#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 -3.59 6.12 4.05 -1.26 -5.05 115.26 115.53 2ju4 n ASN 2 Ca 0.00 0.00 -0.23 0.00 0.45 0.00 0.00 54.58 54.80 2ju4 n ASN 2 Cb 0.00 0.00 0.05 0.00 1.23 0.00 0.00 39.78 41.06 2ju4 n ASN 2 CO 0.00 0.00 0.00 0.18 -3.05 0.00 0.00 177.26 174.39 2ju4 n LEU 3 N 0.00 -3.61 -4.56 1.20 4.77 -1.26 -4.87 117.00 108.67 2ju4 n LEU 3 Ca 0.00 -0.85 -0.39 0.00 -0.03 0.00 0.00 56.01 54.74 2ju4 n LEU 3 Cb 0.00 -2.71 0.04 0.00 -2.33 0.00 0.00 43.42 38.42 2ju4 n LEU 3 CO 0.00 0.36 0.39 -1.84 -1.33 0.00 0.00 177.39 174.97 2ju4 n GLU 4 N -4.01 0.87 -0.99 3.23 0.28 -1.26 -4.52 120.64 114.24 2ju4 n GLU 4 Ca -0.18 0.33 -0.22 0.00 -0.16 0.00 0.00 57.16 56.92 2ju4 n GLU 4 Cb 0.64 -1.97 -0.12 0.00 1.43 0.00 0.00 31.44 31.42 2ju4 n GLU 4 CO 0.00 0.00 0.00 -2.30 -0.16 0.00 0.00 177.13 174.67 2ju4 n PRO 5 N -0.40 0.00 -3.19 3.44 -0.02 -1.26 -4.86 135.00 128.70 2ju4 n PRO 5 Ca 0.12 0.00 -0.38 0.00 -2.02 0.00 0.00 63.50 61.22 2ju4 n PRO 5 Cb 0.45 -0.87 -0.06 0.00 -0.02 0.00 0.00 33.50 33.00 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 5.47 4.26 0.37 0.52 0.04 -1.26 -4.85 135.00 139.55 2ju4 s PRO 6 Ca 0.89 0.82 0.00 0.00 0.04 0.00 0.00 61.00 62.75 2ju4 s PRO 6 Cb -0.73 -3.14 0.00 0.00 0.04 0.00 0.00 34.50 30.67 2ju4 s PRO 6 CO 0.34 0.56 0.00 1.17 0.04 0.00 0.00 177.00 179.12 2ju4 n LYS 7 N 1.40 -5.02 -1.53 4.56 0.00 -1.26 -4.39 118.16 111.93 2ju4 n LYS 7 Ca -0.07 3.62 -0.29 0.00 0.00 0.00 0.00 58.31 61.57 2ju4 n LYS 7 Cb 0.50 -3.99 -0.12 0.00 0.00 0.00 0.00 35.03 31.42 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 0.46 0.62 0.28 3.14 0.00 -1.26 -4.96 120.51 118.79 2ju4 n ALA 8 Ca 0.00 -0.82 0.17 0.00 0.00 0.00 0.00 53.44 52.79 2ju4 n ALA 8 Cb 0.00 -2.77 0.65 0.00 0.00 0.00 0.00 19.45 17.33 2ju4 n ALA 8 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2ju4 h GLU 9 N 13.98 0.00 0.00 0.00 4.57 -1.92 -3.50 114.58 127.72 2ju4 h GLU 9 Ca -0.07 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.11 2ju4 h GLU 9 Cb 1.19 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.78 2ju4 h GLU 9 CO 1.30 0.00 0.00 -2.13 -1.18 0.00 0.00 179.01 177.00 2ju4 n ARG 11 N -3.07 0.00 -3.61 1.92 0.00 -1.26 -4.79 116.66 105.85 2ju4 n ARG 11 Ca 0.01 0.22 -0.06 0.00 -0.00 0.00 0.00 57.85 58.02 2ju4 n ARG 11 Cb 0.32 -0.43 -0.02 0.00 0.00 0.00 0.00 32.46 32.33 2ju4 n ARG 11 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.63 176.51 2ju4 s SER 12 N -1.38 -0.29 0.00 6.15 0.01 -1.26 -5.10 113.70 111.83 2ju4 s SER 12 Ca 0.00 -0.18 0.00 0.00 1.31 0.00 0.00 55.95 57.08 2ju4 s SER 12 Cb 0.00 0.44 0.00 0.00 0.21 0.00 0.00 66.02 66.67 2ju4 s SER 12 CO 0.00 -0.76 0.00 0.00 0.41 0.00 0.00 173.24 172.89 2ju4 n ALA 13 N -0.35 0.00 -1.83 1.44 0.00 -1.26 -4.97 120.51 113.54 2ju4 n ALA 13 Ca -0.08 0.00 -0.36 0.00 0.00 0.00 0.00 53.44 53.01 2ju4 n ALA 13 Cb 0.61 0.00 0.04 0.00 0.00 0.00 0.00 19.45 20.11 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 -1.27 3.36 -3.12 0.00 -2.24 -1.26 -4.80 114.28 104.95 2ju4 n THR 14 Ca 0.00 -3.98 0.05 0.00 -2.27 0.00 0.00 64.05 57.85 2ju4 n THR 14 Cb 0.00 -1.21 0.00 0.00 -2.10 0.00 0.00 70.33 67.02 2ju4 n THR 14 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2ju4 s ARG 15 N -3.90 0.24 -1.11 -0.78 1.70 -1.26 -5.05 118.95 108.80 2ju4 s ARG 15 Ca 0.55 0.18 -0.03 0.00 -0.47 0.00 0.00 55.73 55.97 2ju4 s ARG 15 Cb 0.45 0.09 0.24 0.00 -0.57 0.00 0.00 34.95 35.16 2ju4 s ARG 15 CO -0.23 -0.43 2.08 1.33 -1.08 0.00 0.00 175.30 176.96 2ju4 n VAL 16 N 5.02 5.56 -1.72 4.99 0.24 -1.26 -4.95 118.33 126.20 2ju4 n VAL 16 Ca 0.08 -5.17 0.00 0.00 -2.04 0.00 0.00 64.34 57.22 2ju4 n VAL 16 Cb 0.58 -1.73 0.00 0.00 -1.47 0.00 0.00 33.84 31.22 2ju4 n VAL 16 CO 0.00 0.00 0.00 0.23 -2.14 0.00 0.00 176.83 174.92 2ju4 n MET 17 N 0.61 -4.91 0.00 7.34 0.00 -1.26 -5.07 117.12 113.82 2ju4 n MET 17 Ca 0.53 3.62 0.00 0.00 0.00 0.00 0.00 57.70 61.86 2ju4 n MET 17 Cb 0.26 -4.05 0.00 0.00 0.00 0.00 0.00 33.22 29.43 2ju4 n MET 17 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 2ju4 n GLY 18 N -0.47 -0.71 6.85 3.03 0.00 -1.26 -5.16 105.19 107.47 2ju4 n GLY 18 Ca 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.63 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 0.00 -0.50 3.46 -0.02 0.00 -1.26 -5.05 105.19 101.82 2ju4 n GLY 19 Ca 0.00 -0.52 -0.41 0.00 0.00 0.00 0.00 46.02 45.09 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 -1.08 0.58 0.00 1.61 -0.02 -1.26 -5.20 135.00 129.63 2ju4 n PRO 20 Ca 0.00 0.21 0.00 0.00 -2.02 0.00 0.00 63.50 61.69 2ju4 n PRO 20 Cb 0.01 -1.55 0.00 0.00 -0.02 0.00 0.00 33.50 31.94 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 -1.02 0.00 -1.48 3.45 5.66 -1.26 -5.12 114.28 114.51 2ju4 n THR 22 Ca 0.11 0.00 -0.49 0.00 -3.05 0.00 0.00 64.05 60.62 2ju4 n THR 22 Cb 0.41 0.00 -0.03 0.00 -1.55 0.00 0.00 70.33 69.16 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 0.46 -1.69 1.09 -0.02 -1.26 -4.94 135.00 128.64 2ju4 n PRO 23 Ca 0.00 0.16 -0.29 0.00 -2.02 0.00 0.00 63.50 61.35 2ju4 n PRO 23 Cb 0.00 -1.38 0.11 0.00 -0.02 0.00 0.00 33.50 32.20 2ju4 n PRO 23 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 2ju4 s ARG 24 N -0.89 1.71 0.51 -0.52 0.52 -1.26 -4.86 118.95 114.15 2ju4 s ARG 24 Ca 0.68 0.29 0.00 0.00 -0.52 0.00 0.00 55.73 56.18 2ju4 s ARG 24 Cb -0.91 -1.90 0.00 0.00 0.52 0.00 0.00 34.95 32.65 2ju4 s ARG 24 CO 0.56 -1.81 0.00 1.63 0.02 0.00 0.00 175.30 175.71 2ju4 n LYS 25 N -3.50 -2.86 0.00 3.54 4.76 -1.26 -4.94 118.16 113.90 2ju4 n LYS 25 Ca 0.07 2.28 0.00 0.00 -2.87 0.00 0.00 58.31 57.79 2ju4 n LYS 25 Cb 0.59 -3.45 0.00 0.00 -1.84 0.00 0.00 35.03 30.34 2ju4 n LYS 25 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2ju4 n GLY 26 N -4.13 0.93 2.67 0.72 0.00 -1.26 -5.06 105.19 99.05 2ju4 n GLY 26 Ca -0.07 -1.79 -0.17 0.00 0.00 0.00 0.00 46.02 43.98 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 0.00 -2.25 -1.57 1.61 -0.02 -1.26 -4.87 135.00 126.65 2ju4 n PRO 27 Ca 0.00 -0.83 -0.40 0.00 -2.02 0.00 0.00 63.50 60.25 2ju4 n PRO 27 Cb 0.00 -1.40 0.03 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 -2.54 0.96 0.00 0.52 -0.02 -1.26 -5.20 135.00 127.45 2ju4 n PRO 28 Ca 0.08 0.36 0.00 0.00 -2.02 0.00 0.00 63.50 61.91 2ju4 n PRO 28 Cb 0.34 -1.96 0.00 0.00 -0.02 0.00 0.00 33.50 31.87 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 -0.21 0.00 0.00 -0.52 0.00 -1.26 -5.27 118.16 110.90 2ju4 n LYS 29 Ca 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.42 2ju4 n LYS 29 Cb 0.43 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.46 2ju4 n LYS 29 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 2ju4 n LYS 31 N 0.00 0.00 -3.14 -1.58 3.00 -1.26 -5.10 118.16 110.08 2ju4 n LYS 31 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 58.31 58.18 2ju4 n LYS 31 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 35.03 34.99 2ju4 n LYS 31 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.40 176.26 2ju4 s GLN 32 N -0.19 0.88 -0.37 1.64 0.74 -1.26 -5.05 119.66 116.05 2ju4 s GLN 32 Ca 0.00 -1.19 -0.04 0.00 0.05 0.00 0.00 55.36 54.18 2ju4 s GLN 32 Cb 0.00 -0.57 0.21 0.00 1.10 0.00 0.00 33.01 33.75 2ju4 s GLN 32 CO 0.00 -1.29 1.02 -0.98 -0.55 0.00 0.00 175.29 173.49 2ju4 s ARG 33 N 0.93 0.37 -0.09 1.67 1.70 -1.26 -5.06 118.95 117.21 2ju4 s ARG 33 Ca 0.25 -0.35 -0.01 0.00 -0.47 0.00 0.00 55.73 55.15 2ju4 s ARG 33 Cb -0.04 -0.01 0.01 0.00 -0.57 0.00 0.00 34.95 34.33 2ju4 s ARG 33 CO -0.08 -0.46 0.03 1.04 -1.08 0.00 0.00 175.30 174.74 2ju4 n GLN 34 N 2.78 -1.67 0.14 3.89 3.00 -1.26 -4.83 117.38 119.43 2ju4 n GLN 34 Ca 0.12 1.61 -0.01 0.00 -0.01 0.00 0.00 57.00 58.71 2ju4 n GLN 34 Cb 0.63 -2.38 0.21 0.00 0.00 0.00 0.00 30.24 28.70 2ju4 n GLN 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2ju4 h THR 35 N 3.84 1.39 0.00 5.09 1.03 -1.97 -3.37 112.91 118.92 2ju4 h THR 35 Ca -0.06 -1.88 0.00 0.00 -0.01 0.00 0.00 66.41 64.46 2ju4 h THR 35 Cb 0.60 1.99 0.00 0.00 -1.07 0.00 0.00 68.15 69.67 2ju4 h THR 35 CO 0.02 0.54 0.00 0.54 -0.01 0.00 0.00 175.52 176.62 2ju4 n ARG 36 N -3.89 0.00 -2.07 0.00 1.74 -1.26 -5.17 116.66 106.01 2ju4 n ARG 36 Ca -0.01 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.65 2ju4 n ARG 36 Cb 0.56 -0.19 -0.03 0.00 -1.02 0.00 0.00 32.46 31.78 2ju4 n ARG 36 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 2ju4 s GLN 37 N 0.00 4.28 0.00 5.56 -0.44 -1.26 -5.17 119.66 122.63 2ju4 s GLN 37 Ca 0.00 2.21 0.00 0.00 -2.50 0.00 0.00 55.36 55.07 2ju4 s GLN 37 Cb 0.00 -3.20 0.00 0.00 -1.64 0.00 0.00 33.01 28.17 2ju4 s GLN 37 CO 0.00 -0.49 0.00 1.63 0.50 0.00 0.00 175.29 176.93 2ju4 n LYS 39 N 3.74 0.00 -3.53 1.67 4.01 -1.26 -4.90 118.16 117.88 2ju4 n LYS 39 Ca 0.12 0.00 -0.33 0.00 -0.51 0.00 0.00 58.31 57.59 2ju4 n LYS 39 Cb 0.41 0.00 -0.05 0.00 -0.51 0.00 0.00 35.03 34.87 2ju4 n LYS 39 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 2ju4 s SER 40 N -4.00 6.60 -0.43 4.39 0.15 -1.26 -5.05 113.70 114.10 2ju4 s SER 40 Ca 0.00 0.79 0.05 0.00 0.70 0.00 0.00 55.95 57.49 2ju4 s SER 40 Cb 0.00 -2.17 0.17 0.00 -1.71 0.00 0.00 66.02 62.31 2ju4 s SER 40 CO 0.00 0.04 0.46 -1.59 1.20 0.00 0.00 173.24 173.35 2ju4 s LYS 41 N -2.47 0.88 0.39 5.44 0.00 -1.26 -5.14 119.74 117.58 2ju4 s LYS 41 Ca 0.41 -1.48 -0.15 0.00 0.00 0.00 0.00 55.97 54.75 2ju4 s LYS 41 Cb -0.12 -0.85 -0.08 0.00 0.00 0.00 0.00 37.83 36.77 2ju4 s LYS 41 CO 0.21 -1.32 0.81 -1.25 0.00 0.00 0.00 175.35 173.81 2ju4 s PRO 42 N 0.66 3.96 -0.04 1.78 0.04 -1.26 -5.05 135.00 135.10 2ju4 s PRO 42 Ca 0.28 0.72 -0.29 0.00 0.04 0.00 0.00 61.00 61.74 2ju4 s PRO 42 Cb -0.03 -2.34 -0.02 0.00 0.04 0.00 0.00 34.50 32.15 2ju4 s PRO 42 CO -0.11 0.01 0.97 -1.25 0.04 0.00 0.00 177.00 176.66 2ju4 s PRO 43 N -3.42 4.51 -0.56 0.56 0.04 -1.26 -4.95 135.00 129.91 2ju4 s PRO 43 Ca 0.55 1.38 -0.02 0.00 0.04 0.00 0.00 61.00 62.95 2ju4 s PRO 43 Cb -0.10 -3.49 0.38 0.00 0.04 0.00 0.00 34.50 31.33 2ju4 s PRO 43 CO 0.23 -0.13 2.03 1.17 0.04 0.00 0.00 177.00 180.34 2ju4 n LYS 44 N 4.25 2.42 -3.78 4.56 4.81 -1.26 -4.85 118.16 124.30 2ju4 n LYS 44 Ca 0.06 -2.76 -0.25 0.00 -0.87 0.00 0.00 58.31 54.49 2ju4 n LYS 44 Cb 0.50 -2.08 0.01 0.00 0.02 0.00 0.00 35.03 33.49 2ju4 n LYS 44 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 2ju4 n LYS 45 N -0.53 -3.42 -1.53 1.64 4.01 -1.26 -4.46 118.16 112.61 2ju4 n LYS 45 Ca 0.53 0.51 0.00 0.00 -0.51 0.00 0.00 58.31 58.84 2ju4 n LYS 45 Cb 0.64 -4.71 0.00 0.00 -0.51 0.00 0.00 35.03 30.44 2ju4 n LYS 45 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2ju4 n GLY 46 N -1.75 -4.55 0.00 0.72 0.00 -1.26 -5.07 105.19 93.28 2ju4 n GLY 46 Ca -0.26 -0.72 0.00 0.00 0.00 0.00 0.00 46.02 45.04 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 -1.00 0.00 -1.85 1.61 0.24 -1.26 -5.04 118.33 111.03 2ju4 n VAL 47 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.30 2ju4 n VAL 47 Cb 0.03 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.40 2ju4 n VAL 47 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2ju4 n GLN 48 N -0.19 0.00 -0.63 7.34 6.02 -1.26 -5.13 117.38 123.52 2ju4 n GLN 48 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 2ju4 n GLN 48 Cb 0.00 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.26 2ju4 n GLN 48 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2ju4 n GLY 49 N 0.00 0.74 0.46 1.08 0.00 -1.26 -4.97 105.19 101.23 2ju4 n GLY 49 Ca 0.00 -0.58 0.11 0.00 0.00 0.00 0.00 46.02 45.55 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 -2.29 -0.06 0.00 -0.02 0.00 -1.26 -4.72 105.19 96.84 2ju4 n GLY 51 Ca 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.40 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 -0.13 0.00 -2.51 1.61 2.03 -1.26 -4.89 116.55 111.41 2ju4 n ASP 52 Ca 0.09 0.00 -0.04 0.00 0.52 0.00 0.00 54.79 55.37 2ju4 n ASP 52 Cb 0.45 0.00 0.04 0.00 -0.72 0.00 0.00 41.12 40.89 2ju4 n ASP 52 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 2ju4 n ASP 53 N 0.00 -1.20 -3.84 1.67 5.75 -1.26 -5.09 116.55 112.57 2ju4 n ASP 53 Ca 0.00 -1.82 -0.30 0.00 -0.01 0.00 0.00 54.79 52.66 2ju4 n ASP 53 Cb 0.00 0.83 -0.14 0.00 -1.03 0.00 0.00 41.12 40.78 2ju4 n ASP 53 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 2ju4 s ILE 54 N 0.08 1.69 -1.32 2.12 -1.09 -1.26 -5.04 121.20 116.37 2ju4 s ILE 54 Ca 0.08 -2.30 -0.14 0.00 -2.23 0.00 0.00 60.65 56.07 2ju4 s ILE 54 Cb 0.18 -2.22 0.11 0.00 -1.58 0.00 0.00 42.46 38.94 2ju4 s ILE 54 CO -0.04 -0.74 1.86 -0.81 -1.23 0.00 0.00 174.94 173.98 2ju4 n PRO 55 N 4.04 3.24 -0.03 2.79 -0.04 -1.26 -4.48 135.00 139.26 2ju4 n PRO 55 Ca 0.04 -3.26 0.00 0.00 -0.04 0.00 0.00 63.50 60.24 2ju4 n PRO 55 Cb 0.38 -3.20 0.00 0.00 -0.04 0.00 0.00 33.50 30.64 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 4.08 0.81 4.46 0.55 0.00 -1.26 -3.81 105.19 110.02 2ju4 n GLY 56 Ca 0.45 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.47 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 -2.00 0.00 -2.06 1.61 0.00 -1.26 -4.07 117.12 109.34 2ju4 n MET 57 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 57.70 57.66 2ju4 n MET 57 Cb 0.00 -0.64 0.02 0.00 0.00 0.00 0.00 33.22 32.59 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 0.00 -0.67 -1.03 0.03 2.13 -1.25 -5.14 120.64 114.71 2ju4 n GLU 58 Ca 0.00 0.40 -0.00 0.00 0.66 0.00 0.00 57.16 58.22 2ju4 n GLU 58 Cb 0.00 -2.91 -0.01 0.00 0.27 0.00 0.00 31.44 28.79 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 -1.38 0.77 0.00 8.31 0.00 -1.26 -5.07 105.19 106.57 2ju4 n GLY 59 Ca -0.02 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.66 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 0.20 0.00 0.00 -0.02 0.00 -1.26 -5.21 105.19 98.90 2ju4 n GLY 61 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 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 0.00 0.00 0.41 2.61 -2.24 -1.26 -4.83 114.28 108.97 2ju4 n THR 62 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2ju4 n THR 62 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 2ju4 n THR 62 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2ju4 n ASP 63 N 0.00 1.99 0.00 3.42 5.75 -1.26 -3.03 116.55 123.41 2ju4 n ASP 63 Ca 0.00 -1.28 0.00 0.00 -0.01 0.00 0.00 54.79 53.50 2ju4 n ASP 63 Cb 0.00 -0.36 0.00 0.00 -1.03 0.00 0.00 41.12 39.73 2ju4 n ASP 63 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2ju4 n ILE 64 N 0.90 0.00 -2.63 2.12 3.06 -1.26 -4.98 119.36 116.58 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 0.29 0.00 -0.01 0.00 0.54 0.00 0.00 39.64 40.46 2ju4 n ILE 64 CO 0.00 0.00 0.00 0.35 -2.50 0.00 0.00 176.55 174.40 2ju4 n THR 65 N -0.30 -0.04 0.00 9.51 -2.24 -1.17 0.15 114.28 120.20 2ju4 n THR 65 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2ju4 n THR 65 Cb 0.00 -0.13 0.00 0.00 -2.10 0.00 0.00 70.33 68.10 2ju4 n THR 65 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 2ju4 n VAL 66 N -2.65 0.00 -4.03 2.28 0.31 -1.26 -4.95 118.33 108.03 2ju4 n VAL 66 Ca 0.00 0.00 -0.08 0.00 -0.01 0.00 0.00 64.34 64.25 2ju4 n VAL 66 Cb 0.50 0.00 -0.10 0.00 -0.91 0.00 0.00 33.84 33.33 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 0.17 -0.11 2.52 1.01 0.39 -5.04 121.20 120.14 2ju4 s ILE 67 Ca 0.00 -1.41 -0.19 0.00 0.00 0.00 0.00 60.65 59.05 2ju4 s ILE 67 Cb 0.00 -1.00 -0.17 0.00 0.01 0.00 0.00 42.46 41.30 2ju4 s ILE 67 CO 0.00 -0.78 0.59 -0.65 0.00 0.00 0.00 174.94 174.10 2ju4 h PRO 69 N 3.73 -0.04 -1.09 2.79 0.10 -1.93 -3.47 132.00 132.09 2ju4 h PRO 69 Ca -0.33 0.00 0.00 0.00 0.10 0.00 0.00 66.00 65.77 2ju4 h PRO 69 Cb 1.17 0.01 0.00 0.00 0.10 0.00 0.00 31.00 32.28 2ju4 h PRO 69 CO 0.55 0.56 0.00 -2.67 0.10 0.00 0.00 178.00 176.54 2ju4 n TRP 70 N -4.72 0.00 0.05 0.65 2.14 -1.24 -0.77 117.44 113.55 2ju4 n TRP 70 Ca -0.07 -0.09 0.00 0.00 2.07 0.00 0.00 57.50 59.42 2ju4 n TRP 70 Cb 0.30 -0.10 0.00 0.00 -0.81 0.00 0.00 31.31 30.70 2ju4 n TRP 70 CO 0.00 0.00 0.00 -1.91 2.07 0.00 0.00 177.69 177.85 2ju4 n GLU 71 N 0.63 0.00 0.00 -2.67 4.07 -1.26 -4.84 120.64 116.57 2ju4 n GLU 71 Ca 0.00 0.00 0.13 0.00 -0.06 0.00 0.00 57.16 57.23 2ju4 n GLU 71 Cb 0.12 0.00 0.55 0.00 -0.06 0.00 0.00 31.44 32.05 2ju4 n GLU 71 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2ju4 n ALA 72 N -2.81 2.19 -3.00 4.31 0.00 -1.18 -5.09 120.51 114.92 2ju4 n ALA 72 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.35 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 0.27 0.00 0.00 0.00 177.50 177.77 2ju4 n ASN 74 N -1.50 0.00 0.00 0.00 0.23 0.05 -5.05 115.26 109.00 2ju4 n ASN 74 Ca 0.06 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.11 2ju4 n ASN 74 Cb 0.30 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.00 2ju4 n ASN 74 CO 0.00 0.00 0.00 1.41 -0.93 0.00 0.00 177.26 177.74 2ju4 n HIS 75 N 0.00 0.00 0.00 -2.53 8.25 -1.26 -3.69 115.22 115.99 2ju4 n HIS 75 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 2ju4 n HIS 75 Cb 0.00 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.11 2ju4 n HIS 75 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 2ju4 n GLU 77 N 0.00 0.00 -2.50 -0.41 1.02 -1.26 -5.04 120.64 112.45 2ju4 n GLU 77 Ca 0.00 0.00 -0.23 0.00 -0.02 0.00 0.00 57.16 56.91 2ju4 n GLU 77 Cb 0.00 0.00 0.07 0.00 -0.02 0.00 0.00 31.44 31.49 2ju4 n GLU 77 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2ju4 s LEU 78 N 0.00 3.06 0.00 -4.62 1.43 -1.26 -4.97 118.68 112.31 2ju4 s LEU 78 Ca 0.00 -0.02 0.29 0.00 -1.03 0.00 0.00 54.13 53.37 2ju4 s LEU 78 Cb 0.00 -2.61 1.19 0.00 0.03 0.00 0.00 46.19 44.79 2ju4 s LEU 78 CO 0.00 -1.53 1.85 0.00 0.23 0.00 0.00 176.35 176.91 2ju4 n HIS 79 N -2.67 0.00 0.43 0.29 1.44 -1.26 -3.23 115.22 110.22 2ju4 n HIS 79 Ca 0.10 0.00 0.12 0.00 -2.01 0.00 0.00 57.72 55.94 2ju4 n HIS 79 Cb 0.60 -0.30 0.19 0.00 0.12 0.00 0.00 29.99 30.60 2ju4 n HIS 79 CO 0.00 0.00 0.00 0.93 -2.81 0.00 0.00 176.34 174.46 2ju4 h GLU 80 N 0.22 0.00 -0.19 -1.40 5.08 -1.99 -3.18 114.58 113.11 2ju4 h GLU 80 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2ju4 h GLU 80 Cb 0.40 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.65 2ju4 h GLU 80 CO 0.00 0.00 0.00 1.28 -1.00 0.00 0.00 179.01 179.29 2ju4 n LEU 81 N -2.42 1.54 -2.14 1.33 7.99 -1.20 -4.45 117.00 117.65 2ju4 n LEU 81 Ca 0.03 -0.68 -0.03 0.00 -0.01 0.00 0.00 56.01 55.32 2ju4 n LEU 81 Cb 0.47 -0.12 -0.05 0.00 -0.11 0.00 0.00 43.42 43.61 2ju4 n LEU 81 CO 0.35 0.34 0.79 0.00 -1.51 0.00 0.00 177.39 177.37 2ju4 n ALA 82 N 0.26 3.01 -0.70 -1.18 0.00 -1.20 -4.81 120.51 115.89 2ju4 n ALA 82 Ca 0.15 -0.53 0.00 0.00 0.00 0.00 0.00 53.44 53.06 2ju4 n ALA 82 Cb 0.29 -2.07 0.00 0.00 0.00 0.00 0.00 19.45 17.68 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 2.49 0.00 -0.53 0.00 3.00 -1.26 0.25 117.38 121.32 2ju4 n GLN 83 Ca 0.12 0.00 0.11 0.00 -0.01 0.00 0.00 57.00 57.22 2ju4 n GLN 83 Cb 0.33 0.00 0.35 0.00 0.00 0.00 0.00 30.24 30.92 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 0.00 1.32 -3.98 1.08 4.01 -1.26 -4.93 117.16 113.40 2ju4 n TYR 84 Ca 0.00 -0.57 -0.31 0.00 -0.16 0.00 0.00 57.90 56.87 2ju4 n TYR 84 Cb 0.00 -0.15 0.01 0.00 -0.31 0.00 0.00 39.34 38.89 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 1.38 -0.44 0.00 2.72 0.00 0.14 -5.16 105.19 103.83 2ju4 n GLY 85 Ca 0.26 0.17 0.00 0.00 0.00 0.00 0.00 46.02 46.45 2ju4 n GLY 85 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71