 0.00 46.02 44.93 2ju4 n GLY 51 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2ju4 n ASP 52 N -1.21 0.28 0.00 1.61 8.00 -1.26 -4.99 116.55 118.97 2ju4 n ASP 52 Ca 0.15 -1.47 0.00 0.00 0.71 0.00 0.00 54.79 54.18 2ju4 n ASP 52 Cb 0.67 -0.71 0.00 0.00 -0.02 0.00 0.00 41.12 41.06 2ju4 n ASP 52 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 2ju4 n ASP 53 N -3.50 0.00 -3.71 -2.24 2.03 -1.26 -4.95 116.55 102.93 2ju4 n ASP 53 Ca 0.13 0.00 -0.28 0.00 0.52 0.00 0.00 54.79 55.16 2ju4 n ASP 53 Cb 0.44 0.00 -0.11 0.00 -0.72 0.00 0.00 41.12 40.73 2ju4 n ASP 53 CO 0.00 0.00 0.00 -0.38 -1.92 0.00 0.00 177.20 174.90 2ju4 n ILE 54 N -0.45 0.74 -2.39 5.18 -0.00 -1.26 -5.10 119.36 116.07 2ju4 n ILE 54 Ca 0.00 -4.42 -0.30 0.00 -0.00 0.00 0.00 62.75 58.03 2ju4 n ILE 54 Cb 0.00 -2.01 -0.01 0.00 -0.00 0.00 0.00 39.64 37.62 2ju4 n ILE 54 CO 0.00 0.00 0.00 -2.16 -0.00 0.00 0.00 176.55 174.39 2ju4 s PRO 55 N -1.04 3.66 -0.33 0.38 0.04 -1.26 -4.16 135.00 132.29 2ju4 s PRO 55 Ca 0.28 0.53 0.00 0.00 0.04 0.00 0.00 61.00 61.85 2ju4 s PRO 55 Cb -0.00 -2.25 0.00 0.00 0.04 0.00 0.00 34.50 32.29 2ju4 s PRO 55 CO -0.17 -0.30 0.00 0.41 0.04 0.00 0.00 177.00 176.98 2ju4 n GLY 56 N -2.16 0.43 0.05 0.56 0.00 -1.26 -4.92 105.19 97.90 2ju4 n GLY 56 Ca 0.03 -0.83 0.09 0.00 0.00 0.00 0.00 46.02 45.31 2ju4 n GLY 56 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2ju4 n MET 57 N -2.11 0.65 -2.67 1.61 2.81 -1.26 -4.46 117.12 111.69 2ju4 n MET 57 Ca -0.04 -0.08 -0.05 0.00 -1.81 0.00 0.00 57.70 55.73 2ju4 n MET 57 Cb 0.32 -1.62 0.03 0.00 -0.71 0.00 0.00 33.22 31.25 2ju4 n MET 57 CO 0.00 0.00 0.00 -1.91 1.51 0.00 0.00 175.97 175.57 2ju4 n GLU 58 N -2.44 0.49 -0.04 0.03 2.13 -1.26 -4.82 120.64 114.73 2ju4 n GLU 58 Ca -0.05 -1.05 -0.18 0.00 0.66 0.00 0.00 57.16 56.54 2ju4 n GLU 58 Cb 0.62 -0.05 -0.13 0.00 0.27 0.00 0.00 31.44 32.15 2ju4 n GLU 58 CO 0.00 0.00 0.00 0.78 -0.41 0.00 0.00 177.13 177.50 2ju4 h GLY 59 N 1.49 0.11 0.00 8.31 0.00 -1.98 -3.47 103.07 107.53 2ju4 h GLY 59 Ca -0.47 -0.28 0.00 0.00 0.00 0.00 0.00 47.33 46.58 2ju4 h GLY 59 CO -0.15 0.25 0.00 0.61 0.00 0.00 0.00 176.54 177.24 2ju4 n GLY 61 N 1.60 0.00 4.91 4.60 0.00 -1.26 -5.14 105.19 109.90 2ju4 n GLY 61 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.83 2ju4 n GLY 61 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2ju4 n THR 62 N -0.16 0.00 -1.85 2.61 -1.04 -1.26 -4.75 114.28 107.83 2ju4 n THR 62 Ca 0.00 0.00 -0.24 0.00 -2.04 0.00 0.00 64.05 61.77 2ju4 n THR 62 Cb 0.00 0.00 -0.05 0.00 -1.82 0.00 0.00 70.33 68.46 2ju4 n THR 62 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 2ju4 s ASP 63 N 0.00 4.67 0.00 8.00 1.01 -1.26 -3.19 116.67 125.90 2ju4 s ASP 63 Ca 0.00 -0.24 0.00 0.00 0.71 0.00 0.00 52.55 53.02 2ju4 s ASP 63 Cb 0.00 -2.55 0.00 0.00 1.01 0.00 0.00 42.92 41.38 2ju4 s ASP 63 CO 0.00 -3.12 0.00 -0.38 0.21 0.00 0.00 175.17 171.88 2ju4 n ILE 64 N 8.15 0.00 -4.20 0.77 -0.00 -1.26 -2.75 119.36 120.06 2ju4 n ILE 64 Ca 0.41 0.00 -0.29 0.00 -0.00 0.00 0.00 62.75 62.86 2ju4 n ILE 64 Cb 0.46 -0.56 -0.07 0.00 -0.00 0.00 0.00 39.64 39.47 2ju4 n ILE 64 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.55 176.96 2ju4 n THR 65 N -1.60 -1.65 0.00 1.39 -1.04 -1.19 -1.91 114.28 108.28 2ju4 n THR 65 Ca 0.00 -0.50 0.00 0.00 -2.04 0.00 0.00 64.05 61.51 2ju4 n THR 65 Cb 0.13 -1.53 0.00 0.00 -1.82 0.00 0.00 70.33 67.12 2ju4 n THR 65 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 2ju4 n VAL 66 N -4.53 0.00 -4.08 12.58 0.31 -1.11 -4.91 118.33 116.60 2ju4 n VAL 66 Ca -0.32 0.00 -0.12 0.00 -0.01 0.00 0.00 64.34 63.88 2ju4 n VAL 66 Cb 0.69 0.00 -0.11 0.00 -0.91 0.00 0.00 33.84 33.51 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 0.00 0.55 -1.25 2.52 -1.09 -0.80 -5.06 121.20 116.06 2ju4 s ILE 67 Ca 0.00 -1.22 0.26 0.00 -2.23 0.00 0.00 60.65 57.46 2ju4 s ILE 67 Cb 0.00 -0.78 0.11 0.00 -1.58 0.00 0.00 42.46 40.21 2ju4 s ILE 67 CO 0.00 -0.47 1.50 -0.81 -1.23 0.00 0.00 174.94 173.93 2ju4 n PRO 69 N 1.21 0.28 0.07 2.79 -0.04 -1.26 -4.98 135.00 133.07 2ju4 n PRO 69 Ca -0.21 -0.16 -0.06 0.00 -0.04 0.00 0.00 63.50 63.03 2ju4 n PRO 69 Cb 0.56 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.43 2ju4 n PRO 69 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 2ju4 h TRP 70 N 0.38 0.00 0.02 0.54 4.06 -1.96 -2.63 115.95 116.36 2ju4 h TRP 70 Ca 0.00 0.00 -0.36 0.00 2.06 0.00 0.00 58.89 60.59 2ju4 h TRP 70 Cb 0.50 0.00 -0.05 0.00 -1.00 0.00 0.00 29.16 28.61 2ju4 h TRP 70 CO 0.00 0.94 -2.03 0.39 -3.56 0.00 0.00 178.44 174.17 2ju4 n GLU 71 N -3.37 0.62 0.00 0.49 -0.58 -1.26 -4.87 120.64 111.66 2ju4 n GLU 71 Ca 0.00 0.35 -0.07 0.00 -0.42 0.00 0.00 57.16 57.02 2ju4 n GLU 71 Cb 0.90 -1.61 -0.06 0.00 -0.57 0.00 0.00 31.44 30.10 2ju4 n GLU 71 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2ju4 h ALA 72 N -0.50 -0.12 0.00 0.62 0.00 -1.95 -3.54 119.26 113.78 2ju4 h ALA 72 Ca -0.53 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.19 2ju4 h ALA 72 Cb 1.63 0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.47 2ju4 h ALA 72 CO -0.22 -0.14 -0.53 0.09 0.00 0.00 0.00 179.25 178.45 2ju4 n ASN 74 N -4.82 0.48 -3.30 0.00 3.02 -0.99 -4.90 115.26 104.74 2ju4 n ASN 74 Ca -0.05 0.00 -0.08 0.00 -0.03 0.00 0.00 54.58 54.42 2ju4 n ASN 74 Cb 0.21 0.00 0.08 0.00 -0.61 0.00 0.00 39.78 39.46 2ju4 n ASN 74 CO 0.00 0.00 0.00 1.57 -2.62 0.00 0.00 177.26 176.21 2ju4 n HIS 75 N -2.60 -1.79 -3.65 3.10 -0.00 -1.26 -4.98 115.22 104.04 2ju4 n HIS 75 Ca 0.00 0.00 -0.09 0.00 0.46 0.00 0.00 57.72 58.09 2ju4 n HIS 75 Cb 0.26 -0.78 -0.08 0.00 -0.12 0.00 0.00 29.99 29.28 2ju4 n HIS 75 CO 0.00 0.00 0.00 -1.21 0.46 0.00 0.00 176.34 175.59 2ju4 s GLU 77 N -2.54 0.69 0.00 1.57 2.02 -1.26 -5.12 118.70 114.06 2ju4 s GLU 77 Ca 0.18 1.09 -0.02 0.00 0.02 0.00 0.00 54.97 56.24 2ju4 s GLU 77 Cb -0.03 0.18 -0.07 0.00 0.10 0.00 0.00 34.13 34.31 2ju4 s GLU 77 CO 0.15 -0.14 1.73 -0.11 0.02 0.00 0.00 175.26 176.91 2ju4 n LEU 78 N 3.89 3.27 0.00 1.80 -0.00 -1.26 -3.80 117.00 120.90 2ju4 n LEU 78 Ca -0.19 -1.76 0.00 0.00 -0.00 0.00 0.00 56.01 54.06 2ju4 n LEU 78 Cb 0.58 -0.77 0.00 0.00 -0.00 0.00 0.00 43.42 43.22 2ju4 n LEU 78 CO 0.01 0.72 0.00 1.41 -0.00 0.00 0.00 177.39 179.53 2ju4 n HIS 79 N 2.10 0.00 0.04 1.96 8.25 -1.26 -5.00 115.22 121.31 2ju4 n HIS 79 Ca 0.11 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.57 2ju4 n HIS 79 Cb 0.42 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.53 2ju4 n HIS 79 CO 0.00 0.00 0.00 -1.91 0.64 0.00 0.00 176.34 175.07 2ju4 n GLU 80 N 0.00 0.00 0.09 -0.41 0.00 -1.25 -4.97 120.64 114.10 2ju4 n GLU 80 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 57.16 56.94 2ju4 n GLU 80 Cb 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 31.44 31.29 2ju4 n GLU 80 CO 0.00 0.00 0.00 1.37 0.00 0.00 0.00 177.13 178.50 2ju4 h LEU 81 N 0.00 0.64 0.00 4.31 8.10 -1.98 -3.46 115.31 122.92 2ju4 h LEU 81 Ca 0.00 -0.86 -0.01 0.00 0.11 0.00 0.00 57.88 57.12 2ju4 h LEU 81 Cb 0.00 -0.21 0.01 0.00 -0.44 0.00 0.00 40.66 40.02 2ju4 h LEU 81 CO 0.00 1.71 0.00 0.00 -4.11 0.00 0.00 178.44 176.04 2ju4 n ALA 82 N -2.79 -0.14 -2.30 0.17 0.00 -1.26 -4.62 120.51 109.56 2ju4 n ALA 82 Ca -0.21 -0.06 -0.04 0.00 0.00 0.00 0.00 53.44 53.14 2ju4 n ALA 82 Cb 1.08 -0.00 0.02 0.00 0.00 0.00 0.00 19.45 20.54 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 -1.78 -1.40 0.00 0.00 7.27 -1.26 -4.88 117.38 115.33 2ju4 n GLN 83 Ca 0.01 0.18 0.00 0.00 0.07 0.00 0.00 57.00 57.25 2ju4 n GLN 83 Cb 0.02 -3.21 0.00 0.00 2.41 0.00 0.00 30.24 29.46 2ju4 n GLN 83 CO 0.00 0.00 0.00 0.98 0.07 0.00 0.00 177.06 178.11 2ju4 n TYR 84 N -1.67 -0.68 -0.31 3.69 4.19 -1.26 -5.01 117.16 116.12 2ju4 n TYR 84 Ca -0.06 0.00 0.00 0.00 3.31 0.00 0.00 57.90 61.15 2ju4 n TYR 84 Cb 0.54 0.14 0.00 0.00 0.49 0.00 0.00 39.34 40.50 2ju4 n TYR 84 CO 0.00 0.00 0.00 0.41 0.91 0.00 0.00 176.86 178.18 2ju4 n GLY 85 N -1.11 0.31 3.90 2.98 0.00 -1.26 -5.30 105.19 104.70 2ju4 n GLY 85 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2ju4 n GLY 85 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71