#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 3.09 -0.53 3.17 3.02 -1.26 -4.30 115.26 118.45 2ju4 n ASN 2 Ca 0.00 -1.82 0.00 0.00 -0.03 0.00 0.00 54.58 52.73 2ju4 n ASN 2 Cb 0.00 -0.66 0.00 0.00 -0.61 0.00 0.00 39.78 38.51 2ju4 n ASN 2 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 2ju4 n LEU 3 N 1.74 0.79 -4.71 3.41 0.00 -1.26 -4.83 117.00 112.14 2ju4 n LEU 3 Ca 0.01 -0.40 -0.42 0.00 0.00 0.00 0.00 56.01 55.20 2ju4 n LEU 3 Cb 0.30 -0.35 -0.03 0.00 0.00 0.00 0.00 43.42 43.33 2ju4 n LEU 3 CO 0.01 0.19 1.27 -0.70 0.00 0.00 0.00 177.39 178.15 2ju4 s GLU 4 N -0.92 4.20 0.72 1.96 2.56 -1.26 -4.98 118.70 120.97 2ju4 s GLU 4 Ca 0.00 2.41 -0.11 0.00 0.00 0.00 0.00 54.97 57.27 2ju4 s GLU 4 Cb 0.00 -3.20 0.02 0.00 2.00 0.00 0.00 34.13 32.95 2ju4 s GLU 4 CO 0.00 -0.65 1.07 -1.25 -0.56 0.00 0.00 175.26 173.87 2ju4 s PRO 5 N 1.33 2.77 0.90 4.30 0.04 -1.26 -5.04 135.00 138.05 2ju4 s PRO 5 Ca 0.72 0.92 -0.11 0.00 0.04 0.00 0.00 61.00 62.56 2ju4 s PRO 5 Cb -0.44 -1.97 0.13 0.00 0.04 0.00 0.00 34.50 32.26 2ju4 s PRO 5 CO 0.32 -1.21 1.09 -1.25 0.04 0.00 0.00 177.00 175.99 2ju4 s PRO 6 N -5.05 1.18 -0.42 0.56 0.04 -1.26 -5.03 135.00 125.02 2ju4 s PRO 6 Ca 0.59 0.88 0.08 0.00 0.04 0.00 0.00 61.00 62.59 2ju4 s PRO 6 Cb -0.14 -1.80 0.35 0.00 0.04 0.00 0.00 34.50 32.95 2ju4 s PRO 6 CO 0.55 -2.31 1.06 0.36 0.04 0.00 0.00 177.00 176.70 2ju4 n LYS 7 N -3.94 1.04 -3.36 4.56 -0.00 -1.26 -5.13 118.16 110.08 2ju4 n LYS 7 Ca 0.07 -2.30 -0.03 0.00 -0.00 0.00 0.00 58.31 56.05 2ju4 n LYS 7 Cb 0.55 -1.03 0.02 0.00 -0.00 0.00 0.00 35.03 34.56 2ju4 n LYS 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2ju4 n ALA 8 N 0.17 -2.10 -3.39 0.58 0.00 -1.26 -5.07 120.51 109.44 2ju4 n ALA 8 Ca 0.09 -0.82 -0.24 0.00 0.00 0.00 0.00 53.44 52.46 2ju4 n ALA 8 Cb 0.72 0.47 0.04 0.00 0.00 0.00 0.00 19.45 20.68 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 -0.57 -5.63 -2.91 0.00 2.13 -1.26 -5.06 120.64 107.34 2ju4 n GLU 9 Ca -0.02 0.77 -0.13 0.00 0.66 0.00 0.00 57.16 58.44 2ju4 n GLU 9 Cb 0.46 -5.67 0.02 0.00 0.27 0.00 0.00 31.44 26.53 2ju4 n GLU 9 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 2ju4 n ARG 11 N -4.37 1.05 -0.62 5.31 3.00 -1.26 -5.09 116.66 114.68 2ju4 n ARG 11 Ca -0.04 -2.91 0.00 0.00 -0.01 0.00 0.00 57.85 54.89 2ju4 n ARG 11 Cb 0.58 -1.28 0.00 0.00 0.00 0.00 0.00 32.46 31.76 2ju4 n ARG 11 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 2ju4 n SER 12 N 0.11 -2.53 -0.12 0.55 2.88 -1.26 -4.71 113.62 108.54 2ju4 n SER 12 Ca 0.14 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.68 2ju4 n SER 12 Cb 0.73 -2.50 0.00 0.00 -0.75 0.00 0.00 64.21 61.69 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 0.90 0.00 -0.63 -1.46 0.00 -1.26 -4.84 120.51 113.23 2ju4 n ALA 13 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2ju4 n ALA 13 Cb 0.21 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.66 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 -0.24 0.00 -3.56 0.00 -1.04 -1.26 -5.11 114.28 103.06 2ju4 n THR 14 Ca 0.00 0.00 -0.01 0.00 -2.04 0.00 0.00 64.05 62.00 2ju4 n THR 14 Cb 0.00 0.00 -0.05 0.00 -1.82 0.00 0.00 70.33 68.46 2ju4 n THR 14 CO 0.00 0.00 0.00 -0.60 -0.64 0.00 0.00 175.07 173.83 2ju4 s ARG 15 N 0.00 0.45 -0.35 -2.82 3.52 -1.26 -5.12 118.95 113.36 2ju4 s ARG 15 Ca 0.00 0.96 0.04 0.00 -0.13 0.00 0.00 55.73 56.59 2ju4 s ARG 15 Cb 0.00 0.40 0.16 0.00 -1.56 0.00 0.00 34.95 33.95 2ju4 s ARG 15 CO 0.00 -0.13 0.45 0.54 -0.81 0.00 0.00 175.30 175.35 2ju4 s VAL 16 N 2.13 -0.59 -0.30 7.11 0.11 -1.26 -5.10 120.40 122.51 2ju4 s VAL 16 Ca -0.06 -0.53 -0.10 0.00 -2.93 0.00 0.00 61.98 58.36 2ju4 s VAL 16 Cb -0.07 -0.63 0.18 0.00 -1.53 0.00 0.00 36.38 34.34 2ju4 s VAL 16 CO -0.18 -0.35 0.96 -0.32 -3.33 0.00 0.00 175.10 171.88 2ju4 s MET 17 N 1.90 0.25 0.00 1.54 -2.45 -1.26 -5.17 119.30 114.11 2ju4 s MET 17 Ca 0.14 0.37 0.00 0.00 -1.25 0.00 0.00 55.69 54.96 2ju4 s MET 17 Cb -0.12 0.20 0.00 0.00 1.25 0.00 0.00 34.83 36.16 2ju4 s MET 17 CO -0.13 -0.34 0.00 0.41 1.05 0.00 0.00 175.02 176.01 2ju4 n GLY 18 N 5.37 -1.02 0.00 2.11 0.00 -1.26 -5.04 105.19 105.35 2ju4 n GLY 18 Ca -0.01 -1.66 0.00 0.00 0.00 0.00 0.00 46.02 44.35 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 5.00 -2.87 0.00 -0.02 0.00 -1.26 -5.19 105.19 100.85 2ju4 n GLY 19 Ca 0.00 -0.97 0.00 0.00 0.00 0.00 0.00 46.02 45.05 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 -0.43 0.00 0.00 1.61 -0.02 -1.26 -5.23 135.00 129.67 2ju4 n PRO 20 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 2ju4 n PRO 20 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 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 0.00 0.00 0.00 3.45 5.66 -1.26 -5.22 114.28 116.91 2ju4 n THR 22 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 2ju4 n THR 22 Cb 0.00 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 2ju4 n THR 22 CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 175.07 169.37 2ju4 n PRO 23 N 0.00 2.91 -0.82 1.09 -0.02 -1.26 -5.08 135.00 131.81 2ju4 n PRO 23 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 2ju4 n PRO 23 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 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 0.00 0.00 -0.02 -0.52 1.85 -1.26 -5.05 116.66 111.66 2ju4 n ARG 24 Ca 0.00 0.00 -0.15 0.00 -1.00 0.00 0.00 57.85 56.70 2ju4 n ARG 24 Cb 0.00 0.00 -0.11 0.00 -1.05 0.00 0.00 32.46 31.30 2ju4 n ARG 24 CO 0.00 0.00 0.00 0.87 -0.01 0.00 0.00 177.63 178.49 2ju4 h LYS 25 N 0.00 0.25 -2.30 2.89 1.79 -1.91 -3.47 116.57 113.82 2ju4 h LYS 25 Ca 0.00 -0.24 0.27 0.00 -2.18 0.00 0.00 60.65 58.51 2ju4 h LYS 25 Cb 0.00 0.06 -0.08 0.00 -1.58 0.00 0.00 32.23 30.63 2ju4 h LYS 25 CO 0.00 0.93 -0.44 0.41 -1.08 0.00 0.00 179.45 179.27 2ju4 n GLY 26 N 0.91 -1.90 3.66 3.86 0.00 -1.26 -4.68 105.19 105.78 2ju4 n GLY 26 Ca -0.09 -1.26 -0.42 0.00 0.00 0.00 0.00 46.02 44.25 2ju4 n GLY 26 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2ju4 s PRO 27 N -2.14 4.14 1.06 1.61 0.02 -1.26 -4.97 135.00 133.47 2ju4 s PRO 27 Ca 0.00 2.58 -0.16 0.00 0.02 0.00 0.00 61.00 63.44 2ju4 s PRO 27 Cb 0.00 -4.11 0.09 0.00 0.02 0.00 0.00 34.50 30.50 2ju4 s PRO 27 CO 0.00 -0.94 0.22 -2.30 -0.33 0.00 0.00 177.00 173.65 2ju4 n PRO 28 N 7.37 -1.15 -0.42 5.54 -0.02 -1.26 -4.94 135.00 140.12 2ju4 n PRO 28 Ca 0.20 -0.31 0.00 0.00 -2.02 0.00 0.00 63.50 61.37 2ju4 n PRO 28 Cb 0.41 -1.79 0.00 0.00 -0.02 0.00 0.00 33.50 32.10 2ju4 n PRO 28 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 2ju4 n LYS 29 N -2.10 0.00 0.00 -0.52 4.76 -1.26 -5.13 118.16 113.91 2ju4 n LYS 29 Ca 0.03 0.14 0.00 0.00 -2.87 0.00 0.00 58.31 55.61 2ju4 n LYS 29 Cb 0.59 -0.42 0.00 0.00 -1.84 0.00 0.00 35.03 33.35 2ju4 n LYS 29 CO 0.00 0.00 0.00 0.36 -1.37 0.00 0.00 177.40 176.39 2ju4 n LYS 31 N -0.26 0.00 0.00 1.97 2.85 -1.26 -5.08 118.16 116.38 2ju4 n LYS 31 Ca 0.00 0.00 0.01 0.00 -1.05 0.00 0.00 58.31 57.27 2ju4 n LYS 31 Cb 0.12 0.00 0.07 0.00 -0.65 0.00 0.00 35.03 34.57 2ju4 n LYS 31 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 177.40 178.39 2ju4 n GLN 32 N -0.15 0.25 -3.50 -1.58 3.00 -1.26 -4.75 117.38 109.39 2ju4 n GLN 32 Ca 0.00 0.00 -0.26 0.00 -0.01 0.00 0.00 57.00 56.73 2ju4 n GLN 32 Cb 0.00 -1.15 0.02 0.00 0.00 0.00 0.00 30.24 29.11 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 -0.65 -4.74 0.00 -1.09 0.63 -1.26 -4.95 116.66 104.60 2ju4 n ARG 33 Ca 0.02 0.64 0.00 0.00 -0.92 0.00 0.00 57.85 57.59 2ju4 n ARG 33 Cb 0.01 -5.47 0.00 0.00 0.45 0.00 0.00 32.46 27.45 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 -4.21 2.54 -3.57 -0.14 -0.06 -1.26 -4.90 117.38 105.77 2ju4 n GLN 34 Ca -0.01 0.00 -0.37 0.00 -2.00 0.00 0.00 57.00 54.61 2ju4 n GLN 34 Cb 0.55 0.00 -0.10 0.00 -4.06 0.00 0.00 30.24 26.64 2ju4 n GLN 34 CO 0.00 0.00 0.00 0.99 -0.20 0.00 0.00 177.06 177.85 2ju4 s THR 35 N 0.00 5.30 -0.74 1.69 2.01 -1.26 -4.98 115.64 117.67 2ju4 s THR 35 Ca 0.00 0.29 -0.02 0.00 0.31 0.00 0.00 61.69 62.27 2ju4 s THR 35 Cb 0.00 -3.56 0.30 0.00 0.01 0.00 0.00 72.50 69.25 2ju4 s THR 35 CO 0.00 0.28 2.18 0.54 -0.69 0.00 0.00 174.62 176.93 2ju4 n ARG 36 N 4.68 2.65 -1.35 4.92 3.00 -1.26 -5.17 116.66 124.12 2ju4 n ARG 36 Ca -0.13 -3.21 -0.30 0.00 -0.01 0.00 0.00 57.85 54.20 2ju4 n ARG 36 Cb 0.52 -2.23 0.22 0.00 0.00 0.00 0.00 32.46 30.97 2ju4 n ARG 36 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.63 178.77 2ju4 s GLN 37 N -3.52 -0.54 -0.38 5.56 -2.07 -1.26 -5.00 119.66 112.45 2ju4 s GLN 37 Ca 0.54 -0.14 -0.13 0.00 -1.82 0.00 0.00 55.36 53.82 2ju4 s GLN 37 Cb 0.43 -1.68 -0.09 0.00 -1.09 0.00 0.00 33.01 30.58 2ju4 s GLN 37 CO -0.32 -3.25 1.06 1.17 -1.32 0.00 0.00 175.29 172.63 2ju4 n LYS 39 N -4.42 0.00 -0.05 9.60 0.00 -1.26 -4.97 118.16 117.06 2ju4 n LYS 39 Ca 0.13 0.00 -0.06 0.00 0.00 0.00 0.00 58.31 58.38 2ju4 n LYS 39 Cb 0.59 -0.60 -0.02 0.00 0.00 0.00 0.00 35.03 35.00 2ju4 n LYS 39 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 2ju4 n SER 40 N 4.09 1.55 -4.47 3.14 2.88 -1.26 -4.96 113.62 114.58 2ju4 n SER 40 Ca 0.26 0.25 -0.35 0.00 -1.33 0.00 0.00 58.87 57.70 2ju4 n SER 40 Cb 0.01 -0.62 0.09 0.00 -0.75 0.00 0.00 64.21 62.94 2ju4 n SER 40 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2ju4 n LYS 41 N -4.04 0.17 -0.97 -1.46 4.01 -1.26 -4.83 118.16 109.77 2ju4 n LYS 41 Ca -0.10 0.10 -0.33 0.00 -0.51 0.00 0.00 58.31 57.48 2ju4 n LYS 41 Cb 0.36 -1.89 0.02 0.00 -0.51 0.00 0.00 35.03 33.01 2ju4 n LYS 41 CO 0.00 0.00 0.00 -2.30 -1.11 0.00 0.00 177.40 173.99 2ju4 n PRO 42 N -1.16 0.00 -2.19 1.97 -0.02 -1.26 -4.81 135.00 127.53 2ju4 n PRO 42 Ca 0.10 0.00 -0.42 0.00 -2.02 0.00 0.00 63.50 61.15 2ju4 n PRO 42 Cb 0.51 -0.89 -0.03 0.00 -0.02 0.00 0.00 33.50 33.07 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 -1.42 4.28 0.00 0.52 0.04 -1.26 -4.89 135.00 132.27 2ju4 s PRO 43 Ca 0.41 2.01 0.00 0.00 0.04 0.00 0.00 61.00 63.46 2ju4 s PRO 43 Cb -0.27 -3.54 0.00 0.00 0.04 0.00 0.00 34.50 30.73 2ju4 s PRO 43 CO 0.68 -0.57 0.00 1.63 0.04 0.00 0.00 177.00 178.78 2ju4 n LYS 44 N 5.21 0.00 -2.14 4.56 4.76 -1.26 -4.92 118.16 124.37 2ju4 n LYS 44 Ca 0.13 0.00 -0.42 0.00 -2.87 0.00 0.00 58.31 55.15 2ju4 n LYS 44 Cb 0.43 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.62 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 -1.42 3.55 -2.36 1.97 5.02 -1.26 -4.27 118.16 119.38 2ju4 n LYS 45 Ca 0.00 -3.28 -0.03 0.00 -2.02 0.00 0.00 58.31 52.98 2ju4 n LYS 45 Cb 0.00 -2.97 0.05 0.00 -0.02 0.00 0.00 35.03 32.09 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 3.00 0.31 0.28 0.72 0.00 -1.26 -4.49 105.19 103.75 2ju4 n GLY 46 Ca 0.46 -0.07 0.16 0.00 0.00 0.00 0.00 46.02 46.57 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 1.50 0.23 0.00 1.61 2.07 -1.98 -3.38 116.25 116.30 2ju4 h VAL 47 Ca -0.34 -0.47 0.00 0.00 0.82 0.00 0.00 66.70 66.72 2ju4 h VAL 47 Cb 1.20 1.37 0.00 0.00 -1.52 0.00 0.00 31.29 32.35 2ju4 h VAL 47 CO -0.12 0.06 0.00 1.67 0.02 0.00 0.00 177.57 179.20 2ju4 n GLN 48 N -3.29 0.00 0.00 1.57 0.00 -1.26 -5.09 117.38 109.31 2ju4 n GLN 48 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 56.99 2ju4 n GLN 48 Cb 0.24 -0.34 0.00 0.00 0.00 0.00 0.00 30.24 30.15 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 0.45 0.00 0.00 1.69 0.00 -1.26 -4.78 105.19 101.28 2ju4 n GLY 49 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 0.00 0.00 -0.02 0.00 -1.26 -4.84 105.19 99.07 2ju4 n GLY 51 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.08 -1.26 -5.05 116.55 111.62 2ju4 n ASP 52 Ca 0.00 -0.62 0.00 0.00 -1.51 0.00 0.00 54.79 52.66 2ju4 n ASP 52 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 2ju4 n ASP 52 CO 0.00 0.00 0.00 -0.90 0.12 0.00 0.00 177.20 176.42 2ju4 n ASP 53 N -1.85 0.00 -3.08 1.67 5.75 -1.26 -4.89 116.55 112.89 2ju4 n ASP 53 Ca 0.00 -0.40 -0.16 0.00 -0.01 0.00 0.00 54.79 54.22 2ju4 n ASP 53 Cb 0.00 0.00 -0.04 0.00 -1.03 0.00 0.00 41.12 40.05 2ju4 n ASP 53 CO 0.00 0.00 0.00 2.30 -0.11 0.00 0.00 177.20 179.39 2ju4 n ILE 54 N 0.00 -0.61 -1.89 2.12 -5.35 -1.26 -5.05 119.36 107.32 2ju4 n ILE 54 Ca 0.00 -2.25 -0.42 0.00 -0.27 0.00 0.00 62.75 59.80 2ju4 n ILE 54 Cb 0.20 -0.34 0.00 0.00 -1.74 0.00 0.00 39.64 37.76 2ju4 n ILE 54 CO 0.00 0.00 0.00 -0.81 -1.76 0.00 0.00 176.55 173.98 2ju4 n PRO 55 N 2.83 2.92 0.00 6.28 -0.04 -1.26 -4.00 135.00 141.73 2ju4 n PRO 55 Ca 0.24 -2.73 0.00 0.00 -0.04 0.00 0.00 63.50 60.97 2ju4 n PRO 55 Cb 0.52 -3.32 0.00 0.00 -0.04 0.00 0.00 33.50 30.66 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 4.31 -1.13 3.57 0.55 0.00 -1.26 -5.05 105.19 106.18 2ju4 n GLY 56 Ca 0.51 0.47 -0.24 0.00 0.00 0.00 0.00 46.02 46.76 2ju4 n GLY 56 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2ju4 s MET 57 N 0.00 2.22 0.00 1.61 0.00 -1.26 -4.92 119.30 116.96 2ju4 s MET 57 Ca 0.00 -0.48 0.00 0.00 0.00 0.00 0.00 55.69 55.21 2ju4 s MET 57 Cb 0.00 -5.07 0.00 0.00 0.00 0.00 0.00 34.83 29.76 2ju4 s MET 57 CO 0.00 -4.00 0.00 -0.85 0.00 0.00 0.00 175.02 170.17 2ju4 n GLU 58 N 8.58 0.25 -2.75 4.11 0.00 -1.26 -5.04 120.64 124.53 2ju4 n GLU 58 Ca 0.43 0.00 -0.07 0.00 0.00 0.00 0.00 57.16 57.52 2ju4 n GLU 58 Cb 0.46 0.00 0.04 0.00 0.00 0.00 0.00 31.44 31.94 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 -0.23 2.37 -1.84 0.00 -1.26 -5.13 105.19 104.10 2ju4 n GLY 59 Ca 0.00 0.28 -0.30 0.00 0.00 0.00 0.00 46.02 46.01 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 2.05 5.04 2.49 -0.02 0.00 -1.26 -5.09 105.19 108.41 2ju4 n GLY 61 Ca 0.12 -1.95 -0.17 0.00 0.00 0.00 0.00 46.02 44.01 2ju4 n GLY 61 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2ju4 n THR 62 N -0.15 -0.02 0.52 2.61 -2.24 -1.26 -4.80 114.28 108.93 2ju4 n THR 62 Ca 0.50 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.28 2ju4 n THR 62 Cb 0.53 -1.74 0.00 0.00 -2.10 0.00 0.00 70.33 67.01 2ju4 n THR 62 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2ju4 n ASP 63 N -0.77 0.88 0.00 3.42 -0.08 -1.26 -2.55 116.55 116.18 2ju4 n ASP 63 Ca -0.17 -1.04 0.00 0.00 -1.51 0.00 0.00 54.79 52.07 2ju4 n ASP 63 Cb 0.56 -0.26 0.00 0.00 2.34 0.00 0.00 41.12 43.76 2ju4 n ASP 63 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2ju4 n ILE 64 N 0.41 0.00 0.07 5.18 3.06 -1.05 -4.33 119.36 122.70 2ju4 n ILE 64 Ca 0.00 0.00 -0.03 0.00 -2.50 0.00 0.00 62.75 60.22 2ju4 n ILE 64 Cb 0.17 0.01 -0.07 0.00 0.54 0.00 0.00 39.64 40.30 2ju4 n ILE 64 CO 0.00 0.00 0.00 0.74 -2.50 0.00 0.00 176.55 174.79 2ju4 h THR 65 N 0.00 1.16 0.00 9.51 2.02 -1.88 -3.40 112.91 120.32 2ju4 h THR 65 Ca 0.00 -2.74 0.00 0.00 0.77 0.00 0.00 66.41 64.44 2ju4 h THR 65 Cb 0.00 2.54 0.00 0.00 -1.74 0.00 0.00 68.15 68.95 2ju4 h THR 65 CO 0.00 0.66 -0.16 0.52 0.37 0.00 0.00 175.52 176.91 2ju4 n VAL 66 N -3.21 0.00 -4.11 3.16 0.31 -1.19 -5.15 118.33 108.16 2ju4 n VAL 66 Ca -0.03 0.00 -0.15 0.00 -0.01 0.00 0.00 64.34 64.15 2ju4 n VAL 66 Cb 0.87 0.03 -0.12 0.00 -0.91 0.00 0.00 33.84 33.71 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 -0.51 0.71 0.18 2.52 1.09 -1.20 -5.09 121.20 118.89 2ju4 s ILE 67 Ca 0.00 -1.10 0.10 0.00 -1.10 0.00 0.00 60.65 58.54 2ju4 s ILE 67 Cb 0.00 -0.74 -0.10 0.00 -1.06 0.00 0.00 42.46 40.57 2ju4 s ILE 67 CO 0.00 -0.30 1.46 -0.65 -0.10 0.00 0.00 174.94 175.34 2ju4 h PRO 69 N 4.52 0.00 -0.11 2.79 0.11 -1.97 -2.79 132.00 134.56 2ju4 h PRO 69 Ca -0.37 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.74 2ju4 h PRO 69 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2ju4 h PRO 69 CO 0.41 0.77 0.00 -2.67 -0.21 0.00 0.00 178.00 176.30 2ju4 n TRP 70 N -3.55 0.00 0.00 0.65 2.14 -1.26 -2.00 117.44 113.41 2ju4 n TRP 70 Ca -0.00 0.00 0.00 0.00 2.07 0.00 0.00 57.50 59.57 2ju4 n TRP 70 Cb 0.76 -0.01 0.00 0.00 -0.81 0.00 0.00 31.31 31.25 2ju4 n TRP 70 CO 0.00 0.00 0.00 0.39 2.07 0.00 0.00 177.69 180.15 2ju4 n GLU 71 N -0.25 3.83 0.00 -2.67 -0.58 -1.26 -4.92 120.64 114.79 2ju4 n GLU 71 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 2ju4 n GLU 71 Cb 0.03 -0.57 0.00 0.00 -0.57 0.00 0.00 31.44 30.33 2ju4 n GLU 71 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2ju4 n ALA 72 N -0.35 -0.09 0.00 0.62 0.00 -0.85 -4.20 120.51 115.64 2ju4 n ALA 72 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2ju4 n ALA 72 Cb 0.02 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.47 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 -1.85 0.00 -2.23 0.00 4.13 -1.23 -3.98 115.26 110.09 2ju4 n ASN 74 Ca 0.00 0.00 -0.00 0.00 1.68 0.00 0.00 54.58 56.26 2ju4 n ASN 74 Cb 0.00 0.00 -0.00 0.00 -1.54 0.00 0.00 39.78 38.24 2ju4 n ASN 74 CO 0.00 0.00 0.00 1.57 0.28 0.00 0.00 177.26 179.11 2ju4 n HIS 75 N 0.00 -1.21 0.00 3.10 -0.00 -1.26 -5.07 115.22 110.78 2ju4 n HIS 75 Ca 0.00 0.72 0.00 0.00 0.46 0.00 0.00 57.72 58.90 2ju4 n HIS 75 Cb 0.00 -1.72 0.00 0.00 -0.12 0.00 0.00 29.99 28.15 2ju4 n HIS 75 CO 0.00 0.00 0.00 0.39 0.46 0.00 0.00 176.34 177.19 2ju4 n GLU 77 N 2.03 0.00 -3.71 1.57 -0.58 -1.26 -5.13 120.64 113.56 2ju4 n GLU 77 Ca -0.02 0.00 -0.12 0.00 -0.42 0.00 0.00 57.16 56.61 2ju4 n GLU 77 Cb 0.03 0.00 -0.12 0.00 -0.57 0.00 0.00 31.44 30.78 2ju4 n GLU 77 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 2ju4 s LEU 78 N 0.00 0.14 -0.15 -4.62 2.96 -1.26 -5.15 118.68 110.59 2ju4 s LEU 78 Ca 0.00 0.69 -0.15 0.00 -0.22 0.00 0.00 54.13 54.45 2ju4 s LEU 78 Cb 0.00 1.00 0.04 0.00 0.50 0.00 0.00 46.19 47.73 2ju4 s LEU 78 CO 0.00 -0.18 0.43 -1.00 -1.32 0.00 0.00 176.35 174.28 2ju4 s HIS 79 N 1.42 -0.46 0.00 5.38 3.76 -1.26 -5.05 115.29 119.08 2ju4 s HIS 79 Ca -0.09 1.12 0.00 0.00 -0.15 0.00 0.00 55.06 55.95 2ju4 s HIS 79 Cb -0.10 0.16 0.00 0.00 1.11 0.00 0.00 32.58 33.75 2ju4 s HIS 79 CO -0.10 -0.24 0.00 0.39 -0.85 0.00 0.00 174.74 173.94 2ju4 n GLU 80 N 2.77 0.00 0.08 1.40 1.02 -1.26 -4.89 120.64 119.76 2ju4 n GLU 80 Ca -0.14 0.00 -0.08 0.00 -0.02 0.00 0.00 57.16 56.92 2ju4 n GLU 80 Cb 0.57 -0.11 -0.05 0.00 -0.02 0.00 0.00 31.44 31.83 2ju4 n GLU 80 CO 0.00 0.00 0.00 1.37 1.18 0.00 0.00 177.13 179.68 2ju4 h LEU 81 N 0.00 0.15 -8.45 -4.62 8.10 -1.96 -3.42 115.31 105.11 2ju4 h LEU 81 Ca 0.00 -0.13 -0.21 0.00 0.11 0.00 0.00 57.88 57.64 2ju4 h LEU 81 Cb 0.00 -0.05 0.00 0.00 -0.44 0.00 0.00 40.66 40.17 2ju4 h LEU 81 CO 0.00 1.01 0.74 0.00 -4.11 0.00 0.00 178.44 176.07 2ju4 s ALA 82 N -2.98 1.14 0.00 0.17 0.00 -1.26 -3.98 121.76 114.84 2ju4 s ALA 82 Ca -0.01 -0.49 0.00 0.00 0.00 0.00 0.00 51.96 51.46 2ju4 s ALA 82 Cb 0.10 -4.48 0.00 0.00 0.00 0.00 0.00 23.12 18.74 2ju4 s ALA 82 CO 0.82 -5.25 0.00 0.94 0.00 0.00 0.00 175.76 172.27 2ju4 n GLN 83 N 8.91 0.00 -0.41 0.00 -0.06 -1.26 -4.82 117.38 119.75 2ju4 n GLN 83 Ca 0.42 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.42 2ju4 n GLN 83 Cb 0.48 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.66 2ju4 n GLN 83 CO 0.00 0.00 0.00 2.48 -0.20 0.00 0.00 177.06 179.34 2ju4 n TYR 84 N 0.00 0.00 0.00 3.69 0.18 -1.26 -4.88 117.16 114.89 2ju4 n TYR 84 Ca 0.00 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.78 2ju4 n TYR 84 Cb 0.00 -0.03 0.00 0.00 -0.38 0.00 0.00 39.34 38.93 2ju4 n TYR 84 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 2ju4 n GLY 85 N 0.00 0.00 2.52 -7.48 0.00 -1.26 -4.84 105.19 94.13 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