#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ju4 h ASN 2 N 0.00 0.04 -1.86 3.17 4.21 -2.06 -3.47 115.58 115.61 2ju4 h ASN 2 Ca 0.00 -0.77 -0.19 0.00 1.21 0.00 0.00 56.30 56.55 2ju4 h ASN 2 Cb 0.00 -0.01 0.11 0.00 -1.12 0.00 0.00 38.32 37.30 2ju4 h ASN 2 CO 0.00 1.28 -0.21 0.00 -1.29 0.00 0.00 177.43 177.21 2ju4 n LEU 3 N -4.46 -1.36 -4.81 1.61 -0.00 -1.26 -4.89 117.00 101.83 2ju4 n LEU 3 Ca -0.21 -0.36 -0.34 0.00 -0.00 0.00 0.00 56.01 55.10 2ju4 n LEU 3 Cb 0.61 -0.73 -0.05 0.00 -0.00 0.00 0.00 43.42 43.25 2ju4 n LEU 3 CO 0.28 -3.15 0.68 -1.61 -0.00 0.00 0.00 177.39 173.60 2ju4 s GLU 4 N -3.33 4.03 -0.79 1.47 8.01 -1.26 -4.85 118.70 121.98 2ju4 s GLU 4 Ca 0.32 1.24 -0.31 0.00 0.01 0.00 0.00 54.97 56.23 2ju4 s GLU 4 Cb -0.05 -2.15 -0.19 0.00 -4.31 0.00 0.00 34.13 27.42 2ju4 s GLU 4 CO 0.29 -0.22 2.32 -2.30 0.01 0.00 0.00 175.26 175.36 2ju4 n PRO 5 N -0.77 0.00 -2.94 0.39 -0.02 -1.26 -4.89 135.00 125.52 2ju4 n PRO 5 Ca 0.08 0.00 -0.34 0.00 -2.02 0.00 0.00 63.50 61.22 2ju4 n PRO 5 Cb 0.53 -1.36 -0.07 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 7.48 4.20 -0.55 0.52 0.04 -1.26 -4.91 135.00 140.52 2ju4 s PRO 6 Ca 1.20 0.99 -0.27 0.00 0.04 0.00 0.00 61.00 62.95 2ju4 s PRO 6 Cb -1.20 -2.39 -0.27 0.00 0.04 0.00 0.00 34.50 30.68 2ju4 s PRO 6 CO 0.48 0.10 1.82 1.63 0.04 0.00 0.00 177.00 181.08 2ju4 n LYS 7 N -0.30 0.51 -0.04 4.56 5.02 -1.26 -4.49 118.16 122.17 2ju4 n LYS 7 Ca 0.05 -1.51 -0.21 0.00 -2.02 0.00 0.00 58.31 54.61 2ju4 n LYS 7 Cb 0.53 -3.07 -0.13 0.00 -0.02 0.00 0.00 35.03 32.34 2ju4 n LYS 7 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2ju4 h ALA 8 N 9.94 0.24 -1.13 7.82 0.00 -2.00 -3.50 119.26 130.64 2ju4 h ALA 8 Ca 0.23 -1.15 -0.33 0.00 0.00 0.00 0.00 54.91 53.65 2ju4 h ALA 8 Cb 0.79 0.58 -0.13 0.00 0.00 0.00 0.00 17.79 19.04 2ju4 h ALA 8 CO 1.69 0.82 -0.30 0.39 0.00 0.00 0.00 179.25 181.85 2ju4 n GLU 9 N -4.06 -1.41 0.00 0.00 1.02 -1.26 -5.01 120.64 109.92 2ju4 n GLU 9 Ca -0.28 0.98 0.00 0.00 -0.02 0.00 0.00 57.16 57.84 2ju4 n GLU 9 Cb 0.82 -5.29 0.00 0.00 -0.02 0.00 0.00 31.44 26.96 2ju4 n GLU 9 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 2ju4 n ARG 11 N -1.98 0.00 0.00 3.49 1.85 -1.26 -5.24 116.66 113.51 2ju4 n ARG 11 Ca -0.16 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.69 2ju4 n ARG 11 Cb 0.55 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.96 2ju4 n ARG 11 CO 0.00 0.00 0.00 0.43 -0.01 0.00 0.00 177.63 178.05 2ju4 n SER 12 N 0.00 -0.52 0.00 2.89 7.64 -1.26 -4.66 113.62 117.71 2ju4 n SER 12 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2ju4 n SER 12 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2ju4 n SER 12 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ju4 n ALA 13 N 2.58 0.00 -1.09 -0.43 0.00 -1.26 -4.24 120.51 116.08 2ju4 n ALA 13 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.41 2ju4 n ALA 13 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 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 0.00 0.00 0.00 0.00 -2.24 -1.26 -4.86 114.28 105.92 2ju4 n THR 14 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2ju4 n THR 14 Cb 0.00 -1.08 0.00 0.00 -2.10 0.00 0.00 70.33 67.15 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 0.25 0.00 -1.27 -0.78 0.63 -1.26 -5.07 116.66 109.16 2ju4 n ARG 15 Ca -0.03 0.00 0.15 0.00 -0.92 0.00 0.00 57.85 57.05 2ju4 n ARG 15 Cb 0.49 0.00 -0.06 0.00 0.45 0.00 0.00 32.46 33.34 2ju4 n ARG 15 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 2ju4 n VAL 16 N 0.00 -0.11 0.00 5.15 0.31 -1.26 -4.45 118.33 117.96 2ju4 n VAL 16 Ca 0.00 0.45 0.00 0.00 -0.01 0.00 0.00 64.34 64.78 2ju4 n VAL 16 Cb 0.00 -0.84 0.00 0.00 -0.91 0.00 0.00 33.84 32.09 2ju4 n VAL 16 CO 0.00 0.00 0.00 0.23 -1.32 0.00 0.00 176.83 175.74 2ju4 n MET 17 N -3.89 0.00 -3.66 5.55 2.81 -1.26 -4.42 117.12 112.25 2ju4 n MET 17 Ca -0.04 0.00 -0.13 0.00 -1.81 0.00 0.00 57.70 55.73 2ju4 n MET 17 Cb 0.64 0.00 -0.08 0.00 -0.71 0.00 0.00 33.22 33.07 2ju4 n MET 17 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 2ju4 s GLY 18 N 0.00 -0.49 -0.08 3.03 0.00 -1.26 -5.08 107.32 103.43 2ju4 s GLY 18 Ca 0.00 1.88 -0.03 0.00 0.00 0.00 0.00 44.72 46.57 2ju4 s GLY 18 CO 0.00 1.68 -0.06 -1.33 0.00 0.00 0.00 173.10 173.40 2ju4 h GLY 19 N 5.51 0.00 -5.79 0.20 0.00 -1.90 -3.48 103.07 97.61 2ju4 h GLY 19 Ca -0.29 0.00 -0.74 0.00 0.00 0.00 0.00 47.33 46.30 2ju4 h GLY 19 CO 0.12 0.00 0.30 -1.05 0.00 0.00 0.00 176.54 175.91 2ju4 n PRO 20 N -3.78 0.59 0.00 4.80 -0.02 -1.26 -5.11 135.00 130.22 2ju4 n PRO 20 Ca -0.02 0.21 0.00 0.00 -2.02 0.00 0.00 63.50 61.67 2ju4 n PRO 20 Cb 0.08 -1.79 0.00 0.00 -0.02 0.00 0.00 33.50 31.77 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 2.20 0.00 -1.63 3.45 -2.24 -1.26 -5.27 114.28 109.53 2ju4 n THR 22 Ca 0.20 0.00 -0.48 0.00 -2.27 0.00 0.00 64.05 61.50 2ju4 n THR 22 Cb 0.13 0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 68.32 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 1.62 -2.36 -0.78 -0.02 -1.26 -4.88 135.00 127.31 2ju4 n PRO 23 Ca 0.00 0.58 -0.02 0.00 -2.02 0.00 0.00 63.50 62.04 2ju4 n PRO 23 Cb 0.00 -2.20 0.10 0.00 -0.02 0.00 0.00 33.50 31.37 2ju4 n PRO 23 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 2ju4 n ARG 24 N 2.28 1.02 0.01 -0.52 3.00 -1.26 -5.03 116.66 116.17 2ju4 n ARG 24 Ca 0.15 -0.92 -0.01 0.00 -0.00 0.00 0.00 57.85 57.07 2ju4 n ARG 24 Cb 0.27 0.33 -0.01 0.00 0.00 0.00 0.00 32.46 33.05 2ju4 n ARG 24 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.63 178.50 2ju4 h LYS 25 N 0.75 -0.06 0.00 -0.14 1.57 -2.08 -3.48 116.57 113.12 2ju4 h LYS 25 Ca -0.34 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.44 2ju4 h LYS 25 Cb 1.23 0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.55 2ju4 h LYS 25 CO -0.15 -0.04 0.00 0.41 -0.57 0.00 0.00 179.45 179.10 2ju4 n GLY 26 N -1.04 2.16 3.20 3.86 0.00 -1.26 -5.14 105.19 106.97 2ju4 n GLY 26 Ca -0.01 -1.06 -0.35 0.00 0.00 0.00 0.00 46.02 44.60 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 -0.96 -0.05 -1.40 1.61 -0.02 -1.26 -4.79 135.00 128.13 2ju4 n PRO 27 Ca 0.00 0.00 -0.46 0.00 -2.02 0.00 0.00 63.50 61.02 2ju4 n PRO 27 Cb 0.00 -1.35 -0.02 0.00 -0.02 0.00 0.00 33.50 32.11 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 0.81 0.18 -2.35 0.52 -0.02 -1.26 -5.15 135.00 127.73 2ju4 n PRO 28 Ca 0.03 0.06 -0.02 0.00 -2.02 0.00 0.00 63.50 61.55 2ju4 n PRO 28 Cb 0.54 -1.12 0.09 0.00 -0.02 0.00 0.00 33.50 32.98 2ju4 n PRO 28 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 2ju4 n LYS 29 N 1.01 0.92 0.00 -0.52 3.00 -1.26 -5.22 118.16 116.08 2ju4 n LYS 29 Ca 0.15 -0.91 0.00 0.00 -0.00 0.00 0.00 58.31 57.56 2ju4 n LYS 29 Cb 0.30 0.25 0.00 0.00 0.00 0.00 0.00 35.03 35.57 2ju4 n LYS 29 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 2ju4 n LYS 31 N -1.00 0.00 -1.61 1.64 5.02 -1.26 -5.15 118.16 115.81 2ju4 n LYS 31 Ca -0.12 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.17 2ju4 n LYS 31 Cb 0.76 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.77 2ju4 n LYS 31 CO 0.00 0.00 0.00 0.94 -0.52 0.00 0.00 177.40 177.82 2ju4 n GLN 32 N 0.00 -2.85 -2.73 1.97 7.27 -1.26 -5.02 117.38 114.76 2ju4 n GLN 32 Ca 0.00 2.29 -0.02 0.00 0.07 0.00 0.00 57.00 59.33 2ju4 n GLN 32 Cb 0.00 -2.62 0.10 0.00 2.41 0.00 0.00 30.24 30.13 2ju4 n GLN 32 CO 0.00 0.00 0.00 2.89 0.07 0.00 0.00 177.06 180.02 2ju4 n ARG 33 N 0.99 1.46 0.00 3.69 1.85 -1.26 -4.90 116.66 118.49 2ju4 n ARG 33 Ca 0.00 -2.17 0.14 0.00 -1.00 0.00 0.00 57.85 54.82 2ju4 n ARG 33 Cb 0.00 -0.40 0.59 0.00 -1.05 0.00 0.00 32.46 31.60 2ju4 n ARG 33 CO 0.00 0.00 0.00 0.94 -0.01 0.00 0.00 177.63 178.56 2ju4 n GLN 34 N -1.05 0.72 -1.01 2.89 7.27 -1.26 -5.03 117.38 119.91 2ju4 n GLN 34 Ca -0.06 -0.26 0.00 0.00 0.07 0.00 0.00 57.00 56.74 2ju4 n GLN 34 Cb 0.85 -1.49 0.00 0.00 2.41 0.00 0.00 30.24 32.00 2ju4 n GLN 34 CO 0.00 0.00 0.00 2.41 0.07 0.00 0.00 177.06 179.54 2ju4 n THR 35 N -0.91 -3.70 -3.60 1.69 -1.04 -1.26 -4.80 114.28 100.66 2ju4 n THR 35 Ca 0.14 1.50 -0.24 0.00 -2.04 0.00 0.00 64.05 63.42 2ju4 n THR 35 Cb 0.28 -2.16 0.04 0.00 -1.82 0.00 0.00 70.33 66.68 2ju4 n THR 35 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2ju4 n ARG 36 N -0.63 -2.87 -0.10 -2.82 1.74 -1.26 -5.14 116.66 105.60 2ju4 n ARG 36 Ca 0.00 0.61 0.00 0.00 -0.77 0.00 0.00 57.85 57.69 2ju4 n ARG 36 Cb 0.00 -4.90 0.00 0.00 -1.02 0.00 0.00 32.46 26.54 2ju4 n ARG 36 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2ju4 n GLN 37 N -4.01 0.95 -3.45 5.56 1.13 -1.26 -5.03 117.38 111.27 2ju4 n GLN 37 Ca -0.17 0.00 -0.43 0.00 -1.94 0.00 0.00 57.00 54.46 2ju4 n GLN 37 Cb 0.63 -1.02 -0.07 0.00 0.11 0.00 0.00 30.24 29.89 2ju4 n GLN 37 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 2ju4 s LYS 39 N 0.06 2.74 0.00 -1.09 -0.14 -1.26 -5.17 119.74 114.88 2ju4 s LYS 39 Ca 0.00 -1.79 0.00 0.00 -1.36 0.00 0.00 55.97 52.82 2ju4 s LYS 39 Cb 0.00 -4.10 0.00 0.00 -1.68 0.00 0.00 37.83 32.05 2ju4 s LYS 39 CO 0.00 -1.25 0.00 -1.13 -0.76 0.00 0.00 175.35 172.21 2ju4 n SER 40 N 4.97 0.00 -4.76 2.83 3.41 -1.26 -5.14 113.62 113.67 2ju4 n SER 40 Ca -0.09 0.00 -0.39 0.00 -0.26 0.00 0.00 58.87 58.13 2ju4 n SER 40 Cb 0.41 0.00 0.02 0.00 -0.26 0.00 0.00 64.21 64.37 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 0.00 3.56 0.64 4.33 -2.85 -1.26 -4.98 119.74 119.18 2ju4 s LYS 41 Ca 0.00 2.21 -0.15 0.00 -1.00 0.00 0.00 55.97 57.04 2ju4 s LYS 41 Cb 0.00 -2.50 -0.01 0.00 -2.06 0.00 0.00 37.83 33.26 2ju4 s LYS 41 CO 0.00 -0.85 1.08 -1.25 0.10 0.00 0.00 175.35 174.43 2ju4 s PRO 42 N -2.60 3.00 -0.09 1.78 0.04 -1.26 -5.00 135.00 130.87 2ju4 s PRO 42 Ca 0.64 1.24 -0.30 0.00 0.04 0.00 0.00 61.00 62.63 2ju4 s PRO 42 Cb -0.39 -1.99 -0.02 0.00 0.04 0.00 0.00 34.50 32.14 2ju4 s PRO 42 CO 0.49 -1.07 1.16 -1.25 0.04 0.00 0.00 177.00 176.37 2ju4 s PRO 43 N -4.25 4.35 -0.70 0.56 0.04 -1.26 -3.55 135.00 130.18 2ju4 s PRO 43 Ca 0.64 1.60 0.00 0.00 0.04 0.00 0.00 61.00 63.28 2ju4 s PRO 43 Cb -0.18 -3.58 0.00 0.00 0.04 0.00 0.00 34.50 30.78 2ju4 s PRO 43 CO 0.42 -0.46 0.00 1.63 0.04 0.00 0.00 177.00 178.63 2ju4 n LYS 44 N 5.39 -2.07 -1.44 4.56 4.76 -1.26 -4.27 118.16 123.83 2ju4 n LYS 44 Ca 0.11 0.39 0.17 0.00 -2.87 0.00 0.00 58.31 56.12 2ju4 n LYS 44 Cb 0.46 -4.82 -0.09 0.00 -1.84 0.00 0.00 35.03 28.75 2ju4 n LYS 44 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2ju4 n LYS 45 N -2.29 -3.25 -0.82 1.97 5.02 -1.23 -3.02 118.16 114.53 2ju4 n LYS 45 Ca -0.09 2.63 -0.20 0.00 -2.02 0.00 0.00 58.31 58.63 2ju4 n LYS 45 Cb 0.46 -3.84 -0.06 0.00 -0.02 0.00 0.00 35.03 31.58 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 -4.33 3.05 0.00 0.72 0.00 -1.26 -2.99 105.19 100.37 2ju4 n GLY 46 Ca -0.08 -0.96 0.00 0.00 0.00 0.00 0.00 46.02 44.98 2ju4 n GLY 46 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2ju4 n VAL 47 N 3.53 0.00 -2.76 1.61 0.31 -1.25 -4.52 118.33 115.26 2ju4 n VAL 47 Ca 0.45 0.00 -0.10 0.00 -0.01 0.00 0.00 64.34 64.68 2ju4 n VAL 47 Cb 0.33 0.00 0.03 0.00 -0.91 0.00 0.00 33.84 33.29 2ju4 n VAL 47 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2ju4 n GLN 48 N -0.35 1.11 -2.49 5.55 1.13 -1.16 -4.57 117.38 116.60 2ju4 n GLN 48 Ca 0.00 -3.04 -0.02 0.00 -1.94 0.00 0.00 57.00 52.00 2ju4 n GLN 48 Cb 0.00 -1.16 0.08 0.00 0.11 0.00 0.00 30.24 29.27 2ju4 n GLN 48 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2ju4 n GLY 49 N -0.05 1.78 0.00 1.08 0.00 -1.25 -4.63 105.19 102.11 2ju4 n GLY 49 Ca 0.10 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.70 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 -1.06 0.00 0.00 -0.02 0.00 -1.26 -4.84 105.19 98.02 2ju4 n GLY 51 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.91 2ju4 n GLY 51 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2ju4 n ASP 52 N 0.00 0.00 0.00 1.61 5.68 -1.26 -4.95 116.55 117.63 2ju4 n ASP 52 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.29 2ju4 n ASP 52 Cb 0.00 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 39.98 2ju4 n ASP 52 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 2ju4 n ASP 53 N -0.74 0.00 -3.33 -1.12 8.00 -1.26 -4.80 116.55 113.29 2ju4 n ASP 53 Ca 0.00 0.33 -0.25 0.00 0.71 0.00 0.00 54.79 55.58 2ju4 n ASP 53 Cb 0.00 -0.16 -0.09 0.00 -0.02 0.00 0.00 41.12 40.85 2ju4 n ASP 53 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 2ju4 n ILE 54 N -0.99 -1.11 1.90 0.53 -0.00 -1.26 -4.94 119.36 113.49 2ju4 n ILE 54 Ca 0.00 -3.22 0.04 0.00 -0.00 0.00 0.00 62.75 59.57 2ju4 n ILE 54 Cb 0.00 -1.42 0.20 0.00 -0.00 0.00 0.00 39.64 38.42 2ju4 n ILE 54 CO 0.00 0.00 0.00 -0.81 -0.00 0.00 0.00 176.55 175.74 2ju4 n PRO 55 N 2.82 1.08 0.00 0.38 -0.04 -1.26 -4.42 135.00 133.56 2ju4 n PRO 55 Ca 0.29 -0.12 0.00 0.00 -0.04 0.00 0.00 63.50 63.62 2ju4 n PRO 55 Cb 0.49 -1.13 0.00 0.00 -0.04 0.00 0.00 33.50 32.82 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 0.65 0.00 0.08 0.55 0.00 -1.26 -4.99 105.19 100.23 2ju4 n GLY 56 Ca 0.06 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.91 2ju4 n GLY 56 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2ju4 h MET 57 N 0.00 0.00 0.00 1.61 -1.53 -1.79 -3.48 114.93 109.74 2ju4 h MET 57 Ca 0.00 0.00 0.00 0.00 -3.44 0.00 0.00 59.70 56.26 2ju4 h MET 57 Cb 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 31.60 31.05 2ju4 h MET 57 CO 0.00 0.92 0.00 -1.91 0.14 0.00 0.00 176.91 176.06 2ju4 n GLU 58 N -4.54 0.00 0.00 0.39 0.00 -1.26 -5.19 120.64 110.04 2ju4 n GLU 58 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 57.16 56.97 2ju4 n GLU 58 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.98 2ju4 n GLU 58 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2ju4 n GLY 59 N -0.76 1.69 0.00 8.31 0.00 -1.26 -5.12 105.19 108.05 2ju4 n GLY 59 Ca 0.00 -1.76 0.00 0.00 0.00 0.00 0.00 46.02 44.26 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 5.00 0.76 3.51 -0.02 0.00 -1.26 -4.74 105.19 108.44 2ju4 n GLY 61 Ca 0.00 -0.02 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 2ju4 n GLY 61 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2ju4 s THR 62 N 0.28 4.10 0.00 2.61 -1.32 -1.26 -4.87 115.64 115.18 2ju4 s THR 62 Ca 0.00 0.09 0.00 0.00 -1.21 0.00 0.00 61.69 60.57 2ju4 s THR 62 Cb 0.00 -4.75 0.00 0.00 -1.51 0.00 0.00 72.50 66.24 2ju4 s THR 62 CO 0.00 -1.54 0.89 -0.90 -2.21 0.00 0.00 174.62 170.86 2ju4 n ASP 63 N 8.30 2.43 0.00 8.08 5.75 -1.26 -2.11 116.55 137.73 2ju4 n ASP 63 Ca 0.00 -1.53 0.00 0.00 -0.01 0.00 0.00 54.79 53.25 2ju4 n ASP 63 Cb 0.47 -0.49 0.00 0.00 -1.03 0.00 0.00 41.12 40.07 2ju4 n ASP 63 CO 0.00 0.00 0.00 -0.38 -0.11 0.00 0.00 177.20 176.71 2ju4 n ILE 64 N 1.44 0.00 -2.94 2.12 2.08 -1.26 -5.00 119.36 115.81 2ju4 n ILE 64 Ca 0.00 -0.00 -0.15 0.00 0.56 0.00 0.00 62.75 63.16 2ju4 n ILE 64 Cb 0.26 0.33 -0.03 0.00 -0.75 0.00 0.00 39.64 39.45 2ju4 n ILE 64 CO 0.00 0.00 0.00 1.07 0.56 0.00 0.00 176.55 178.18 2ju4 n THR 65 N -0.02 0.00 0.00 1.39 5.66 -0.90 -0.97 114.28 119.44 2ju4 n THR 65 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 2ju4 n THR 65 Cb 0.00 -0.17 0.00 0.00 -1.55 0.00 0.00 70.33 68.61 2ju4 n THR 65 CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 175.07 172.54 2ju4 n VAL 66 N -2.64 0.00 -4.20 1.08 0.31 -1.26 -5.11 118.33 106.51 2ju4 n VAL 66 Ca 0.04 0.00 -0.12 0.00 -0.01 0.00 0.00 64.34 64.25 2ju4 n VAL 66 Cb 0.39 0.00 -0.10 0.00 -0.91 0.00 0.00 33.84 33.22 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 0.72 -0.20 2.52 1.01 -0.14 -5.12 121.20 120.00 2ju4 s ILE 67 Ca 0.00 -1.96 0.19 0.00 0.00 0.00 0.00 60.65 58.88 2ju4 s ILE 67 Cb 0.00 -1.85 -0.02 0.00 0.01 0.00 0.00 42.46 40.60 2ju4 s ILE 67 CO 0.00 -0.72 1.04 -0.65 0.00 0.00 0.00 174.94 174.60 2ju4 h PRO 69 N 2.86 0.00 -0.74 2.79 0.11 -1.97 -3.48 132.00 131.57 2ju4 h PRO 69 Ca -0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 2ju4 h PRO 69 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2ju4 h PRO 69 CO 0.64 0.17 0.00 1.87 -0.21 0.00 0.00 178.00 180.47 2ju4 n TRP 70 N -2.85 0.00 0.05 0.65 -0.00 -1.26 -1.61 117.44 112.42 2ju4 n TRP 70 Ca -0.03 -0.03 0.00 0.00 -0.00 0.00 0.00 57.50 57.43 2ju4 n TRP 70 Cb 0.69 -0.08 0.00 0.00 -0.00 0.00 0.00 31.31 31.92 2ju4 n TRP 70 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 177.69 178.08 2ju4 n GLU 71 N 0.21 0.00 0.01 5.87 1.02 -1.26 -4.92 120.64 121.56 2ju4 n GLU 71 Ca 0.00 0.00 0.13 0.00 -0.02 0.00 0.00 57.16 57.27 2ju4 n GLU 71 Cb 0.19 0.00 0.55 0.00 -0.02 0.00 0.00 31.44 32.16 2ju4 n GLU 71 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2ju4 n ALA 72 N -2.79 2.19 0.00 0.62 0.00 -1.24 -5.03 120.51 114.26 2ju4 n ALA 72 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.36 2ju4 n ALA 72 Cb 0.00 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.03 2ju4 n ALA 72 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2ju4 n ASN 74 N -1.54 0.00 -4.49 0.00 5.03 -0.63 -5.07 115.26 108.55 2ju4 n ASN 74 Ca 0.06 0.00 -0.43 0.00 0.87 0.00 0.00 54.58 55.08 2ju4 n ASN 74 Cb 0.31 0.00 -0.06 0.00 -1.02 0.00 0.00 39.78 39.01 2ju4 n ASN 74 CO 0.00 0.00 0.00 -1.00 -1.83 0.00 0.00 177.26 174.43 2ju4 s HIS 75 N 0.00 3.04 0.00 3.10 3.76 -1.26 -4.98 115.29 118.95 2ju4 s HIS 75 Ca 0.00 -0.25 0.00 0.00 -0.15 0.00 0.00 55.06 54.66 2ju4 s HIS 75 Cb 0.00 -3.46 0.00 0.00 1.11 0.00 0.00 32.58 30.23 2ju4 s HIS 75 CO 0.00 -0.97 0.00 -1.91 -0.85 0.00 0.00 174.74 171.01 2ju4 n GLU 77 N 6.30 0.00 0.00 1.40 4.07 -1.26 -5.16 120.64 125.99 2ju4 n GLU 77 Ca -0.03 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.07 2ju4 n GLU 77 Cb 0.47 -0.45 0.00 0.00 -0.06 0.00 0.00 31.44 31.40 2ju4 n GLU 77 CO 0.00 0.00 0.00 1.28 -0.06 0.00 0.00 177.13 178.35 2ju4 n LEU 78 N -0.40 0.47 -3.15 4.31 7.99 -1.26 -4.98 117.00 119.98 2ju4 n LEU 78 Ca 0.00 0.09 0.05 0.00 -0.01 0.00 0.00 56.01 56.14 2ju4 n LEU 78 Cb 0.00 0.00 -0.00 0.00 -0.11 0.00 0.00 43.42 43.31 2ju4 n LEU 78 CO 0.00 0.00 0.42 -2.28 -1.51 0.00 0.00 177.39 174.02 2ju4 s HIS 79 N -0.18 -0.80 0.00 -1.77 2.46 -1.26 -4.99 115.29 108.75 2ju4 s HIS 79 Ca 0.00 0.48 0.00 0.00 0.47 0.00 0.00 55.06 56.01 2ju4 s HIS 79 Cb 0.00 0.14 0.00 0.00 -0.13 0.00 0.00 32.58 32.59 2ju4 s HIS 79 CO 0.00 -0.46 0.00 -1.91 -2.47 0.00 0.00 174.74 169.90 2ju4 n GLU 80 N 5.19 0.00 0.17 2.88 2.13 -1.26 -4.96 120.64 124.79 2ju4 n GLU 80 Ca 0.08 0.00 0.13 0.00 0.66 0.00 0.00 57.16 58.03 2ju4 n GLU 80 Cb 0.57 0.00 0.48 0.00 0.27 0.00 0.00 31.44 32.76 2ju4 n GLU 80 CO 0.00 0.00 0.00 1.37 -0.41 0.00 0.00 177.13 178.09 2ju4 h LEU 81 N 0.00 0.00 0.00 4.31 -0.00 -2.03 -3.40 115.31 114.19 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 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.66 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 -1.88 0.00 -1.27 0.17 0.00 -1.26 -4.69 120.51 111.58 2ju4 n ALA 82 Ca 0.03 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.37 2ju4 n ALA 82 Cb 0.33 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.73 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 0.00 -1.67 0.11 0.00 7.27 -1.26 -4.21 117.38 117.62 2ju4 n GLN 83 Ca 0.00 0.82 0.00 0.00 0.07 0.00 0.00 57.00 57.89 2ju4 n GLN 83 Cb 0.00 -5.21 0.00 0.00 2.41 0.00 0.00 30.24 27.44 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 -2.22 -3.50 -0.97 3.69 9.36 -1.26 -4.98 117.16 117.27 2ju4 n TYR 84 Ca -0.09 0.73 -0.30 0.00 3.32 0.00 0.00 57.90 61.57 2ju4 n TYR 84 Cb 0.56 2.10 -0.02 0.00 -0.63 0.00 0.00 39.34 41.35 2ju4 n TYR 84 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 2ju4 n GLY 85 N -1.22 3.39 0.35 2.98 0.00 -1.26 -5.21 105.19 104.23 2ju4 n GLY 85 Ca 0.00 -1.09 0.00 0.00 0.00 0.00 0.00 46.02 44.93 2ju4 n GLY 85 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61