#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 -0.39 -3.46 6.12 7.08 -2.12 -3.43 115.58 119.38 2ju4 h ASN 2 Ca 0.00 0.01 -0.53 0.00 -3.08 0.00 0.00 56.30 52.70 2ju4 h ASN 2 Cb 0.00 0.10 0.09 0.00 -2.08 0.00 0.00 38.32 36.43 2ju4 h ASN 2 CO 0.00 -0.21 0.87 -1.48 -2.08 0.00 0.00 177.43 174.53 2ju4 s LEU 3 N -6.65 4.34 0.69 6.14 0.05 -1.26 -4.94 118.68 117.05 2ju4 s LEU 3 Ca -0.07 2.99 -0.16 0.00 0.05 0.00 0.00 54.13 56.94 2ju4 s LEU 3 Cb 0.01 -3.64 0.02 0.00 -2.05 0.00 0.00 46.19 40.52 2ju4 s LEU 3 CO 0.20 -0.92 1.18 -1.61 -0.55 0.00 0.00 176.35 174.66 2ju4 s GLU 4 N -0.86 2.43 1.05 1.48 0.41 -1.26 -4.97 118.70 116.99 2ju4 s GLU 4 Ca 0.61 1.68 -0.13 0.00 -0.41 0.00 0.00 54.97 56.72 2ju4 s GLU 4 Cb -0.48 -1.88 0.16 0.00 -1.78 0.00 0.00 34.13 30.16 2ju4 s GLU 4 CO 0.52 -1.59 0.71 -0.35 -0.49 0.00 0.00 175.26 174.05 2ju4 n PRO 5 N -2.46 -1.31 -1.46 0.39 -0.04 -1.26 -4.96 135.00 123.89 2ju4 n PRO 5 Ca 0.13 -0.34 -0.33 0.00 -0.04 0.00 0.00 63.50 62.92 2ju4 n PRO 5 Cb 0.51 -2.06 0.08 0.00 -0.04 0.00 0.00 33.50 31.99 2ju4 n PRO 5 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 2ju4 s PRO 6 N -4.10 2.31 0.61 0.54 0.04 -1.26 -4.96 135.00 128.18 2ju4 s PRO 6 Ca 0.63 1.49 -0.19 0.00 0.04 0.00 0.00 61.00 62.97 2ju4 s PRO 6 Cb -0.21 -1.88 -0.03 0.00 0.04 0.00 0.00 34.50 32.42 2ju4 s PRO 6 CO 0.64 -1.65 1.26 0.36 0.04 0.00 0.00 177.00 177.66 2ju4 n LYS 7 N -2.88 1.26 0.00 4.56 -0.00 -1.26 -5.02 118.16 114.82 2ju4 n LYS 7 Ca 0.11 0.48 0.00 0.00 -0.00 0.00 0.00 58.31 58.90 2ju4 n LYS 7 Cb 0.52 -2.49 0.00 0.00 -0.00 0.00 0.00 35.03 33.06 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 -1.62 0.00 -0.73 0.58 0.00 -1.26 -5.24 120.51 112.24 2ju4 n ALA 8 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.58 2ju4 n ALA 8 Cb 0.47 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.92 2ju4 n ALA 8 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2ju4 n GLU 9 N 0.00 0.00 0.00 0.00 -0.58 -1.26 -5.22 120.64 113.58 2ju4 n GLU 9 Ca 0.00 0.05 0.00 0.00 -0.42 0.00 0.00 57.16 56.79 2ju4 n GLU 9 Cb 0.00 -0.30 0.00 0.00 -0.57 0.00 0.00 31.44 30.57 2ju4 n GLU 9 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2ju4 n ARG 11 N -1.49 0.00 0.00 3.49 3.00 -1.26 -5.19 116.66 115.22 2ju4 n ARG 11 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.84 2ju4 n ARG 11 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.46 2ju4 n ARG 11 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.63 178.06 2ju4 n SER 12 N 0.00 0.00 0.00 0.55 7.64 -1.26 -4.67 113.62 115.88 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 0.16 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.36 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 5.30 0.00 -2.69 -0.43 0.00 -1.26 -4.24 120.51 117.19 2ju4 n ALA 13 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.40 2ju4 n ALA 13 Cb 0.00 0.00 0.12 0.00 0.00 0.00 0.00 19.45 19.57 2ju4 n ALA 13 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 2ju4 n THR 14 N -0.28 0.08 -0.89 0.00 5.66 -1.26 -5.14 114.28 112.45 2ju4 n THR 14 Ca 0.00 -1.35 0.11 0.00 -3.05 0.00 0.00 64.05 59.75 2ju4 n THR 14 Cb 0.00 1.00 -0.03 0.00 -1.55 0.00 0.00 70.33 69.75 2ju4 n THR 14 CO 0.00 0.00 0.00 -1.14 -3.05 0.00 0.00 175.07 170.88 2ju4 n ARG 15 N -1.07 -1.61 0.00 1.09 0.63 -1.26 -4.34 116.66 110.10 2ju4 n ARG 15 Ca -0.10 1.06 0.00 0.00 -0.92 0.00 0.00 57.85 57.89 2ju4 n ARG 15 Cb 0.86 -1.96 0.00 0.00 0.45 0.00 0.00 32.46 31.81 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 -2.58 0.00 -3.85 5.15 0.31 -1.26 -4.85 118.33 111.24 2ju4 n VAL 16 Ca 0.01 0.66 -0.12 0.00 -0.01 0.00 0.00 64.34 64.88 2ju4 n VAL 16 Cb 0.36 -1.37 -0.11 0.00 -0.91 0.00 0.00 33.84 31.81 2ju4 n VAL 16 CO 0.00 0.00 0.00 -0.04 -1.32 0.00 0.00 176.83 175.47 2ju4 s MET 17 N -0.31 0.30 1.20 5.55 -1.94 -1.26 -5.11 119.30 117.73 2ju4 s MET 17 Ca 0.00 -0.10 0.00 0.00 -1.71 0.00 0.00 55.69 53.88 2ju4 s MET 17 Cb 0.00 0.13 0.00 0.00 2.01 0.00 0.00 34.83 36.97 2ju4 s MET 17 CO 0.00 -0.06 0.00 0.41 -0.01 0.00 0.00 175.02 175.36 2ju4 n GLY 18 N 2.29 -0.69 0.00 -0.03 0.00 -1.26 -4.73 105.19 100.77 2ju4 n GLY 18 Ca -0.17 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.18 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 -0.36 -3.55 3.20 -0.02 0.00 -1.26 -4.90 105.19 98.30 2ju4 n GLY 19 Ca 0.00 -1.20 -0.35 0.00 0.00 0.00 0.00 46.02 44.47 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 -0.77 -0.59 0.00 1.61 -0.02 -1.26 -4.92 135.00 129.05 2ju4 n PRO 20 Ca 0.00 -0.16 0.00 0.00 -2.02 0.00 0.00 63.50 61.32 2ju4 n PRO 20 Cb 0.00 -1.44 0.00 0.00 -0.02 0.00 0.00 33.50 32.04 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 -3.63 0.00 -1.44 3.45 5.66 -1.26 -5.13 114.28 111.93 2ju4 n THR 22 Ca 0.01 0.00 -0.53 0.00 -3.05 0.00 0.00 64.05 60.48 2ju4 n THR 22 Cb 0.62 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.34 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 -0.33 0.00 -3.78 1.09 -0.02 -1.26 -4.95 135.00 125.75 2ju4 n PRO 23 Ca 0.00 0.00 -0.30 0.00 -2.02 0.00 0.00 63.50 61.18 2ju4 n PRO 23 Cb 0.00 -1.26 -0.14 0.00 -0.02 0.00 0.00 33.50 32.08 2ju4 n PRO 23 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 2ju4 s ARG 24 N -0.45 1.10 0.49 -0.52 3.52 -1.26 -5.12 118.95 116.71 2ju4 s ARG 24 Ca 0.78 -1.61 0.01 0.00 -0.13 0.00 0.00 55.73 54.78 2ju4 s ARG 24 Cb -1.10 -2.36 0.10 0.00 -1.56 0.00 0.00 34.95 30.02 2ju4 s ARG 24 CO 0.56 -1.05 0.67 0.36 -0.81 0.00 0.00 175.30 175.04 2ju4 n LYS 25 N 4.20 0.22 -3.51 5.12 2.85 -1.26 -5.13 118.16 120.65 2ju4 n LYS 25 Ca 0.03 -1.96 -0.09 0.00 -1.05 0.00 0.00 58.31 55.24 2ju4 n LYS 25 Cb 0.39 -0.41 -0.03 0.00 -0.65 0.00 0.00 35.03 34.33 2ju4 n LYS 25 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 177.40 177.55 2ju4 s GLY 26 N -4.21 -0.45 -0.37 2.58 0.00 -1.26 -5.12 107.32 98.49 2ju4 s GLY 26 Ca 0.46 1.14 -0.44 0.00 0.00 0.00 0.00 44.72 45.88 2ju4 s GLY 26 CO 0.30 0.46 1.58 -1.05 0.00 0.00 0.00 173.10 174.38 2ju4 n PRO 27 N -0.06 0.35 -1.59 2.90 -0.02 -1.26 -4.79 135.00 130.53 2ju4 n PRO 27 Ca -0.10 0.13 -0.53 0.00 -2.02 0.00 0.00 63.50 60.98 2ju4 n PRO 27 Cb 0.61 -1.68 -0.06 0.00 -0.02 0.00 0.00 33.50 32.35 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 4.08 1.06 -2.79 0.52 -0.02 -1.26 -5.15 135.00 131.44 2ju4 n PRO 28 Ca 0.28 0.38 0.00 0.00 -2.02 0.00 0.00 63.50 62.15 2ju4 n PRO 28 Cb 0.01 -2.02 0.01 0.00 -0.02 0.00 0.00 33.50 31.49 2ju4 n PRO 28 CO 0.00 0.00 0.00 0.21 1.98 0.00 0.00 175.50 177.69 2ju4 s LYS 29 N 0.69 0.29 0.00 -0.52 2.47 -1.26 -5.25 119.74 116.15 2ju4 s LYS 29 Ca 0.86 -0.15 0.00 0.00 -1.56 0.00 0.00 55.97 55.12 2ju4 s LYS 29 Cb -0.99 0.02 0.00 0.00 -1.46 0.00 0.00 37.83 35.40 2ju4 s LYS 29 CO 0.49 -0.40 0.00 0.36 0.16 0.00 0.00 175.35 175.96 2ju4 n LYS 31 N 3.49 0.00 -2.92 4.03 2.85 -1.26 -5.10 118.16 119.25 2ju4 n LYS 31 Ca 0.08 0.00 -0.02 0.00 -1.05 0.00 0.00 58.31 57.32 2ju4 n LYS 31 Cb 0.63 0.00 -0.01 0.00 -0.65 0.00 0.00 35.03 34.99 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 0.00 -2.37 -0.27 -1.58 1.13 -1.26 -4.92 117.38 108.11 2ju4 n GLN 32 Ca 0.00 2.00 -0.17 0.00 -1.94 0.00 0.00 57.00 56.89 2ju4 n GLN 32 Cb 0.00 -2.56 0.16 0.00 0.11 0.00 0.00 30.24 27.95 2ju4 n GLN 32 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 2ju4 n ARG 33 N 1.94 -3.20 0.00 -1.09 1.74 -1.26 -4.96 116.66 109.83 2ju4 n ARG 33 Ca -0.13 -0.88 0.00 0.00 -0.77 0.00 0.00 57.85 56.07 2ju4 n ARG 33 Cb 0.28 -1.03 0.00 0.00 -1.02 0.00 0.00 32.46 30.69 2ju4 n ARG 33 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2ju4 n GLN 34 N -3.92 0.00 -3.30 5.56 6.02 -1.26 -4.75 117.38 115.73 2ju4 n GLN 34 Ca 0.08 0.00 -0.20 0.00 -0.01 0.00 0.00 57.00 56.87 2ju4 n GLN 34 Cb 0.34 -0.23 -0.08 0.00 1.02 0.00 0.00 30.24 31.29 2ju4 n GLN 34 CO 0.00 0.00 0.00 0.95 -1.01 0.00 0.00 177.06 177.00 2ju4 s THR 35 N 0.00 -0.16 0.36 5.09 -4.23 -1.26 -4.99 115.64 110.45 2ju4 s THR 35 Ca 0.00 -1.60 0.16 0.00 -1.18 0.00 0.00 61.69 59.08 2ju4 s THR 35 Cb 0.00 -0.81 0.35 0.00 1.34 0.00 0.00 72.50 73.39 2ju4 s THR 35 CO 0.00 -0.76 1.68 0.03 -0.54 0.00 0.00 174.62 175.03 2ju4 h ARG 36 N 6.32 0.31 0.00 3.99 2.47 -2.00 -3.45 114.38 122.02 2ju4 h ARG 36 Ca 0.12 -0.02 0.00 0.00 -1.26 0.00 0.00 59.98 58.82 2ju4 h ARG 36 Cb 1.01 -0.07 0.00 0.00 -1.65 0.00 0.00 29.97 29.26 2ju4 h ARG 36 CO 0.23 0.21 0.00 1.04 0.56 0.00 0.00 179.97 182.01 2ju4 n GLN 37 N -4.95 0.00 0.00 0.04 6.02 -1.26 -5.20 117.38 112.04 2ju4 n GLN 37 Ca 0.31 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.30 2ju4 n GLN 37 Cb 1.01 0.00 0.00 0.00 1.02 0.00 0.00 30.24 32.27 2ju4 n GLN 37 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 2ju4 n LYS 39 N 0.00 0.00 0.00 -1.09 5.02 -1.26 -4.70 118.16 116.13 2ju4 n LYS 39 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2ju4 n LYS 39 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 2ju4 n LYS 39 CO 0.00 0.00 0.00 0.43 -0.52 0.00 0.00 177.40 177.31 2ju4 n SER 40 N 0.00 0.00 -4.69 4.39 7.64 -1.26 -4.70 113.62 115.00 2ju4 n SER 40 Ca 0.00 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.47 2ju4 n SER 40 Cb 0.00 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.16 2ju4 n SER 40 CO 0.00 0.00 0.00 -1.59 -3.01 0.00 0.00 175.04 170.44 2ju4 s LYS 41 N 0.00 4.41 0.69 1.43 0.00 -1.26 -5.04 119.74 119.97 2ju4 s LYS 41 Ca 0.00 1.15 -0.11 0.00 0.00 0.00 0.00 55.97 57.01 2ju4 s LYS 41 Cb 0.00 -3.51 0.00 0.00 0.00 0.00 0.00 37.83 34.32 2ju4 s LYS 41 CO 0.00 -0.17 1.06 -1.25 0.00 0.00 0.00 175.35 174.99 2ju4 s PRO 42 N 1.56 3.00 0.91 1.78 0.04 -1.26 -5.05 135.00 135.99 2ju4 s PRO 42 Ca 0.43 0.78 -0.11 0.00 0.04 0.00 0.00 61.00 62.14 2ju4 s PRO 42 Cb -0.18 -2.01 0.14 0.00 0.04 0.00 0.00 34.50 32.49 2ju4 s PRO 42 CO 0.18 -1.01 1.09 -1.25 0.04 0.00 0.00 177.00 176.06 2ju4 s PRO 43 N -5.14 1.09 0.00 0.56 0.04 -1.26 -4.99 135.00 125.30 2ju4 s PRO 43 Ca 0.58 0.94 0.00 0.00 0.04 0.00 0.00 61.00 62.56 2ju4 s PRO 43 Cb -0.13 -1.78 0.00 0.00 0.04 0.00 0.00 34.50 32.63 2ju4 s PRO 43 CO 0.54 -2.39 0.00 1.17 0.04 0.00 0.00 177.00 176.36 2ju4 n LYS 44 N -4.00 0.00 0.00 4.56 4.81 -1.26 -4.97 118.16 117.30 2ju4 n LYS 44 Ca 0.07 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.51 2ju4 n LYS 44 Cb 0.55 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.60 2ju4 n LYS 44 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 2ju4 n LYS 45 N -1.52 0.00 0.00 1.64 4.81 -1.26 -4.30 118.16 117.54 2ju4 n LYS 45 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 2ju4 n LYS 45 Cb 0.00 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.05 2ju4 n LYS 45 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2ju4 n GLY 46 N 0.00 0.13 0.11 3.14 0.00 -1.26 -4.85 105.19 102.46 2ju4 n GLY 46 Ca 0.00 0.11 0.03 0.00 0.00 0.00 0.00 46.02 46.16 2ju4 n GLY 46 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2ju4 n VAL 47 N 0.00 0.51 0.00 1.61 0.24 -1.26 -3.78 118.33 115.65 2ju4 n VAL 47 Ca 0.00 0.66 0.00 0.00 -2.04 0.00 0.00 64.34 62.96 2ju4 n VAL 47 Cb 0.00 -1.66 0.00 0.00 -1.47 0.00 0.00 33.84 30.71 2ju4 n VAL 47 CO 0.00 0.00 0.00 1.67 -2.14 0.00 0.00 176.83 176.36 2ju4 n GLN 48 N -1.67 0.00 -0.45 7.34 0.00 -1.26 -5.23 117.38 116.10 2ju4 n GLN 48 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 57.00 2ju4 n GLN 48 Cb 0.42 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.66 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 -0.53 -0.89 1.35 1.69 0.00 -1.25 -5.09 105.19 100.47 2ju4 n GLY 49 Ca 0.00 -0.64 -0.07 0.00 0.00 0.00 0.00 46.02 45.31 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 0.31 1.70 0.00 -0.02 0.00 -1.26 -4.94 105.19 100.97 2ju4 n GLY 51 Ca 0.00 -2.13 0.10 0.00 0.00 0.00 0.00 46.02 43.99 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 -2.81 0.00 -3.63 1.61 5.68 -1.26 -4.12 116.55 112.03 2ju4 n ASP 52 Ca 0.06 -1.16 -0.16 0.00 -0.50 0.00 0.00 54.79 53.03 2ju4 n ASP 52 Cb 0.21 0.00 -0.07 0.00 -1.14 0.00 0.00 41.12 40.11 2ju4 n ASP 52 CO 0.00 0.00 0.00 1.51 -1.33 0.00 0.00 177.20 177.38 2ju4 s ASP 53 N -1.72 -0.51 -0.42 -1.12 1.47 -1.26 -5.06 116.67 108.05 2ju4 s ASP 53 Ca 0.29 0.65 -0.10 0.00 1.18 0.00 0.00 52.55 54.57 2ju4 s ASP 53 Cb 0.13 0.63 0.07 0.00 -0.34 0.00 0.00 42.92 43.42 2ju4 s ASP 53 CO 0.22 -0.47 0.27 -0.63 0.68 0.00 0.00 175.17 175.25 2ju4 s ILE 54 N -0.87 4.35 -0.96 2.11 1.01 -1.26 -4.93 121.20 120.65 2ju4 s ILE 54 Ca -0.09 -1.33 0.28 0.00 0.00 0.00 0.00 60.65 59.51 2ju4 s ILE 54 Cb -0.02 -3.64 0.24 0.00 0.01 0.00 0.00 42.46 39.04 2ju4 s ILE 54 CO 0.06 -0.50 1.88 -0.81 0.00 0.00 0.00 174.94 175.58 2ju4 n PRO 55 N 4.95 0.04 0.00 2.79 -0.04 -1.26 -3.16 135.00 138.32 2ju4 n PRO 55 Ca -0.10 0.03 0.14 0.00 -0.04 0.00 0.00 63.50 63.53 2ju4 n PRO 55 Cb 0.43 -1.54 0.59 0.00 -0.04 0.00 0.00 33.50 32.94 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 1.47 -0.41 1.57 0.55 0.00 -1.26 -4.88 105.19 102.24 2ju4 n GLY 56 Ca 0.07 -0.37 0.00 0.00 0.00 0.00 0.00 46.02 45.72 2ju4 n GLY 56 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 2ju4 n MET 57 N -0.32 -1.81 0.00 1.61 0.00 -1.19 -3.80 117.12 111.62 2ju4 n MET 57 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.88 2ju4 n MET 57 Cb 0.30 -3.86 0.00 0.00 0.00 0.00 0.00 33.22 29.66 2ju4 n MET 57 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 175.97 174.06 2ju4 n GLU 58 N -1.55 0.00 -2.54 3.17 2.13 -1.26 -5.20 120.64 115.39 2ju4 n GLU 58 Ca 0.00 0.00 0.01 0.00 0.66 0.00 0.00 57.16 57.83 2ju4 n GLU 58 Cb 0.21 0.00 0.01 0.00 0.27 0.00 0.00 31.44 31.93 2ju4 n GLU 58 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2ju4 n GLY 59 N -0.39 0.61 2.34 8.31 0.00 -1.25 -5.06 105.19 109.76 2ju4 n GLY 59 Ca 0.00 -0.93 -0.32 0.00 0.00 0.00 0.00 46.02 44.77 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 -0.31 5.50 3.23 -0.02 0.00 -1.26 -5.04 105.19 107.28 2ju4 n GLY 61 Ca 0.01 -2.12 0.00 0.00 0.00 0.00 0.00 46.02 43.91 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 -0.61 0.00 0.07 2.61 5.66 -1.26 0.22 114.28 120.97 2ju4 n THR 62 Ca 0.56 0.00 -0.13 0.00 -3.05 0.00 0.00 64.05 61.43 2ju4 n THR 62 Cb 0.59 0.00 -0.08 0.00 -1.55 0.00 0.00 70.33 69.29 2ju4 n THR 62 CO 0.00 0.00 0.00 0.44 -3.05 0.00 0.00 175.07 172.46 2ju4 h ASP 63 N 0.00 -0.15 -1.06 1.09 5.19 -1.98 -2.75 116.42 116.75 2ju4 h ASP 63 Ca 0.00 -0.25 0.31 0.00 -0.62 0.00 0.00 57.03 56.47 2ju4 h ASP 63 Cb 0.00 0.04 -0.13 0.00 0.18 0.00 0.00 39.33 39.42 2ju4 h ASP 63 CO 0.00 0.17 0.65 0.40 -3.12 0.00 0.00 179.24 177.34 2ju4 h ILE 64 N -0.49 0.38 -0.84 0.35 5.03 0.25 1.01 117.51 123.21 2ju4 h ILE 64 Ca -0.02 -0.12 0.02 0.00 -0.12 0.00 0.00 64.86 64.62 2ju4 h ILE 64 Cb 0.39 -0.01 -0.05 0.00 -3.03 0.00 0.00 36.82 34.12 2ju4 h ILE 64 CO 0.03 0.07 0.55 0.74 -0.68 0.00 0.00 178.15 178.86 2ju4 h THR 65 N 0.36 1.17 0.00 -0.27 2.02 -0.84 -3.15 112.91 112.19 2ju4 h THR 65 Ca 0.69 -0.37 -0.06 0.00 0.77 0.00 0.00 66.41 67.44 2ju4 h THR 65 Cb 1.67 -0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 68.07 2ju4 h THR 65 CO -0.46 0.20 -0.41 0.58 0.37 0.00 0.00 175.52 175.79 2ju4 h VAL 66 N 1.07 0.91 -3.76 3.16 2.07 0.90 -3.49 116.25 117.10 2ju4 h VAL 66 Ca 0.32 -1.81 -0.31 0.00 0.82 0.00 0.00 66.70 65.72 2ju4 h VAL 66 Cb -0.03 1.84 -0.15 0.00 -1.52 0.00 0.00 31.29 31.44 2ju4 h VAL 66 CO -0.09 0.31 -0.65 -0.63 0.02 0.00 0.00 177.57 176.53 2ju4 s ILE 67 N -2.12 0.65 -0.18 4.57 -1.09 0.85 -5.13 121.20 118.75 2ju4 s ILE 67 Ca -0.17 -1.99 -0.25 0.00 -2.23 0.00 0.00 60.65 56.02 2ju4 s ILE 67 Cb 0.01 -2.30 -0.22 0.00 -1.58 0.00 0.00 42.46 38.37 2ju4 s ILE 67 CO 0.44 -0.31 0.45 -0.65 -1.23 0.00 0.00 174.94 173.65 2ju4 h PRO 69 N 2.58 0.00 -2.00 2.79 0.11 -1.98 -3.35 132.00 130.16 2ju4 h PRO 69 Ca -0.37 0.00 -0.16 0.00 0.11 0.00 0.00 66.00 65.58 2ju4 h PRO 69 Cb 1.22 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.27 2ju4 h PRO 69 CO 0.62 0.99 -0.28 -2.67 -0.21 0.00 0.00 178.00 176.45 2ju4 n TRP 70 N -4.51 0.06 0.00 0.65 4.27 -1.26 -3.33 117.44 113.32 2ju4 n TRP 70 Ca -0.22 -1.41 0.00 0.00 -3.89 0.00 0.00 57.50 51.98 2ju4 n TRP 70 Cb 0.59 -1.35 0.00 0.00 -1.36 0.00 0.00 31.31 29.18 2ju4 n TRP 70 CO 0.00 0.00 0.00 -0.85 -2.29 0.00 0.00 177.69 174.55 2ju4 n GLU 71 N 2.22 3.28 -1.67 -2.67 -0.00 -1.26 -5.00 120.64 115.54 2ju4 n GLU 71 Ca 0.34 0.00 -0.42 0.00 -0.00 0.00 0.00 57.16 57.08 2ju4 n GLU 71 Cb 0.82 -0.48 -0.02 0.00 -0.00 0.00 0.00 31.44 31.76 2ju4 n GLU 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2ju4 n ALA 72 N -0.49 4.66 0.00 -1.84 0.00 -1.21 -4.98 120.51 116.66 2ju4 n ALA 72 Ca 0.00 -3.70 0.00 0.00 0.00 0.00 0.00 53.44 49.74 2ju4 n ALA 72 Cb 0.00 -3.57 0.00 0.00 0.00 0.00 0.00 19.45 15.88 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 6.95 0.00 -3.49 0.00 3.02 -1.26 -5.14 115.26 115.33 2ju4 n ASN 74 Ca 0.51 0.00 0.01 0.00 -0.03 0.00 0.00 54.58 55.07 2ju4 n ASN 74 Cb 0.40 0.00 -0.05 0.00 -0.61 0.00 0.00 39.78 39.52 2ju4 n ASN 74 CO 0.00 0.00 0.00 -2.28 -2.62 0.00 0.00 177.26 172.36 2ju4 s HIS 75 N 0.00 -0.30 0.89 3.10 2.46 -1.26 -4.82 115.29 115.36 2ju4 s HIS 75 Ca 0.00 0.57 -0.13 0.00 0.47 0.00 0.00 55.06 55.96 2ju4 s HIS 75 Cb 0.00 0.18 0.14 0.00 -0.13 0.00 0.00 32.58 32.77 2ju4 s HIS 75 CO 0.00 -0.15 1.20 -1.21 -2.47 0.00 0.00 174.74 172.11 2ju4 s GLU 77 N 1.62 1.26 0.00 2.88 2.02 -1.26 -5.12 118.70 120.10 2ju4 s GLU 77 Ca -0.05 0.01 0.00 0.00 0.02 0.00 0.00 54.97 54.95 2ju4 s GLU 77 Cb -0.03 -1.88 0.00 0.00 0.10 0.00 0.00 34.13 32.32 2ju4 s GLU 77 CO -0.14 -2.06 0.00 1.28 0.02 0.00 0.00 175.26 174.36 2ju4 n LEU 78 N -3.62 0.00 0.00 1.80 4.77 -1.26 -4.60 117.00 114.09 2ju4 n LEU 78 Ca 0.10 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.08 2ju4 n LEU 78 Cb 0.60 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.69 2ju4 n LEU 78 CO 0.54 0.00 0.00 0.00 -1.33 0.00 0.00 177.39 176.60 2ju4 n HIS 79 N 0.00 0.00 0.00 -1.77 1.44 -1.26 -4.85 115.22 108.78 2ju4 n HIS 79 Ca 0.00 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.71 2ju4 n HIS 79 Cb 0.00 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.11 2ju4 n HIS 79 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 2ju4 n GLU 80 N 0.00 0.00 -0.20 -1.40 1.02 -1.26 0.32 120.64 119.12 2ju4 n GLU 80 Ca 0.00 0.00 0.12 0.00 -0.02 0.00 0.00 57.16 57.26 2ju4 n GLU 80 Cb 0.00 0.00 0.23 0.00 -0.02 0.00 0.00 31.44 31.65 2ju4 n GLU 80 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2ju4 n LEU 81 N 0.00 3.44 -4.56 -4.62 7.99 -1.26 -4.85 117.00 113.14 2ju4 n LEU 81 Ca 0.00 -1.51 -0.26 0.00 -0.01 0.00 0.00 56.01 54.23 2ju4 n LEU 81 Cb 0.00 -0.27 -0.05 0.00 -0.11 0.00 0.00 43.42 42.99 2ju4 n LEU 81 CO 0.00 0.75 1.37 0.00 -1.51 0.00 0.00 177.39 178.00 2ju4 s ALA 82 N -1.46 1.58 0.00 -1.18 0.00 0.15 -4.77 121.76 116.08 2ju4 s ALA 82 Ca 0.40 -1.28 0.00 0.00 0.00 0.00 0.00 51.96 51.07 2ju4 s ALA 82 Cb 0.23 -4.53 0.00 0.00 0.00 0.00 0.00 23.12 18.82 2ju4 s ALA 82 CO 0.32 -4.86 0.00 1.04 0.00 0.00 0.00 175.76 172.25 2ju4 n GLN 83 N 8.89 0.00 -0.69 0.00 3.00 -1.26 -4.44 117.38 122.87 2ju4 n GLN 83 Ca 0.39 0.15 -0.02 0.00 -0.01 0.00 0.00 57.00 57.51 2ju4 n GLN 83 Cb 0.47 -0.56 0.23 0.00 0.00 0.00 0.00 30.24 30.39 2ju4 n GLN 83 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 2ju4 n TYR 84 N -1.59 1.66 0.00 1.08 4.02 -1.26 -4.90 117.16 116.17 2ju4 n TYR 84 Ca 0.00 -0.79 0.00 0.00 -0.01 0.00 0.00 57.90 57.10 2ju4 n TYR 84 Cb 0.00 -0.49 0.00 0.00 -0.02 0.00 0.00 39.34 38.83 2ju4 n TYR 84 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2ju4 n GLY 85 N 0.10 2.08 2.91 2.72 0.00 -1.26 -5.05 105.19 106.69 2ju4 n GLY 85 Ca 0.26 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.97 2ju4 n GLY 85 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71