#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 6.45 -2.93 7.83 3.02 -1.26 -4.93 115.26 123.44 2ju4 n ASN 2 Ca 0.00 -2.95 0.00 0.00 -0.03 0.00 0.00 54.58 51.60 2ju4 n ASN 2 Cb 0.00 -1.50 0.00 0.00 -0.61 0.00 0.00 39.78 37.67 2ju4 n ASN 2 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 2ju4 n LEU 3 N 3.65 0.00 -4.60 3.41 4.77 -1.26 -4.92 117.00 118.06 2ju4 n LEU 3 Ca 0.57 0.00 -0.45 0.00 -0.03 0.00 0.00 56.01 56.09 2ju4 n LEU 3 Cb 0.31 0.00 -0.02 0.00 -2.33 0.00 0.00 43.42 41.38 2ju4 n LEU 3 CO 0.81 0.00 0.66 -0.62 -1.33 0.00 0.00 177.39 176.91 2ju4 n GLU 4 N 0.00 1.42 -1.29 3.23 4.71 -1.26 -4.58 120.64 122.87 2ju4 n GLU 4 Ca 0.00 0.50 -0.34 0.00 -0.01 0.00 0.00 57.16 57.31 2ju4 n GLU 4 Cb 0.00 -1.94 -0.13 0.00 -1.01 0.00 0.00 31.44 28.36 2ju4 n GLU 4 CO 0.00 0.00 0.00 -2.30 0.09 0.00 0.00 177.13 174.92 2ju4 n PRO 5 N 1.06 0.00 -3.15 3.49 -0.02 -1.26 -4.88 135.00 130.23 2ju4 n PRO 5 Ca 0.11 0.00 -0.39 0.00 -2.02 0.00 0.00 63.50 61.20 2ju4 n PRO 5 Cb 0.31 -1.25 -0.06 0.00 -0.02 0.00 0.00 33.50 32.48 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 7.56 4.34 0.00 0.52 0.04 -1.26 -5.07 135.00 141.13 2ju4 s PRO 6 Ca 1.16 0.90 0.00 0.00 0.04 0.00 0.00 61.00 63.11 2ju4 s PRO 6 Cb -1.05 -3.23 0.00 0.00 0.04 0.00 0.00 34.50 30.26 2ju4 s PRO 6 CO 0.43 0.60 0.00 1.63 0.04 0.00 0.00 177.00 179.70 2ju4 n LYS 7 N 1.61 0.00 0.00 4.56 5.02 -1.26 -5.05 118.16 123.04 2ju4 n LYS 7 Ca -0.08 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.21 2ju4 n LYS 7 Cb 0.50 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.51 2ju4 n LYS 7 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2ju4 n ALA 8 N -3.00 0.00 -1.83 7.82 0.00 -1.26 -5.28 120.51 116.95 2ju4 n ALA 8 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2ju4 n ALA 8 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 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 3.74 0.00 0.00 -0.58 -1.26 -5.19 120.64 117.36 2ju4 n GLU 9 Ca 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.74 2ju4 n GLU 9 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 30.87 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 0.00 0.00 -2.63 3.49 1.74 -1.26 -5.28 116.66 112.72 2ju4 n ARG 11 Ca 0.00 0.00 -0.06 0.00 -0.77 0.00 0.00 57.85 57.02 2ju4 n ARG 11 Cb 0.00 0.00 -0.05 0.00 -1.02 0.00 0.00 32.46 31.39 2ju4 n ARG 11 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 2ju4 n SER 12 N 0.00 -0.76 -3.62 0.55 7.64 -1.26 -5.07 113.62 111.11 2ju4 n SER 12 Ca 0.00 1.34 -0.04 0.00 1.01 0.00 0.00 58.87 61.19 2ju4 n SER 12 Cb 0.00 -5.15 -0.02 0.00 -1.01 0.00 0.00 64.21 58.03 2ju4 n SER 12 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2ju4 s ALA 13 N -0.67 -2.12 -0.30 -0.43 0.00 -1.26 -5.13 121.76 111.85 2ju4 s ALA 13 Ca -0.28 1.74 -0.08 0.00 0.00 0.00 0.00 51.96 53.34 2ju4 s ALA 13 Cb 0.02 -0.37 0.18 0.00 0.00 0.00 0.00 23.12 22.95 2ju4 s ALA 13 CO 0.77 -0.54 0.85 0.99 0.00 0.00 0.00 175.76 177.83 2ju4 s THR 14 N -2.12 -0.64 -1.38 0.00 2.01 -1.26 -4.95 115.64 107.30 2ju4 s THR 14 Ca 0.10 0.00 -0.02 0.00 0.31 0.00 0.00 61.69 62.08 2ju4 s THR 14 Cb -0.01 -1.00 0.01 0.00 0.01 0.00 0.00 72.50 71.51 2ju4 s THR 14 CO -0.04 0.00 0.61 0.54 -0.69 0.00 0.00 174.62 175.04 2ju4 n ARG 15 N 5.41 -4.22 -0.81 4.92 1.74 -1.26 -3.59 116.66 118.86 2ju4 n ARG 15 Ca -0.05 0.52 -0.00 0.00 -0.77 0.00 0.00 57.85 57.55 2ju4 n ARG 15 Cb 0.52 -4.93 0.00 0.00 -1.02 0.00 0.00 32.46 27.03 2ju4 n ARG 15 CO 0.00 0.00 0.00 1.55 -1.52 0.00 0.00 177.63 177.66 2ju4 n VAL 16 N -4.37 -0.23 -2.71 1.55 3.14 -1.26 -4.91 118.33 109.55 2ju4 n VAL 16 Ca -0.26 0.05 -0.03 0.00 -2.96 0.00 0.00 64.34 61.15 2ju4 n VAL 16 Cb 0.66 -0.33 0.03 0.00 -1.06 0.00 0.00 33.84 33.14 2ju4 n VAL 16 CO 0.00 0.00 0.00 -0.04 -6.46 0.00 0.00 176.83 170.33 2ju4 s MET 17 N -0.12 0.35 -0.57 1.45 1.00 -1.24 -5.11 119.30 115.07 2ju4 s MET 17 Ca 0.00 -0.32 -0.17 0.00 0.00 0.00 0.00 55.69 55.20 2ju4 s MET 17 Cb -0.00 -0.01 0.12 0.00 0.00 0.00 0.00 34.83 34.94 2ju4 s MET 17 CO 0.00 -0.44 0.60 0.20 0.00 0.00 0.00 175.02 175.38 2ju4 s GLY 18 N 1.12 1.95 0.10 -0.03 0.00 -1.26 -4.88 107.32 104.32 2ju4 s GLY 18 Ca 0.23 -2.41 0.00 0.00 0.00 0.00 0.00 44.72 42.54 2ju4 s GLY 18 CO -0.10 1.38 0.00 0.61 0.00 0.00 0.00 173.10 174.98 2ju4 n GLY 19 N 5.25 -0.74 0.00 0.20 0.00 -1.26 -5.07 105.19 103.57 2ju4 n GLY 19 Ca -0.12 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.38 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 -1.82 0.00 0.00 1.61 -0.02 -1.26 -5.25 135.00 128.26 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 0.20 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.68 2ju4 n PRO 20 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 2ju4 n THR 22 N 0.00 0.00 -1.66 3.45 -1.04 -1.26 -5.15 114.28 108.62 2ju4 n THR 22 Ca 0.00 0.00 -0.40 0.00 -2.04 0.00 0.00 64.05 61.61 2ju4 n THR 22 Cb 0.00 0.00 0.02 0.00 -1.82 0.00 0.00 70.33 68.53 2ju4 n THR 22 CO 0.00 0.00 0.00 -2.65 -0.64 0.00 0.00 175.07 171.78 2ju4 n PRO 23 N 0.00 1.53 -3.29 -2.82 -0.02 -1.26 -4.94 135.00 124.19 2ju4 n PRO 23 Ca 0.00 0.55 -0.47 0.00 -2.02 0.00 0.00 63.50 61.57 2ju4 n PRO 23 Cb 0.00 -2.24 -0.03 0.00 -0.02 0.00 0.00 33.50 31.22 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 -2.28 3.51 1.31 -0.52 6.06 -1.26 -5.05 118.95 120.72 2ju4 s ARG 24 Ca 0.65 -2.29 -0.18 0.00 -2.50 0.00 0.00 55.73 51.42 2ju4 s ARG 24 Cb -0.50 -4.44 0.34 0.00 0.06 0.00 0.00 34.95 30.40 2ju4 s ARG 24 CO 0.55 -1.33 0.97 -1.59 -2.50 0.00 0.00 175.30 171.39 2ju4 s LYS 25 N 0.59 -2.09 -0.51 5.12 0.00 -1.26 -4.44 119.74 117.15 2ju4 s LYS 25 Ca 0.17 0.53 -0.03 0.00 0.00 0.00 0.00 55.97 56.64 2ju4 s LYS 25 Cb -0.13 -1.44 0.00 0.00 0.00 0.00 0.00 37.83 36.26 2ju4 s LYS 25 CO -0.07 -4.42 0.52 0.41 0.00 0.00 0.00 175.35 171.79 2ju4 n GLY 26 N 1.32 -1.06 3.77 0.59 0.00 -1.26 -5.02 105.19 103.53 2ju4 n GLY 26 Ca 0.07 0.47 -0.30 0.00 0.00 0.00 0.00 46.02 46.26 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 -2.81 0.14 1.01 1.61 0.02 -1.26 -5.01 135.00 128.69 2ju4 s PRO 27 Ca 0.05 -0.09 -0.16 0.00 0.02 0.00 0.00 61.00 60.82 2ju4 s PRO 27 Cb -0.01 -1.76 0.02 0.00 0.02 0.00 0.00 34.50 32.77 2ju4 s PRO 27 CO 0.58 -2.80 0.04 -2.30 -0.33 0.00 0.00 177.00 172.19 2ju4 n PRO 28 N -4.11 -0.60 -2.49 5.54 -0.02 -1.26 -5.24 135.00 126.83 2ju4 n PRO 28 Ca 0.12 -0.15 -0.31 0.00 -2.02 0.00 0.00 63.50 61.14 2ju4 n PRO 28 Cb 0.59 -1.66 -0.03 0.00 -0.02 0.00 0.00 33.50 32.39 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 -3.29 3.84 0.00 -0.52 2.20 -1.26 -5.14 119.74 115.56 2ju4 s LYS 29 Ca 0.53 0.75 0.00 0.00 -0.36 0.00 0.00 55.97 56.89 2ju4 s LYS 29 Cb -0.17 -2.22 0.00 0.00 -1.51 0.00 0.00 37.83 33.94 2ju4 s LYS 29 CO 0.69 -0.23 0.00 1.17 -0.36 0.00 0.00 175.35 176.62 2ju4 n LYS 31 N -1.66 0.00 -3.65 4.03 4.81 -1.26 -4.85 118.16 115.58 2ju4 n LYS 31 Ca 0.05 0.00 -0.01 0.00 -0.87 0.00 0.00 58.31 57.47 2ju4 n LYS 31 Cb 0.54 0.00 -0.06 0.00 0.02 0.00 0.00 35.03 35.53 2ju4 n LYS 31 CO 0.00 0.00 0.00 -1.14 1.17 0.00 0.00 177.40 177.43 2ju4 s GLN 32 N 1.53 0.28 0.00 1.64 0.74 -1.26 -5.15 119.66 117.44 2ju4 s GLN 32 Ca 0.00 0.46 0.00 0.00 0.05 0.00 0.00 55.36 55.87 2ju4 s GLN 32 Cb 0.00 0.07 0.00 0.00 1.10 0.00 0.00 33.01 34.18 2ju4 s GLN 32 CO 0.00 -0.06 0.00 2.89 -0.55 0.00 0.00 175.29 177.57 2ju4 n ARG 33 N 3.33 0.00 0.00 1.67 0.00 -1.26 -5.08 116.66 115.32 2ju4 n ARG 33 Ca -0.17 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.68 2ju4 n ARG 33 Cb 0.57 0.00 0.00 0.00 -0.00 0.00 0.00 32.46 33.03 2ju4 n ARG 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2ju4 n GLN 34 N 0.00 0.00 0.00 2.89 0.00 -1.26 -5.15 117.38 113.86 2ju4 n GLN 34 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.00 57.00 2ju4 n GLN 34 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.24 2ju4 n GLN 34 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.06 179.47 2ju4 n THR 35 N -0.67 0.00 -3.08 -0.39 -1.04 -1.26 -5.11 114.28 102.73 2ju4 n THR 35 Ca 0.00 0.00 -0.12 0.00 -2.04 0.00 0.00 64.05 61.89 2ju4 n THR 35 Cb 0.00 0.00 -0.04 0.00 -1.82 0.00 0.00 70.33 68.47 2ju4 n THR 35 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2ju4 s ARG 36 N 4.73 0.93 -0.17 -2.82 1.70 -1.26 -5.21 118.95 116.86 2ju4 s ARG 36 Ca 0.00 -1.24 -0.29 0.00 -0.47 0.00 0.00 55.73 53.73 2ju4 s ARG 36 Cb 0.00 -0.53 -0.04 0.00 -0.57 0.00 0.00 34.95 33.82 2ju4 s ARG 36 CO 0.00 -1.31 1.71 -1.14 -1.08 0.00 0.00 175.30 173.48 2ju4 s GLN 37 N 0.84 3.83 0.00 3.89 0.74 -1.26 -5.06 119.66 122.65 2ju4 s GLN 37 Ca 0.27 1.88 0.00 0.00 0.05 0.00 0.00 55.36 57.56 2ju4 s GLN 37 Cb -0.02 -4.07 0.00 0.00 1.10 0.00 0.00 33.01 30.02 2ju4 s GLN 37 CO -0.09 -1.26 0.00 1.63 -0.55 0.00 0.00 175.29 175.02 2ju4 n LYS 39 N 7.66 0.00 0.00 1.67 5.02 -1.26 -5.01 118.16 126.23 2ju4 n LYS 39 Ca 0.20 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.49 2ju4 n LYS 39 Cb 0.44 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.45 2ju4 n LYS 39 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2ju4 n SER 40 N -0.64 0.08 -4.67 4.39 2.88 -1.26 -5.09 113.62 109.30 2ju4 n SER 40 Ca 0.00 -0.01 -0.37 0.00 -1.33 0.00 0.00 58.87 57.16 2ju4 n SER 40 Cb 0.00 0.04 0.06 0.00 -0.75 0.00 0.00 64.21 63.56 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 -0.04 1.01 -1.75 -1.46 5.02 -1.26 -4.96 118.16 114.72 2ju4 n LYS 41 Ca 0.00 0.40 -0.32 0.00 -2.02 0.00 0.00 58.31 56.37 2ju4 n LYS 41 Cb 0.00 -2.36 0.04 0.00 -0.02 0.00 0.00 35.03 32.69 2ju4 n LYS 41 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2ju4 s PRO 42 N -3.07 3.01 0.46 1.97 0.04 -1.26 -5.03 135.00 131.12 2ju4 s PRO 42 Ca 0.79 1.12 -0.22 0.00 0.04 0.00 0.00 61.00 62.73 2ju4 s PRO 42 Cb -0.40 -1.99 -0.08 0.00 0.04 0.00 0.00 34.50 32.07 2ju4 s PRO 42 CO 0.44 -1.05 1.07 -1.25 0.04 0.00 0.00 177.00 176.24 2ju4 s PRO 43 N -4.54 3.89 0.00 0.56 0.04 -1.26 -5.04 135.00 128.65 2ju4 s PRO 43 Ca 0.61 1.49 0.00 0.00 0.04 0.00 0.00 61.00 63.14 2ju4 s PRO 43 Cb -0.16 -2.29 0.00 0.00 0.04 0.00 0.00 34.50 32.09 2ju4 s PRO 43 CO 0.46 -0.37 0.00 1.63 0.04 0.00 0.00 177.00 178.76 2ju4 n LYS 44 N -0.60 -1.43 -1.90 4.56 5.02 -1.26 -4.66 118.16 117.89 2ju4 n LYS 44 Ca 0.08 0.00 -0.23 0.00 -2.02 0.00 0.00 58.31 56.14 2ju4 n LYS 44 Cb 0.51 0.00 -0.06 0.00 -0.02 0.00 0.00 35.03 35.46 2ju4 n LYS 44 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2ju4 s LYS 45 N -2.47 2.24 0.09 1.97 3.01 -1.26 -4.81 119.74 118.52 2ju4 s LYS 45 Ca 0.00 -0.10 -0.30 0.00 -1.01 0.00 0.00 55.97 54.56 2ju4 s LYS 45 Cb 0.00 -4.99 -0.13 0.00 -1.01 0.00 0.00 37.83 31.70 2ju4 s LYS 45 CO 0.00 -3.76 1.48 0.78 0.51 0.00 0.00 175.35 174.36 2ju4 h GLY 46 N 19.34 -1.18 -6.36 -3.33 0.00 -1.88 -3.47 103.07 106.19 2ju4 h GLY 46 Ca 0.07 0.62 -0.33 0.00 0.00 0.00 0.00 47.33 47.69 2ju4 h GLY 46 CO 1.15 -0.30 -1.10 -0.62 0.00 0.00 0.00 176.54 175.66 2ju4 n VAL 47 N -5.08 -5.06 -1.68 4.60 0.31 -1.26 -3.14 118.33 107.02 2ju4 n VAL 47 Ca -0.08 0.21 -0.11 0.00 -0.01 0.00 0.00 64.34 64.35 2ju4 n VAL 47 Cb 0.36 -4.14 0.01 0.00 -0.91 0.00 0.00 33.84 29.17 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 -0.25 -0.52 0.00 5.55 10.64 -1.26 -5.09 117.38 126.44 2ju4 n GLN 48 Ca -0.06 0.39 0.00 0.00 -1.83 0.00 0.00 57.00 55.50 2ju4 n GLN 48 Cb 0.65 -0.54 0.00 0.00 -0.86 0.00 0.00 30.24 29.49 2ju4 n GLN 48 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2ju4 n GLY 49 N -0.04 3.67 0.00 2.61 0.00 -1.19 -5.19 105.19 105.06 2ju4 n GLY 49 Ca -0.02 -1.60 0.00 0.00 0.00 0.00 0.00 46.02 44.40 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 -0.97 -1.26 0.00 -0.02 0.00 -1.26 -4.84 105.19 96.84 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 1.22 0.00 0.00 0.00 173.32 174.54 2ju4 n ASP 52 N 0.00 0.00 -4.36 1.61 8.00 -1.26 -5.02 116.55 115.51 2ju4 n ASP 52 Ca 0.00 -0.84 -0.46 0.00 0.71 0.00 0.00 54.79 54.20 2ju4 n ASP 52 Cb 0.00 0.00 -0.01 0.00 -0.02 0.00 0.00 41.12 41.09 2ju4 n ASP 52 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 2ju4 s ASP 53 N 0.00 6.94 -0.49 -2.24 1.11 -1.26 -4.90 116.67 115.83 2ju4 s ASP 53 Ca 0.00 -2.90 0.05 0.00 0.18 0.00 0.00 52.55 49.87 2ju4 s ASP 53 Cb 0.00 -2.25 0.18 0.00 1.07 0.00 0.00 42.92 41.91 2ju4 s ASP 53 CO 0.00 -0.57 0.41 -0.38 1.18 0.00 0.00 175.17 175.81 2ju4 n ILE 54 N 3.86 -0.33 0.00 0.77 -0.00 -1.26 -5.00 119.36 117.40 2ju4 n ILE 54 Ca 0.20 -3.90 0.00 0.00 -0.00 0.00 0.00 62.75 59.06 2ju4 n ILE 54 Cb 0.45 -1.83 0.00 0.00 -0.00 0.00 0.00 39.64 38.26 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 2.45 0.00 0.05 0.38 -0.04 -1.26 -4.52 135.00 132.06 2ju4 n PRO 55 Ca 0.27 0.17 0.12 0.00 -0.04 0.00 0.00 63.50 64.01 2ju4 n PRO 55 Cb 0.45 -0.58 0.46 0.00 -0.04 0.00 0.00 33.50 33.79 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 2.06 -1.38 3.52 0.55 0.00 -1.26 -4.55 105.19 104.13 2ju4 n GLY 56 Ca 0.00 -0.03 -0.42 0.00 0.00 0.00 0.00 46.02 45.57 2ju4 n GLY 56 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2ju4 s MET 57 N -3.09 3.24 0.00 1.61 -1.94 -1.26 -4.16 119.30 113.69 2ju4 s MET 57 Ca 0.09 -0.61 0.00 0.00 -1.71 0.00 0.00 55.69 53.46 2ju4 s MET 57 Cb 0.13 -4.40 0.00 0.00 2.01 0.00 0.00 34.83 32.57 2ju4 s MET 57 CO 0.45 -2.04 0.00 -1.91 -0.01 0.00 0.00 175.02 171.51 2ju4 n GLU 58 N 8.68 0.00 -2.49 2.03 4.07 -1.26 -4.97 120.64 126.70 2ju4 n GLU 58 Ca 0.06 0.00 -0.33 0.00 -0.06 0.00 0.00 57.16 56.83 2ju4 n GLU 58 Cb 0.48 0.00 -0.03 0.00 -0.06 0.00 0.00 31.44 31.83 2ju4 n GLU 58 CO 0.00 0.00 0.00 0.20 -0.06 0.00 0.00 177.13 177.27 2ju4 s GLY 59 N -0.44 2.37 0.00 8.31 0.00 -1.26 -5.11 107.32 111.19 2ju4 s GLY 59 Ca 0.00 0.48 0.00 0.00 0.00 0.00 0.00 44.72 45.20 2ju4 s GLY 59 CO 0.00 0.79 0.00 0.61 0.00 0.00 0.00 173.10 174.50 2ju4 n GLY 61 N -0.60 0.64 2.72 0.20 0.00 -1.26 -4.90 105.19 101.99 2ju4 n GLY 61 Ca 0.08 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.83 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 -2.70 1.38 -0.20 2.61 -2.24 -1.26 -4.93 114.28 106.95 2ju4 n THR 62 Ca 0.00 -4.75 -0.02 0.00 -2.27 0.00 0.00 64.05 57.01 2ju4 n THR 62 Cb 0.00 -2.10 -0.03 0.00 -2.10 0.00 0.00 70.33 66.10 2ju4 n THR 62 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2ju4 n ASP 63 N 1.82 1.25 0.00 3.42 9.92 -1.17 -1.77 116.55 130.02 2ju4 n ASP 63 Ca 0.23 -1.61 0.00 0.00 -0.53 0.00 0.00 54.79 52.88 2ju4 n ASP 63 Cb 0.38 -0.32 0.00 0.00 -0.64 0.00 0.00 41.12 40.55 2ju4 n ASP 63 CO 0.00 0.00 0.00 -0.38 0.13 0.00 0.00 177.20 176.95 2ju4 n ILE 64 N 2.58 0.00 0.00 0.53 5.41 0.87 -3.78 119.36 124.96 2ju4 n ILE 64 Ca 0.07 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.82 2ju4 n ILE 64 Cb 0.19 0.36 0.00 0.00 -0.71 0.00 0.00 39.64 39.48 2ju4 n ILE 64 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 2ju4 n THR 65 N 0.00 0.00 0.14 1.39 -2.24 -0.73 -4.85 114.28 107.99 2ju4 n THR 65 Ca 0.00 0.00 0.15 0.00 -2.27 0.00 0.00 64.05 61.93 2ju4 n THR 65 Cb 0.00 0.00 0.46 0.00 -2.10 0.00 0.00 70.33 68.69 2ju4 n THR 65 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 2ju4 h VAL 66 N 0.00 0.07 -2.53 2.28 2.07 -1.95 -3.50 116.25 112.70 2ju4 h VAL 66 Ca 0.00 0.00 -0.52 0.00 0.82 0.00 0.00 66.70 67.00 2ju4 h VAL 66 Cb 0.00 0.29 -0.14 0.00 -1.52 0.00 0.00 31.29 29.92 2ju4 h VAL 66 CO 0.00 0.00 -0.69 -0.63 0.02 0.00 0.00 177.57 176.27 2ju4 s ILE 67 N -4.26 1.80 0.16 4.57 1.09 -1.18 -5.08 121.20 118.30 2ju4 s ILE 67 Ca -0.02 -2.16 0.19 0.00 -1.10 0.00 0.00 60.65 57.56 2ju4 s ILE 67 Cb 0.09 -2.43 0.15 0.00 -1.06 0.00 0.00 42.46 39.21 2ju4 s ILE 67 CO 0.30 -0.32 1.74 -0.65 -0.10 0.00 0.00 174.94 175.91 2ju4 h PRO 69 N 2.26 0.00 -0.57 2.79 0.10 -1.94 2.60 132.00 137.24 2ju4 h PRO 69 Ca -0.40 0.00 0.00 0.00 0.10 0.00 0.00 66.00 65.70 2ju4 h PRO 69 Cb 1.24 0.00 0.00 0.00 0.10 0.00 0.00 31.00 32.34 2ju4 h PRO 69 CO 0.67 0.35 0.00 0.91 0.10 0.00 0.00 178.00 180.03 2ju4 n TRP 70 N -3.51 0.00 -0.37 0.65 5.03 -1.26 -1.78 117.44 116.21 2ju4 n TRP 70 Ca -0.00 0.00 0.00 0.00 3.03 0.00 0.00 57.50 60.53 2ju4 n TRP 70 Cb 0.50 -0.06 0.00 0.00 -1.03 0.00 0.00 31.31 30.72 2ju4 n TRP 70 CO 0.00 0.00 0.00 0.39 -0.03 0.00 0.00 177.69 178.05 2ju4 n GLU 71 N 0.17 0.86 -2.01 -0.99 1.02 -1.26 -5.09 120.64 113.34 2ju4 n GLU 71 Ca 0.00 -0.11 -0.26 0.00 -0.02 0.00 0.00 57.16 56.77 2ju4 n GLU 71 Cb 0.14 -0.48 -0.06 0.00 -0.02 0.00 0.00 31.44 31.02 2ju4 n GLU 71 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2ju4 s ALA 72 N -0.15 1.62 0.00 0.62 0.00 -0.73 -4.90 121.76 118.21 2ju4 s ALA 72 Ca 0.00 -1.86 0.00 0.00 0.00 0.00 0.00 51.96 50.10 2ju4 s ALA 72 Cb 0.00 -4.64 0.00 0.00 0.00 0.00 0.00 23.12 18.48 2ju4 s ALA 72 CO 0.00 -5.26 0.00 0.09 0.00 0.00 0.00 175.76 170.59 2ju4 n ASN 74 N 14.82 0.00 0.00 0.00 4.13 -1.26 -5.17 115.26 127.78 2ju4 n ASN 74 Ca 0.43 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.69 2ju4 n ASN 74 Cb 0.47 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.71 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 0.00 0.00 3.10 -0.00 -1.26 -5.30 115.22 111.76 2ju4 n HIS 75 Ca 0.00 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.18 2ju4 n HIS 75 Cb 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 29.87 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 0.00 -1.62 -0.22 1.57 1.02 -1.26 -5.20 120.64 114.93 2ju4 n GLU 77 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 2ju4 n GLU 77 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 2ju4 n GLU 77 CO 0.00 0.00 0.00 1.47 1.18 0.00 0.00 177.13 179.78 2ju4 n LEU 78 N 0.00 0.00 0.00 -4.62 -0.00 -1.26 -4.98 117.00 106.14 2ju4 n LEU 78 Ca 0.00 -0.61 0.00 0.00 -0.00 0.00 0.00 56.01 55.40 2ju4 n LEU 78 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.42 2ju4 n LEU 78 CO 0.00 0.70 0.00 1.57 -0.00 0.00 0.00 177.39 179.66 2ju4 n HIS 79 N 0.00 -0.38 -0.09 1.47 -0.00 -1.26 -4.73 115.22 110.23 2ju4 n HIS 79 Ca 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 57.72 57.66 2ju4 n HIS 79 Cb 0.39 0.27 0.01 0.00 -0.00 0.00 0.00 29.99 30.66 2ju4 n HIS 79 CO 0.00 0.00 0.00 1.49 -0.00 0.00 0.00 176.34 177.83 2ju4 h GLU 80 N 0.00 0.19 0.00 1.57 4.81 -2.04 -0.38 114.58 118.73 2ju4 h GLU 80 Ca 0.00 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.18 2ju4 h GLU 80 Cb 0.00 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.33 2ju4 h GLU 80 CO 0.00 0.12 -0.19 -0.07 -0.73 0.00 0.00 179.01 178.15 2ju4 h LEU 81 N 0.19 0.00 -1.54 1.64 -0.00 -1.94 -3.01 115.31 110.66 2ju4 h LEU 81 Ca 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.03 2ju4 h LEU 81 Cb 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 40.82 2ju4 h LEU 81 CO -0.20 0.19 0.00 0.00 -0.00 0.00 0.00 178.44 178.43 2ju4 n ALA 82 N -2.21 1.78 0.04 1.53 0.00 -0.15 -3.44 120.51 118.06 2ju4 n ALA 82 Ca -0.00 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.24 2ju4 n ALA 82 Cb 0.39 -1.00 -0.13 0.00 0.00 0.00 0.00 19.45 18.72 2ju4 n ALA 82 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2ju4 h GLN 83 N 0.90 0.44 0.00 0.00 7.50 -1.63 -3.43 115.11 118.88 2ju4 h GLN 83 Ca 0.00 -0.58 -0.09 0.00 0.50 0.00 0.00 58.65 58.48 2ju4 h GLN 83 Cb 0.32 0.19 -0.08 0.00 0.05 0.00 0.00 27.48 27.96 2ju4 h GLN 83 CO 0.00 1.23 -0.17 2.48 -1.50 0.00 0.00 178.83 180.87 2ju4 n TYR 84 N -4.06 -0.42 -0.21 2.96 4.11 -1.22 -4.98 117.16 113.33 2ju4 n TYR 84 Ca -0.12 -0.54 -0.07 0.00 -0.00 0.00 0.00 57.90 57.16 2ju4 n TYR 84 Cb 0.81 0.66 0.03 0.00 -0.00 0.00 0.00 39.34 40.84 2ju4 n TYR 84 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 176.86 177.64 2ju4 h GLY 85 N 0.20 0.97 0.00 -7.48 0.00 -1.84 -3.54 103.07 91.38 2ju4 h GLY 85 Ca -0.31 -0.53 0.00 0.00 0.00 0.00 0.00 47.33 46.49 2ju4 h GLY 85 CO -0.15 0.50 0.00 1.39 0.00 0.00 0.00 176.54 178.28