#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 -4.52 3.17 0.23 -1.26 -5.05 115.26 107.84 2ju4 n ASN 2 Ca 0.00 0.00 -0.43 0.00 -0.53 0.00 0.00 54.58 53.62 2ju4 n ASN 2 Cb 0.00 0.00 -0.01 0.00 -2.08 0.00 0.00 39.78 37.69 2ju4 n ASN 2 CO 0.00 0.00 0.00 -0.22 -0.93 0.00 0.00 177.26 176.11 2ju4 s LEU 3 N -0.76 4.30 0.53 -4.53 2.96 -1.26 -4.99 118.68 114.92 2ju4 s LEU 3 Ca 0.00 -2.18 -0.19 0.00 -0.22 0.00 0.00 54.13 51.54 2ju4 s LEU 3 Cb 0.00 -2.49 -0.07 0.00 0.50 0.00 0.00 46.19 44.13 2ju4 s LEU 3 CO 0.00 -1.15 1.07 -1.83 -1.32 0.00 0.00 176.35 173.12 2ju4 s GLU 4 N 3.50 3.56 -0.77 1.98 -1.05 -1.26 -4.79 118.70 119.87 2ju4 s GLU 4 Ca 0.44 1.41 -0.22 0.00 -0.15 0.00 0.00 54.97 56.45 2ju4 s GLU 4 Cb -0.01 -2.05 -0.18 0.00 -0.44 0.00 0.00 34.13 31.45 2ju4 s GLU 4 CO -0.03 -0.64 2.03 -2.30 0.95 0.00 0.00 175.26 175.27 2ju4 n PRO 5 N -1.28 0.00 -3.04 -4.83 -0.02 -1.26 -4.88 135.00 119.69 2ju4 n PRO 5 Ca 0.10 0.00 -0.32 0.00 -2.02 0.00 0.00 63.50 61.26 2ju4 n PRO 5 Cb 0.52 -1.11 -0.05 0.00 -0.02 0.00 0.00 33.50 32.84 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 6.74 3.90 -0.42 0.52 0.04 -1.26 -5.03 135.00 139.48 2ju4 s PRO 6 Ca 1.04 0.57 -0.24 0.00 0.04 0.00 0.00 61.00 62.40 2ju4 s PRO 6 Cb -0.93 -2.43 0.02 0.00 0.04 0.00 0.00 34.50 31.20 2ju4 s PRO 6 CO 0.39 0.09 0.86 -1.59 0.04 0.00 0.00 177.00 176.79 2ju4 s LYS 7 N -3.33 3.61 0.00 4.56 -2.85 -1.26 -4.64 119.74 115.82 2ju4 s LYS 7 Ca 0.53 0.21 0.00 0.00 -1.00 0.00 0.00 55.97 55.70 2ju4 s LYS 7 Cb -0.10 -3.88 0.00 0.00 -2.06 0.00 0.00 37.83 31.79 2ju4 s LYS 7 CO 0.23 -1.07 0.12 0.00 0.10 0.00 0.00 175.35 174.73 2ju4 n ALA 8 N 6.84 0.74 -0.17 0.59 0.00 -1.26 -4.95 120.51 122.29 2ju4 n ALA 8 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.49 2ju4 n ALA 8 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.93 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 0.00 0.00 0.00 0.00 4.07 -1.26 -5.05 120.64 118.40 2ju4 n GLU 9 Ca 0.00 0.41 0.00 0.00 -0.06 0.00 0.00 57.16 57.51 2ju4 n GLU 9 Cb 0.25 -0.94 0.00 0.00 -0.06 0.00 0.00 31.44 30.69 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 -1.74 0.00 0.00 5.31 5.12 -1.26 -5.20 116.66 118.89 2ju4 n ARG 11 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 2ju4 n ARG 11 Cb 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.30 2ju4 n ARG 11 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 2ju4 n SER 12 N 0.00 0.00 -2.68 0.55 3.41 -1.26 -4.04 113.62 109.59 2ju4 n SER 12 Ca 0.00 0.00 -0.05 0.00 -0.26 0.00 0.00 58.87 58.56 2ju4 n SER 12 Cb 0.00 0.00 0.07 0.00 -0.26 0.00 0.00 64.21 64.02 2ju4 n SER 12 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ju4 n ALA 13 N 9.63 -3.10 -2.22 7.33 0.00 -1.26 -5.09 120.51 125.80 2ju4 n ALA 13 Ca 0.00 -0.54 -0.00 0.00 0.00 0.00 0.00 53.44 52.90 2ju4 n ALA 13 Cb 0.00 -2.83 -0.00 0.00 0.00 0.00 0.00 19.45 16.62 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 1.50 -8.13 -0.56 0.00 -2.24 -1.26 -4.47 114.28 99.13 2ju4 n THR 14 Ca 0.03 1.92 -0.15 0.00 -2.27 0.00 0.00 64.05 63.57 2ju4 n THR 14 Cb 0.69 -4.28 -0.03 0.00 -2.10 0.00 0.00 70.33 64.62 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 1.92 1.52 0.00 -0.78 3.00 -1.26 -4.76 116.66 116.30 2ju4 n ARG 15 Ca -0.00 -1.10 0.00 0.00 -0.00 0.00 0.00 57.85 56.75 2ju4 n ARG 15 Cb 0.00 -2.23 0.00 0.00 0.00 0.00 0.00 32.46 30.23 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 4.04 0.00 -1.48 5.15 0.31 -1.26 -4.86 118.33 120.23 2ju4 n VAL 16 Ca 0.32 0.00 0.18 0.00 -0.01 0.00 0.00 64.34 64.84 2ju4 n VAL 16 Cb 0.17 0.00 -0.09 0.00 -0.91 0.00 0.00 33.84 33.01 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 0.00 -3.34 0.00 5.55 2.81 -1.26 -5.04 117.12 115.84 2ju4 n MET 17 Ca 0.00 2.65 0.00 0.00 -1.81 0.00 0.00 57.70 58.54 2ju4 n MET 17 Cb 0.00 -3.93 0.00 0.00 -0.71 0.00 0.00 33.22 28.58 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 -4.38 -0.58 0.00 3.03 0.00 -1.26 -5.14 105.19 96.86 2ju4 n GLY 18 Ca -0.08 -2.21 0.00 0.00 0.00 0.00 0.00 46.02 43.73 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 -0.05 -3.04 3.04 -0.02 0.00 -1.26 -5.18 105.19 98.68 2ju4 n GLY 19 Ca 0.00 -1.00 -0.38 0.00 0.00 0.00 0.00 46.02 44.65 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 -0.31 -0.20 0.00 1.61 -0.02 -1.26 -5.21 135.00 129.60 2ju4 n PRO 20 Ca 0.00 -0.06 0.00 0.00 -2.02 0.00 0.00 63.50 61.42 2ju4 n PRO 20 Cb 0.00 -1.10 0.00 0.00 -0.02 0.00 0.00 33.50 32.38 2ju4 n PRO 20 CO 0.00 0.00 0.00 -2.37 1.98 0.00 0.00 175.50 175.11 2ju4 n THR 22 N -3.50 0.00 -2.22 3.45 5.66 -1.26 -5.30 114.28 111.11 2ju4 n THR 22 Ca -0.02 0.00 -0.26 0.00 -3.05 0.00 0.00 64.05 60.72 2ju4 n THR 22 Cb 0.72 0.00 0.11 0.00 -1.55 0.00 0.00 70.33 69.61 2ju4 n THR 22 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 175.07 169.86 2ju4 s PRO 23 N 0.00 1.60 0.00 1.09 0.04 -1.26 -5.08 135.00 131.39 2ju4 s PRO 23 Ca 0.00 -0.52 0.00 0.00 0.04 0.00 0.00 61.00 60.52 2ju4 s PRO 23 Cb 0.00 -2.12 0.00 0.00 0.04 0.00 0.00 34.50 32.42 2ju4 s PRO 23 CO 0.00 -1.64 0.00 -2.13 0.04 0.00 0.00 177.00 173.27 2ju4 n ARG 24 N -3.15 0.00 -3.86 4.56 3.00 -1.26 -4.81 116.66 111.14 2ju4 n ARG 24 Ca 0.12 0.00 -0.32 0.00 -0.00 0.00 0.00 57.85 57.65 2ju4 n ARG 24 Cb 0.60 0.00 -0.12 0.00 0.00 0.00 0.00 32.46 32.94 2ju4 n ARG 24 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 2ju4 s LYS 25 N 0.00 2.30 0.61 -0.14 3.01 -1.26 -5.03 119.74 119.23 2ju4 s LYS 25 Ca 0.00 -2.77 0.00 0.00 -1.01 0.00 0.00 55.97 52.19 2ju4 s LYS 25 Cb 0.00 -3.49 0.00 0.00 -1.01 0.00 0.00 37.83 33.33 2ju4 s LYS 25 CO 0.00 -1.17 0.00 0.41 0.51 0.00 0.00 175.35 175.10 2ju4 n GLY 26 N 2.96 -3.86 3.28 -3.33 0.00 -1.26 -4.81 105.19 98.16 2ju4 n GLY 26 Ca 0.09 -0.91 -0.36 0.00 0.00 0.00 0.00 46.02 44.83 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 -3.24 0.07 -1.55 1.61 -0.02 -1.26 -4.76 135.00 125.84 2ju4 n PRO 27 Ca -0.03 0.04 -0.55 0.00 -2.02 0.00 0.00 63.50 60.94 2ju4 n PRO 27 Cb 0.56 -1.41 -0.07 0.00 -0.02 0.00 0.00 33.50 32.56 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 0.55 0.64 0.00 0.52 -0.02 -1.26 -5.15 135.00 130.27 2ju4 n PRO 28 Ca 0.06 0.23 0.00 0.00 -2.02 0.00 0.00 63.50 61.77 2ju4 n PRO 28 Cb 0.52 -1.81 0.00 0.00 -0.02 0.00 0.00 33.50 32.19 2ju4 n PRO 28 CO 0.00 0.00 0.00 0.36 1.98 0.00 0.00 175.50 177.84 2ju4 n LYS 29 N 2.06 3.11 0.00 -0.52 0.00 -1.26 -5.23 118.16 116.32 2ju4 n LYS 29 Ca 0.19 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.50 2ju4 n LYS 29 Cb 0.14 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.17 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 0.00 0.00 0.00 -1.58 5.02 -1.26 -5.15 118.16 115.19 2ju4 n LYS 31 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2ju4 n LYS 31 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 2ju4 n LYS 31 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2ju4 n GLN 32 N 0.17 0.00 -3.64 1.97 -0.00 -1.26 -4.73 117.38 109.90 2ju4 n GLN 32 Ca 0.00 0.00 -0.27 0.00 -0.00 0.00 0.00 57.00 56.73 2ju4 n GLN 32 Cb 0.00 0.00 0.04 0.00 -0.00 0.00 0.00 30.24 30.28 2ju4 n GLN 32 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.06 174.93 2ju4 n ARG 33 N 0.00 -5.99 -0.37 2.61 0.63 -1.26 -4.74 116.66 107.54 2ju4 n ARG 33 Ca 0.00 0.70 -0.01 0.00 -0.92 0.00 0.00 57.85 57.63 2ju4 n ARG 33 Cb 0.00 -5.63 -0.01 0.00 0.45 0.00 0.00 32.46 27.28 2ju4 n ARG 33 CO 0.00 0.00 0.00 0.94 -2.51 0.00 0.00 177.63 176.06 2ju4 n GLN 34 N -4.60 0.00 0.00 -0.14 -0.06 -1.26 -5.06 117.38 106.26 2ju4 n GLN 34 Ca 0.01 -0.11 0.00 0.00 -2.00 0.00 0.00 57.00 54.90 2ju4 n GLN 34 Cb 0.55 0.11 0.00 0.00 -4.06 0.00 0.00 30.24 26.84 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 0.00 0.00 -2.66 1.69 -2.24 -1.26 -5.03 114.28 104.77 2ju4 n THR 35 Ca -0.03 0.00 -0.16 0.00 -2.27 0.00 0.00 64.05 61.59 2ju4 n THR 35 Cb 0.31 0.00 0.02 0.00 -2.10 0.00 0.00 70.33 68.56 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 -0.84 -2.92 0.00 -0.78 3.00 -1.26 -4.92 116.66 108.94 2ju4 n ARG 36 Ca 0.00 0.68 0.00 0.00 -0.00 0.00 0.00 57.85 58.53 2ju4 n ARG 36 Cb 0.00 -5.02 0.00 0.00 0.00 0.00 0.00 32.46 27.44 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 -2.93 0.00 0.00 -0.14 3.00 -1.26 -4.82 117.38 111.23 2ju4 n GLN 37 Ca -0.11 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.88 2ju4 n GLN 37 Cb 0.60 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.84 2ju4 n GLN 37 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.06 178.23 2ju4 n LYS 39 N 0.00 0.00 -3.09 -1.09 3.00 -0.99 -4.34 118.16 111.64 2ju4 n LYS 39 Ca 0.00 0.00 -0.38 0.00 -0.00 0.00 0.00 58.31 57.93 2ju4 n LYS 39 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 35.03 34.97 2ju4 n LYS 39 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.40 176.28 2ju4 s SER 40 N 0.00 7.17 0.46 3.14 0.01 -1.26 -3.82 113.70 119.40 2ju4 s SER 40 Ca 0.00 1.47 0.01 0.00 1.31 0.00 0.00 55.95 58.74 2ju4 s SER 40 Cb 0.00 -2.44 -0.01 0.00 0.21 0.00 0.00 66.02 63.79 2ju4 s SER 40 CO 0.00 0.13 0.05 0.29 0.41 0.00 0.00 173.24 174.12 2ju4 n LYS 41 N 1.18 0.74 -2.01 12.44 4.76 -1.26 -4.94 118.16 129.07 2ju4 n LYS 41 Ca -0.05 -3.49 -0.29 0.00 -2.87 0.00 0.00 58.31 51.61 2ju4 n LYS 41 Cb 0.50 1.26 0.05 0.00 -1.84 0.00 0.00 35.03 35.01 2ju4 n LYS 41 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 2ju4 s PRO 42 N -3.68 2.70 0.14 1.97 0.05 -1.26 -5.02 135.00 129.91 2ju4 s PRO 42 Ca 0.07 0.27 -0.31 0.00 0.05 0.00 0.00 61.00 61.08 2ju4 s PRO 42 Cb 0.00 -2.07 -0.09 0.00 0.05 0.00 0.00 34.50 32.40 2ju4 s PRO 42 CO 0.05 -1.07 1.41 -1.25 0.05 0.00 0.00 177.00 176.20 2ju4 s PRO 43 N -5.31 4.31 0.00 0.56 0.04 -1.26 -5.00 135.00 128.33 2ju4 s PRO 43 Ca 0.58 2.14 0.00 0.00 0.04 0.00 0.00 61.00 63.76 2ju4 s PRO 43 Cb -0.11 -3.21 0.00 0.00 0.04 0.00 0.00 34.50 31.22 2ju4 s PRO 43 CO 0.50 -0.44 0.00 1.63 0.04 0.00 0.00 177.00 178.72 2ju4 n LYS 44 N 3.67 0.00 0.12 4.56 5.02 -1.26 -5.02 118.16 125.24 2ju4 n LYS 44 Ca 0.11 0.00 0.01 0.00 -2.02 0.00 0.00 58.31 56.41 2ju4 n LYS 44 Cb 0.42 0.00 0.34 0.00 -0.02 0.00 0.00 35.03 35.76 2ju4 n LYS 44 CO 0.00 0.00 0.00 0.87 -0.52 0.00 0.00 177.40 177.75 2ju4 h LYS 45 N 0.00 0.22 -7.29 1.97 1.57 -2.02 -3.44 116.57 107.58 2ju4 h LYS 45 Ca 0.00 -0.07 -0.52 0.00 -1.87 0.00 0.00 60.65 58.20 2ju4 h LYS 45 Cb 0.00 -0.02 0.15 0.00 0.08 0.00 0.00 32.23 32.44 2ju4 h LYS 45 CO 0.00 0.45 0.30 0.20 -0.57 0.00 0.00 179.45 179.82 2ju4 s GLY 46 N -4.12 1.73 0.75 3.86 0.00 -1.26 -4.93 107.32 103.35 2ju4 s GLY 46 Ca -0.05 0.39 -0.16 0.00 0.00 0.00 0.00 44.72 44.90 2ju4 s GLY 46 CO 0.74 0.76 0.32 -0.62 0.00 0.00 0.00 173.10 174.30 2ju4 n VAL 47 N -3.62 1.22 0.37 1.40 0.31 -1.26 -4.80 118.33 111.96 2ju4 n VAL 47 Ca 0.10 -0.40 -0.04 0.00 -0.01 0.00 0.00 64.34 64.00 2ju4 n VAL 47 Cb 0.53 -0.57 0.08 0.00 -0.91 0.00 0.00 33.84 32.96 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 -0.28 1.66 -0.94 5.55 6.02 -1.26 -4.84 117.38 123.29 2ju4 n GLN 48 Ca 0.08 -0.91 -0.31 0.00 -0.01 0.00 0.00 57.00 55.86 2ju4 n GLN 48 Cb 0.51 -1.49 0.14 0.00 1.02 0.00 0.00 30.24 30.42 2ju4 n GLN 48 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 2ju4 s GLY 49 N 0.12 1.67 0.00 1.08 0.00 -1.26 -5.03 107.32 103.89 2ju4 s GLY 49 Ca 0.17 0.37 0.00 0.00 0.00 0.00 0.00 44.72 45.26 2ju4 s GLY 49 CO 0.04 0.79 0.00 0.61 0.00 0.00 0.00 173.10 174.54 2ju4 n GLY 51 N -0.40 0.57 0.00 0.20 0.00 -1.25 -4.71 105.19 99.60 2ju4 n GLY 51 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 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 0.00 0.00 0.00 1.61 9.92 -1.26 -4.56 116.55 122.26 2ju4 n ASP 52 Ca 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.26 2ju4 n ASP 52 Cb 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.48 2ju4 n ASP 52 CO 0.00 0.00 0.00 -0.90 0.13 0.00 0.00 177.20 176.43 2ju4 n ASP 53 N 0.00 0.00 -3.42 -2.24 5.75 -1.26 -3.47 116.55 111.91 2ju4 n ASP 53 Ca 0.00 0.00 -0.27 0.00 -0.01 0.00 0.00 54.79 54.51 2ju4 n ASP 53 Cb 0.00 0.00 -0.10 0.00 -1.03 0.00 0.00 41.12 39.99 2ju4 n ASP 53 CO 0.00 0.00 0.00 -0.38 -0.11 0.00 0.00 177.20 176.71 2ju4 n ILE 54 N 0.00 -0.83 0.02 2.12 -0.00 -1.26 -2.35 119.36 117.06 2ju4 n ILE 54 Ca 0.00 -3.65 -0.22 0.00 -0.00 0.00 0.00 62.75 58.88 2ju4 n ILE 54 Cb 0.00 -1.74 -0.14 0.00 -0.00 0.00 0.00 39.64 37.76 2ju4 n ILE 54 CO 0.00 0.00 0.00 1.55 -0.00 0.00 0.00 176.55 178.10 2ju4 h PRO 55 N 5.43 0.30 0.00 0.38 0.13 -1.98 -3.41 132.00 132.85 2ju4 h PRO 55 Ca 0.24 -0.51 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 2ju4 h PRO 55 Cb 0.89 0.19 0.00 0.00 0.13 0.00 0.00 31.00 32.21 2ju4 h PRO 55 CO 0.42 1.25 0.00 0.41 -0.23 0.00 0.00 178.00 179.85 2ju4 n GLY 56 N 1.93 -0.44 2.31 1.56 0.00 -1.26 -5.00 105.19 104.28 2ju4 n GLY 56 Ca -0.29 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.10 -1.05 0.00 1.61 2.81 -1.26 -4.98 117.12 114.15 2ju4 n MET 57 Ca 0.00 0.77 0.00 0.00 -1.81 0.00 0.00 57.70 56.66 2ju4 n MET 57 Cb 0.30 -4.97 0.00 0.00 -0.71 0.00 0.00 33.22 27.84 2ju4 n MET 57 CO 0.00 0.00 0.00 -0.85 1.51 0.00 0.00 175.97 176.63 2ju4 n GLU 58 N -2.41 0.00 -0.22 0.03 0.00 -1.26 -5.16 120.64 111.62 2ju4 n GLU 58 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.01 2ju4 n GLU 58 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 31.44 32.01 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 5.00 -3.28 0.00 -1.84 0.00 -1.26 -4.75 105.19 99.06 2ju4 n GLY 59 Ca 0.00 -0.90 0.00 0.00 0.00 0.00 0.00 46.02 45.12 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 -0.14 -1.97 0.00 -0.02 0.00 -1.26 -4.53 105.19 97.26 2ju4 n GLY 61 Ca 0.00 0.62 0.00 0.00 0.00 0.00 0.00 46.02 46.64 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 -0.80 0.00 0.44 2.61 5.66 -1.26 -4.91 114.28 116.03 2ju4 n THR 62 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 2ju4 n THR 62 Cb 0.00 0.16 0.00 0.00 -1.55 0.00 0.00 70.33 68.94 2ju4 n THR 62 CO 0.00 0.00 0.00 -0.67 -3.05 0.00 0.00 175.07 171.35 2ju4 n ASP 63 N 0.00 1.64 0.00 1.09 2.03 -1.26 -2.91 116.55 117.14 2ju4 n ASP 63 Ca 0.00 -1.08 0.00 0.00 0.52 0.00 0.00 54.79 54.23 2ju4 n ASP 63 Cb 0.27 -0.28 0.00 0.00 -0.72 0.00 0.00 41.12 40.39 2ju4 n ASP 63 CO 0.00 0.00 0.00 -0.38 -1.92 0.00 0.00 177.20 174.90 2ju4 n ILE 64 N 0.83 0.00 -0.00 5.18 5.41 -1.25 -4.59 119.36 124.94 2ju4 n ILE 64 Ca 0.00 0.00 0.01 0.00 1.00 0.00 0.00 62.75 63.76 2ju4 n ILE 64 Cb 0.26 -0.26 0.32 0.00 -0.71 0.00 0.00 39.64 39.24 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 1.18 0.00 1.39 2.02 -1.89 -3.29 112.91 112.32 2ju4 h THR 65 Ca 0.00 -0.68 -0.18 0.00 0.77 0.00 0.00 66.41 66.32 2ju4 h THR 65 Cb 0.00 0.87 -0.03 0.00 -1.74 0.00 0.00 68.15 67.25 2ju4 h THR 65 CO 0.00 0.24 -1.25 0.52 0.37 0.00 0.00 175.52 175.40 2ju4 n VAL 66 N -4.31 1.49 -4.34 3.16 0.31 -1.18 -5.18 118.33 108.29 2ju4 n VAL 66 Ca 0.02 0.00 -0.18 0.00 -0.01 0.00 0.00 64.34 64.17 2ju4 n VAL 66 Cb 0.21 -2.16 -0.09 0.00 -0.91 0.00 0.00 33.84 30.89 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 -2.43 0.41 -0.07 2.52 1.01 -1.24 -5.13 121.20 116.27 2ju4 s ILE 67 Ca -0.27 -2.00 0.20 0.00 0.00 0.00 0.00 60.65 58.58 2ju4 s ILE 67 Cb 0.06 -2.55 -0.30 0.00 0.01 0.00 0.00 42.46 39.68 2ju4 s ILE 67 CO 0.44 0.00 0.35 -2.65 0.00 0.00 0.00 174.94 173.08 2ju4 n PRO 69 N -0.55 0.69 0.25 2.79 -0.02 -1.26 -3.82 135.00 133.07 2ju4 n PRO 69 Ca 0.00 -0.14 0.11 0.00 -2.02 0.00 0.00 63.50 61.45 2ju4 n PRO 69 Cb 0.65 -1.49 0.73 0.00 -0.02 0.00 0.00 33.50 33.37 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 0.15 6.00 7.01 -1.92 -2.50 115.95 124.69 2ju4 h TRP 70 Ca -0.13 0.00 -0.32 0.00 2.11 0.00 0.00 58.89 60.55 2ju4 h TRP 70 Cb 1.26 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 28.32 2ju4 h TRP 70 CO 0.00 0.00 -1.64 0.93 -2.79 0.00 0.00 178.44 174.94 2ju4 h GLU 71 N 0.00 0.31 0.00 2.65 4.39 -1.96 -3.26 114.58 116.71 2ju4 h GLU 71 Ca 0.02 -0.53 0.00 0.00 0.34 0.00 0.00 59.36 59.19 2ju4 h GLU 71 Cb 0.09 0.20 0.00 0.00 -0.10 0.00 0.00 28.75 28.94 2ju4 h GLU 71 CO -0.00 1.26 0.00 0.00 -1.16 0.00 0.00 179.01 179.11 2ju4 n ALA 72 N -2.93 2.44 -3.32 3.43 0.00 -0.95 -4.99 120.51 114.19 2ju4 n ALA 72 Ca -0.26 -0.08 -0.02 0.00 0.00 0.00 0.00 53.44 53.08 2ju4 n ALA 72 Cb 1.00 -1.20 -0.01 0.00 0.00 0.00 0.00 19.45 19.24 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 -0.72 0.40 -0.22 0.00 4.13 -1.21 -5.10 115.26 112.54 2ju4 n ASN 74 Ca 0.09 -1.20 0.03 0.00 1.68 0.00 0.00 54.58 55.19 2ju4 n ASN 74 Cb 0.04 0.12 0.14 0.00 -1.54 0.00 0.00 39.78 38.54 2ju4 n ASN 74 CO 0.00 0.00 0.00 -0.74 0.28 0.00 0.00 177.26 176.80 2ju4 h HIS 75 N 1.08 0.15 0.00 3.10 2.76 -1.93 -3.41 115.15 116.91 2ju4 h HIS 75 Ca -0.02 0.04 0.00 0.00 -2.20 0.00 0.00 60.37 58.19 2ju4 h HIS 75 Cb 0.11 0.04 0.00 0.00 1.55 0.00 0.00 27.41 29.11 2ju4 h HIS 75 CO 0.00 -0.10 0.00 -1.91 -1.30 0.00 0.00 177.93 174.62 2ju4 n GLU 77 N -5.19 0.00 -1.54 5.26 0.00 -1.26 -4.92 120.64 112.98 2ju4 n GLU 77 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.27 2ju4 n GLU 77 Cb 0.39 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.83 2ju4 n GLU 77 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.13 177.02 2ju4 n LEU 78 N 0.00 -1.84 -2.86 4.31 7.94 -1.26 -4.89 117.00 118.39 2ju4 n LEU 78 Ca 0.00 2.86 -0.01 0.00 -1.11 0.00 0.00 56.01 57.75 2ju4 n LEU 78 Cb 0.00 -2.99 -0.01 0.00 0.53 0.00 0.00 43.42 40.94 2ju4 n LEU 78 CO 0.00 -0.35 -0.46 1.41 -1.11 0.00 0.00 177.39 176.88 2ju4 n HIS 79 N -1.97 -2.54 0.00 1.96 8.25 -1.26 -5.02 115.22 114.64 2ju4 n HIS 79 Ca 0.00 1.28 0.00 0.00 -0.26 0.00 0.00 57.72 58.74 2ju4 n HIS 79 Cb 0.30 -2.80 0.00 0.00 1.12 0.00 0.00 29.99 28.61 2ju4 n HIS 79 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 2ju4 n GLU 80 N 1.39 0.00 -0.13 -0.41 1.02 -1.26 -4.97 120.64 116.28 2ju4 n GLU 80 Ca -0.10 0.00 -0.25 0.00 -0.02 0.00 0.00 57.16 56.79 2ju4 n GLU 80 Cb 0.28 0.00 -0.10 0.00 -0.02 0.00 0.00 31.44 31.60 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 -0.18 2.24 -4.68 -4.62 -0.00 -1.26 -2.98 117.00 105.53 2ju4 n LEU 81 Ca 0.00 0.17 -0.57 0.00 -0.00 0.00 0.00 56.01 55.61 2ju4 n LEU 81 Cb 0.00 -0.81 -0.07 0.00 -0.00 0.00 0.00 43.42 42.53 2ju4 n LEU 81 CO 0.00 0.68 1.39 0.00 -0.00 0.00 0.00 177.39 179.45 2ju4 n ALA 82 N -3.88 -0.06 -1.01 1.47 0.00 -1.26 0.32 120.51 116.08 2ju4 n ALA 82 Ca -0.50 0.34 -0.05 0.00 0.00 0.00 0.00 53.44 53.23 2ju4 n ALA 82 Cb 0.91 -2.25 -0.02 0.00 0.00 0.00 0.00 19.45 18.09 2ju4 n ALA 82 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2ju4 n GLN 83 N 5.72 -1.32 0.00 0.00 1.13 -1.26 -4.40 117.38 117.25 2ju4 n GLN 83 Ca 0.29 0.34 0.00 0.00 -1.94 0.00 0.00 57.00 55.69 2ju4 n GLN 83 Cb 0.13 -4.26 0.00 0.00 0.11 0.00 0.00 30.24 26.21 2ju4 n GLN 83 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 2ju4 n TYR 84 N -1.27 0.00 -0.02 1.08 4.01 0.21 -4.80 117.16 116.37 2ju4 n TYR 84 Ca -0.05 0.00 -0.02 0.00 -0.16 0.00 0.00 57.90 57.67 2ju4 n TYR 84 Cb 0.21 0.00 -0.12 0.00 -0.31 0.00 0.00 39.34 39.11 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 0.00 -1.09 0.00 2.72 0.00 0.94 -4.52 105.19 103.24 2ju4 n GLY 85 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.78 2ju4 n GLY 85 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71