#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 -4.56 7.83 4.13 -1.26 -4.61 115.26 116.79 2ju4 n ASN 2 Ca 0.00 0.07 -0.34 0.00 1.68 0.00 0.00 54.58 55.99 2ju4 n ASN 2 Cb 0.00 -0.10 -0.04 0.00 -1.54 0.00 0.00 39.78 38.10 2ju4 n ASN 2 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 2ju4 s LEU 3 N -1.99 3.32 0.14 3.41 2.96 -1.26 -4.94 118.68 120.31 2ju4 s LEU 3 Ca 0.00 -0.99 0.11 0.00 -0.22 0.00 0.00 54.13 53.03 2ju4 s LEU 3 Cb 0.00 -2.56 -0.04 0.00 0.50 0.00 0.00 46.19 44.09 2ju4 s LEU 3 CO 0.00 -2.13 -0.26 -1.61 -1.32 0.00 0.00 176.35 171.02 2ju4 s GLU 4 N 6.04 1.40 0.31 1.98 2.02 -1.26 -5.09 118.70 124.09 2ju4 s GLU 4 Ca 0.58 -1.36 -0.25 0.00 0.02 0.00 0.00 54.97 53.96 2ju4 s GLU 4 Cb -0.04 -1.87 -0.16 0.00 0.10 0.00 0.00 34.13 32.16 2ju4 s GLU 4 CO -0.04 0.44 0.36 -2.30 0.02 0.00 0.00 175.26 173.74 2ju4 n PRO 5 N 0.85 0.11 -1.61 0.39 -0.02 -1.26 -4.93 135.00 128.53 2ju4 n PRO 5 Ca -0.17 0.04 -0.31 0.00 -2.02 0.00 0.00 63.50 61.03 2ju4 n PRO 5 Cb 0.53 -1.08 0.05 0.00 -0.02 0.00 0.00 33.50 32.98 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 -1.08 2.93 -0.32 0.52 0.04 -1.26 -4.93 135.00 130.90 2ju4 s PRO 6 Ca 0.62 1.01 -0.28 0.00 0.04 0.00 0.00 61.00 62.38 2ju4 s PRO 6 Cb -0.77 -1.99 -0.03 0.00 0.04 0.00 0.00 34.50 31.76 2ju4 s PRO 6 CO 0.59 -1.11 1.94 0.15 0.04 0.00 0.00 177.00 178.62 2ju4 s LYS 7 N -4.90 3.18 0.00 4.56 -0.14 -1.26 -4.89 119.74 116.29 2ju4 s LYS 7 Ca 0.59 1.55 0.00 0.00 -1.36 0.00 0.00 55.97 56.75 2ju4 s LYS 7 Cb -0.15 -4.27 0.00 0.00 -1.68 0.00 0.00 37.83 31.73 2ju4 s LYS 7 CO 0.53 -2.04 0.28 0.00 -0.76 0.00 0.00 175.35 173.36 2ju4 n ALA 8 N 11.06 -0.08 -1.30 5.17 0.00 -1.26 -5.18 120.51 128.92 2ju4 n ALA 8 Ca 0.25 0.00 0.15 0.00 0.00 0.00 0.00 53.44 53.84 2ju4 n ALA 8 Cb 0.47 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.85 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 -1.10 -2.74 -0.07 0.00 2.13 -1.26 -5.03 120.64 112.57 2ju4 n GLU 9 Ca 0.00 2.18 0.00 0.00 0.66 0.00 0.00 57.16 60.00 2ju4 n GLU 9 Cb 0.00 -3.32 0.00 0.00 0.27 0.00 0.00 31.44 28.39 2ju4 n GLU 9 CO 0.00 0.00 0.00 -2.13 -0.41 0.00 0.00 177.13 174.59 2ju4 n ARG 11 N -4.07 0.00 -1.89 5.31 3.00 -1.26 -5.09 116.66 112.67 2ju4 n ARG 11 Ca -0.06 0.02 -0.42 0.00 -0.00 0.00 0.00 57.85 57.39 2ju4 n ARG 11 Cb 0.61 -0.20 -0.03 0.00 0.00 0.00 0.00 32.46 32.83 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 -2.05 6.54 -0.19 6.15 0.01 -1.26 -4.98 113.70 117.92 2ju4 s SER 12 Ca 0.00 2.67 -0.09 0.00 1.31 0.00 0.00 55.95 59.84 2ju4 s SER 12 Cb 0.00 -2.59 -0.05 0.00 0.21 0.00 0.00 66.02 63.59 2ju4 s SER 12 CO 0.00 -0.86 0.12 0.00 0.41 0.00 0.00 173.24 172.91 2ju4 s ALA 13 N 1.20 3.66 -0.28 1.44 0.00 -1.26 -5.07 121.76 121.45 2ju4 s ALA 13 Ca 0.71 -0.69 -0.17 0.00 0.00 0.00 0.00 51.96 51.81 2ju4 s ALA 13 Cb -0.45 -2.09 0.08 0.00 0.00 0.00 0.00 23.12 20.66 2ju4 s ALA 13 CO 0.31 0.23 0.71 0.99 0.00 0.00 0.00 175.76 178.00 2ju4 s THR 14 N 0.17 0.00 -0.55 0.00 2.01 -1.26 -5.10 115.64 110.90 2ju4 s THR 14 Ca 0.08 0.00 -0.28 0.00 0.31 0.00 0.00 61.69 61.80 2ju4 s THR 14 Cb -0.11 -1.00 0.01 0.00 0.01 0.00 0.00 72.50 71.41 2ju4 s THR 14 CO -0.01 0.00 1.42 -0.13 -0.69 0.00 0.00 174.62 175.21 2ju4 s ARG 15 N 1.49 3.30 0.05 4.92 0.52 -1.26 -4.95 118.95 123.02 2ju4 s ARG 15 Ca -0.09 0.48 -0.30 0.00 -0.52 0.00 0.00 55.73 55.30 2ju4 s ARG 15 Cb -0.05 -4.12 -0.08 0.00 0.52 0.00 0.00 34.95 31.21 2ju4 s ARG 15 CO -0.18 -1.93 1.74 0.08 0.02 0.00 0.00 175.30 175.03 2ju4 s VAL 16 N 6.08 3.03 0.20 3.52 1.01 -1.26 -4.87 120.40 128.10 2ju4 s VAL 16 Ca 0.53 0.36 -0.11 0.00 0.00 0.00 0.00 61.98 62.77 2ju4 s VAL 16 Cb -0.11 -3.23 0.13 0.00 0.00 0.00 0.00 36.38 33.16 2ju4 s VAL 16 CO 0.25 -0.01 1.81 0.24 0.00 0.00 0.00 175.10 177.39 2ju4 h MET 17 N 8.95 0.97 0.00 2.72 0.00 -1.92 -3.47 114.93 122.18 2ju4 h MET 17 Ca -0.44 -0.11 0.00 0.00 0.00 0.00 0.00 59.70 59.15 2ju4 h MET 17 Cb 1.21 -0.19 0.00 0.00 0.00 0.00 0.00 31.60 32.61 2ju4 h MET 17 CO 0.94 0.72 0.00 0.41 0.00 0.00 0.00 176.91 178.98 2ju4 n GLY 18 N -1.08 1.69 0.06 8.32 0.00 -1.26 -4.09 105.19 108.83 2ju4 n GLY 18 Ca 0.06 -0.33 -0.02 0.00 0.00 0.00 0.00 46.02 45.72 2ju4 n GLY 18 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2ju4 h GLY 19 N 0.00 0.00 -5.78 -0.02 0.00 -2.04 -3.52 103.07 91.71 2ju4 h GLY 19 Ca 0.00 0.00 -0.73 0.00 0.00 0.00 0.00 47.33 46.60 2ju4 h GLY 19 CO 0.00 0.00 0.39 -1.05 0.00 0.00 0.00 176.54 175.88 2ju4 n PRO 20 N -4.65 0.75 0.00 4.80 -0.02 -1.26 -5.17 135.00 129.46 2ju4 n PRO 20 Ca -0.04 0.27 0.00 0.00 -2.02 0.00 0.00 63.50 61.72 2ju4 n PRO 20 Cb 0.14 -1.87 0.00 0.00 -0.02 0.00 0.00 33.50 31.75 2ju4 n PRO 20 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2ju4 n THR 22 N 2.50 0.00 0.00 3.45 -2.24 -1.26 -4.85 114.28 111.88 2ju4 n THR 22 Ca 0.20 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.98 2ju4 n THR 22 Cb 0.14 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.37 2ju4 n THR 22 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 2ju4 n PRO 23 N 0.00 1.54 0.00 -0.78 -0.02 -1.26 -5.06 135.00 129.42 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 0.54 1.98 0.00 0.00 175.50 178.02 2ju4 n ARG 24 N -0.16 0.00 -1.54 -0.52 5.12 -1.26 -4.97 116.66 113.34 2ju4 n ARG 24 Ca 0.00 0.00 -0.31 0.00 -1.93 0.00 0.00 57.85 55.61 2ju4 n ARG 24 Cb 0.00 0.00 -0.08 0.00 -1.16 0.00 0.00 32.46 31.22 2ju4 n ARG 24 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 2ju4 n LYS 25 N 0.00 0.63 0.00 5.56 4.76 -1.26 -4.65 118.16 123.20 2ju4 n LYS 25 Ca 0.00 -0.19 0.00 0.00 -2.87 0.00 0.00 58.31 55.25 2ju4 n LYS 25 Cb 0.00 -2.88 0.00 0.00 -1.84 0.00 0.00 35.03 30.31 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 6.24 -0.25 3.69 0.72 0.00 -1.26 -4.77 105.19 109.55 2ju4 n GLY 26 Ca 0.48 0.00 -0.65 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.11 0.16 -0.93 1.61 -0.02 -1.26 -4.09 135.00 130.35 2ju4 n PRO 27 Ca 0.00 0.06 -0.35 0.00 -2.02 0.00 0.00 63.50 61.19 2ju4 n PRO 27 Cb 0.11 -1.58 0.07 0.00 -0.02 0.00 0.00 33.50 32.07 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 3.61 -0.12 0.00 0.52 -0.02 -1.26 -4.96 135.00 132.77 2ju4 n PRO 28 Ca 0.28 -0.02 0.00 0.00 -2.02 0.00 0.00 63.50 61.74 2ju4 n PRO 28 Cb -0.00 -1.28 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 1.17 1.98 0.00 0.00 175.50 178.65 2ju4 n LYS 29 N 1.10 0.00 0.00 -0.52 4.81 -1.26 -5.17 118.16 117.12 2ju4 n LYS 29 Ca 0.01 0.00 0.04 0.00 -0.87 0.00 0.00 58.31 57.48 2ju4 n LYS 29 Cb 0.56 0.00 0.02 0.00 0.02 0.00 0.00 35.03 35.63 2ju4 n LYS 29 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 2ju4 n LYS 31 N -0.33 0.54 -3.45 1.64 5.02 -1.26 -5.20 118.16 115.12 2ju4 n LYS 31 Ca 0.00 -0.84 -0.19 0.00 -2.02 0.00 0.00 58.31 55.26 2ju4 n LYS 31 Cb 0.00 -1.11 0.07 0.00 -0.02 0.00 0.00 35.03 33.97 2ju4 n LYS 31 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 2ju4 n GLN 32 N 0.25 -4.00 -1.52 1.97 6.02 -1.26 -4.62 117.38 114.23 2ju4 n GLN 32 Ca 0.04 0.76 0.00 0.00 -0.01 0.00 0.00 57.00 57.80 2ju4 n GLN 32 Cb 0.18 -5.51 -0.00 0.00 1.02 0.00 0.00 30.24 25.93 2ju4 n GLN 32 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2ju4 n ARG 33 N -3.83 -3.58 -2.30 -1.09 3.00 -1.26 -4.90 116.66 102.71 2ju4 n ARG 33 Ca -0.19 2.78 0.01 0.00 -0.01 0.00 0.00 57.85 60.45 2ju4 n ARG 33 Cb 0.64 -3.57 0.04 0.00 0.00 0.00 0.00 32.46 29.58 2ju4 n ARG 33 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.63 178.67 2ju4 n GLN 34 N -2.59 1.04 0.00 5.56 1.13 -1.26 -5.10 117.38 116.17 2ju4 n GLN 34 Ca -0.00 -2.80 0.00 0.00 -1.94 0.00 0.00 57.00 52.26 2ju4 n GLN 34 Cb 0.43 -0.89 0.00 0.00 0.11 0.00 0.00 30.24 29.89 2ju4 n GLN 34 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 2ju4 n THR 35 N -0.23 0.00 -2.03 5.09 -2.24 -1.26 -3.92 114.28 109.69 2ju4 n THR 35 Ca 0.05 0.00 -0.07 0.00 -2.27 0.00 0.00 64.05 61.75 2ju4 n THR 35 Cb 0.93 -0.03 -0.01 0.00 -2.10 0.00 0.00 70.33 69.11 2ju4 n THR 35 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2ju4 n ARG 36 N 0.00 -2.07 0.00 -0.78 1.74 -1.26 -5.14 116.66 109.15 2ju4 n ARG 36 Ca 0.00 0.38 0.00 0.00 -0.77 0.00 0.00 57.85 57.46 2ju4 n ARG 36 Cb 0.00 -4.79 0.00 0.00 -1.02 0.00 0.00 32.46 26.65 2ju4 n ARG 36 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2ju4 n GLN 37 N -2.27 0.00 0.00 5.56 3.00 -1.25 -4.83 117.38 117.59 2ju4 n GLN 37 Ca -0.08 0.44 0.00 0.00 -0.01 0.00 0.00 57.00 57.34 2ju4 n GLN 37 Cb 0.45 -1.18 0.00 0.00 0.00 0.00 0.00 30.24 29.51 2ju4 n GLN 37 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.06 178.69 2ju4 n LYS 39 N -1.40 0.00 0.00 -1.09 4.01 -1.26 -5.05 118.16 113.37 2ju4 n LYS 39 Ca 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.80 2ju4 n LYS 39 Cb 0.00 -0.02 0.00 0.00 -0.51 0.00 0.00 35.03 34.50 2ju4 n LYS 39 CO 0.00 0.00 0.00 0.43 -1.11 0.00 0.00 177.40 176.72 2ju4 n SER 40 N 0.00 0.55 -3.45 4.39 7.64 -1.26 -5.10 113.62 116.39 2ju4 n SER 40 Ca 0.00 0.00 -0.28 0.00 1.01 0.00 0.00 58.87 59.60 2ju4 n SER 40 Cb 0.00 0.00 -0.11 0.00 -1.01 0.00 0.00 64.21 63.09 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 2.49 0.92 0.83 1.43 -2.85 -1.26 -4.92 119.74 116.38 2ju4 s LYS 41 Ca 0.00 -1.99 -0.11 0.00 -1.00 0.00 0.00 55.97 52.87 2ju4 s LYS 41 Cb 0.00 -1.54 0.09 0.00 -2.06 0.00 0.00 37.83 34.32 2ju4 s LYS 41 CO 0.00 -1.33 1.09 -1.25 0.10 0.00 0.00 175.35 173.96 2ju4 s PRO 42 N 0.22 1.82 1.04 1.78 0.04 -1.26 -5.00 135.00 133.64 2ju4 s PRO 42 Ca 0.28 1.04 -0.15 0.00 0.04 0.00 0.00 61.00 62.21 2ju4 s PRO 42 Cb -0.04 -1.86 0.09 0.00 0.04 0.00 0.00 34.50 32.73 2ju4 s PRO 42 CO -0.14 -1.91 0.31 -0.35 0.04 0.00 0.00 177.00 174.94 2ju4 n PRO 43 N -3.69 -1.07 0.00 0.56 -0.04 -1.26 -4.68 135.00 124.83 2ju4 n PRO 43 Ca 0.08 -0.28 0.00 0.00 -0.04 0.00 0.00 63.50 63.26 2ju4 n PRO 43 Cb 0.54 -1.83 0.00 0.00 -0.04 0.00 0.00 33.50 32.16 2ju4 n PRO 43 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 2ju4 n LYS 44 N -2.24 0.00 0.00 0.54 4.81 -1.26 -4.83 118.16 115.18 2ju4 n LYS 44 Ca 0.04 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.48 2ju4 n LYS 44 Cb 0.57 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.62 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 3.88 -0.36 0.00 1.64 4.76 -1.12 -4.89 118.16 122.06 2ju4 n LYS 45 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 2ju4 n LYS 45 Cb 0.00 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.19 2ju4 n LYS 45 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2ju4 n GLY 46 N -0.22 1.57 0.41 0.72 0.00 -1.26 -3.68 105.19 102.72 2ju4 n GLY 46 Ca 0.00 0.14 0.24 0.00 0.00 0.00 0.00 46.02 46.40 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 0.00 0.49 -2.88 1.61 2.07 -1.99 -3.37 116.25 112.19 2ju4 h VAL 47 Ca 0.00 -0.12 -0.29 0.00 0.82 0.00 0.00 66.70 67.11 2ju4 h VAL 47 Cb 0.00 0.10 -0.35 0.00 -1.52 0.00 0.00 31.29 29.52 2ju4 h VAL 47 CO 0.00 0.07 -0.61 0.00 0.02 0.00 0.00 177.57 177.04 2ju4 s GLN 48 N -5.46 0.10 0.00 1.57 -2.07 -1.24 -5.04 119.66 107.51 2ju4 s GLN 48 Ca -0.09 0.49 0.00 0.00 -1.82 0.00 0.00 55.36 53.95 2ju4 s GLN 48 Cb 0.26 -0.51 0.00 0.00 -1.09 0.00 0.00 33.01 31.66 2ju4 s GLN 48 CO 0.80 -0.41 0.00 0.41 -1.32 0.00 0.00 175.29 174.77 2ju4 n GLY 49 N 5.33 0.00 2.71 2.60 0.00 -1.26 -2.80 105.19 111.77 2ju4 n GLY 49 Ca -0.05 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.91 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 2.17 0.05 -0.02 0.00 -1.26 -4.85 105.19 101.27 2ju4 n GLY 51 Ca 0.00 -1.31 0.13 0.00 0.00 0.00 0.00 46.02 44.84 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 -0.43 0.55 0.00 1.61 9.92 -1.26 -4.88 116.55 122.06 2ju4 n ASP 52 Ca 0.11 0.21 0.00 0.00 -0.53 0.00 0.00 54.79 54.59 2ju4 n ASP 52 Cb 0.81 -0.16 0.00 0.00 -0.64 0.00 0.00 41.12 41.14 2ju4 n ASP 52 CO 0.00 0.00 0.00 -0.67 0.13 0.00 0.00 177.20 176.66 2ju4 n ASP 53 N -1.90 0.00 -3.16 -2.24 -0.08 -1.26 -4.67 116.55 103.24 2ju4 n ASP 53 Ca 0.05 0.00 -0.19 0.00 -1.51 0.00 0.00 54.79 53.14 2ju4 n ASP 53 Cb 0.40 -0.55 -0.06 0.00 2.34 0.00 0.00 41.12 43.25 2ju4 n ASP 53 CO 0.00 0.00 0.00 -0.38 0.12 0.00 0.00 177.20 176.94 2ju4 n ILE 54 N -1.52 -0.77 -1.97 5.18 5.41 -1.26 -5.14 119.36 119.29 2ju4 n ILE 54 Ca 0.00 -2.56 -0.33 0.00 1.00 0.00 0.00 62.75 60.86 2ju4 n ILE 54 Cb 0.00 -0.69 0.02 0.00 -0.71 0.00 0.00 39.64 38.27 2ju4 n ILE 54 CO 0.00 0.00 0.00 -2.16 0.00 0.00 0.00 176.55 174.39 2ju4 s PRO 55 N 0.33 3.10 0.69 0.38 0.04 -1.26 -4.39 135.00 133.88 2ju4 s PRO 55 Ca 0.32 1.38 0.00 0.00 0.04 0.00 0.00 61.00 62.74 2ju4 s PRO 55 Cb 0.03 -1.99 0.00 0.00 0.04 0.00 0.00 34.50 32.58 2ju4 s PRO 55 CO -0.15 -1.01 0.00 0.41 0.04 0.00 0.00 177.00 176.29 2ju4 n GLY 56 N -0.49 1.02 4.55 0.56 0.00 -1.26 -4.86 105.19 104.70 2ju4 n GLY 56 Ca 0.10 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.59 2ju4 n GLY 56 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2ju4 n MET 57 N 0.00 0.00 -3.14 1.61 1.56 -1.26 -4.24 117.12 111.65 2ju4 n MET 57 Ca 0.00 0.00 -0.20 0.00 -0.27 0.00 0.00 57.70 57.23 2ju4 n MET 57 Cb 0.00 -2.38 0.02 0.00 2.15 0.00 0.00 33.22 33.01 2ju4 n MET 57 CO 0.00 0.00 0.00 0.39 -0.73 0.00 0.00 175.97 175.63 2ju4 n GLU 58 N -1.45 -2.14 0.00 2.12 1.02 -1.26 -4.93 120.64 114.00 2ju4 n GLU 58 Ca 0.00 1.79 0.00 0.00 -0.02 0.00 0.00 57.16 58.93 2ju4 n GLU 58 Cb 0.00 -4.21 0.00 0.00 -0.02 0.00 0.00 31.44 27.21 2ju4 n GLU 58 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2ju4 n GLY 59 N -0.37 0.21 0.65 0.62 0.00 -1.26 -4.81 105.19 100.23 2ju4 n GLY 59 Ca 0.02 -0.93 0.00 0.00 0.00 0.00 0.00 46.02 45.11 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 0.00 0.30 4.76 -0.02 0.00 -1.26 -5.04 105.19 103.93 2ju4 n GLY 61 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 0.57 0.00 0.41 2.61 -2.24 -1.26 -4.63 114.28 109.74 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 0.06 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.29 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 0.18 1.16 0.00 3.42 -0.08 -1.26 -2.53 116.55 117.43 2ju4 n ASP 63 Ca 0.00 -0.83 0.00 0.00 -1.51 0.00 0.00 54.79 52.45 2ju4 n ASP 63 Cb 0.00 -0.21 0.00 0.00 2.34 0.00 0.00 41.12 43.25 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 0.74 0.00 -0.17 5.18 3.06 -0.95 -4.54 119.36 122.69 2ju4 n ILE 64 Ca 0.00 0.00 -0.11 0.00 -2.50 0.00 0.00 62.75 60.14 2ju4 n ILE 64 Cb 0.20 0.00 0.00 0.00 0.54 0.00 0.00 39.64 40.38 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 1.27 0.03 9.51 2.02 -1.88 -3.32 112.91 120.54 2ju4 h THR 65 Ca 0.00 -1.22 -0.38 0.00 0.77 0.00 0.00 66.41 65.58 2ju4 h THR 65 Cb 0.00 1.05 -0.06 0.00 -1.74 0.00 0.00 68.15 67.40 2ju4 h THR 65 CO 0.00 0.43 -2.35 1.33 0.37 0.00 0.00 175.52 175.30 2ju4 n VAL 66 N -4.23 1.56 -4.19 3.16 0.24 -1.19 -5.15 118.33 108.53 2ju4 n VAL 66 Ca 0.01 -0.61 -0.14 0.00 -2.04 0.00 0.00 64.34 61.56 2ju4 n VAL 66 Cb 0.38 -1.45 -0.11 0.00 -1.47 0.00 0.00 33.84 31.19 2ju4 n VAL 66 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 2ju4 s ILE 67 N -2.53 0.98 -0.15 1.34 -1.09 -1.25 -5.07 121.20 113.43 2ju4 s ILE 67 Ca -0.30 -1.72 0.15 0.00 -2.23 0.00 0.00 60.65 56.54 2ju4 s ILE 67 Cb 0.08 -1.46 0.04 0.00 -1.58 0.00 0.00 42.46 39.54 2ju4 s ILE 67 CO 0.66 -0.60 1.39 -0.65 -1.23 0.00 0.00 174.94 174.51 2ju4 h PRO 69 N 3.41 0.00 -0.68 2.79 0.11 -1.92 -2.53 132.00 133.18 2ju4 h PRO 69 Ca -0.37 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.67 2ju4 h PRO 69 Cb 1.19 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.27 2ju4 h PRO 69 CO 0.55 0.49 0.14 2.35 -0.21 0.00 0.00 178.00 181.32 2ju4 h TRP 70 N 0.00 1.17 -0.59 0.65 7.01 -1.99 -2.43 115.95 119.76 2ju4 h TRP 70 Ca -0.02 -0.15 0.03 0.00 2.11 0.00 0.00 58.89 60.87 2ju4 h TRP 70 Cb 1.41 -0.32 -0.03 0.00 -2.10 0.00 0.00 29.16 28.11 2ju4 h TRP 70 CO 0.00 0.96 0.39 0.93 -2.79 0.00 0.00 178.44 177.93 2ju4 h GLU 71 N 1.03 0.67 -1.39 2.65 5.08 -1.95 -1.33 114.58 119.34 2ju4 h GLU 71 Ca 0.21 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 2ju4 h GLU 71 Cb 0.40 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.50 2ju4 h GLU 71 CO 0.01 0.44 0.00 0.00 -1.00 0.00 0.00 179.01 178.46 2ju4 n ALA 72 N -2.46 2.75 0.00 3.43 0.00 -0.92 -4.70 120.51 118.61 2ju4 n ALA 72 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 2ju4 n ALA 72 Cb 0.14 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.55 2ju4 n ALA 72 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2ju4 n ASN 74 N 0.87 0.00 -1.29 0.00 5.15 -0.50 -4.93 115.26 114.55 2ju4 n ASN 74 Ca 0.00 0.00 0.15 0.00 -0.60 0.00 0.00 54.58 54.13 2ju4 n ASN 74 Cb 0.43 0.00 -0.07 0.00 -0.53 0.00 0.00 39.78 39.61 2ju4 n ASN 74 CO 0.00 0.00 0.00 1.57 1.40 0.00 0.00 177.26 180.23 2ju4 n HIS 75 N -1.26 -3.14 0.00 1.20 -0.00 -1.26 -5.11 115.22 105.65 2ju4 n HIS 75 Ca 0.00 1.70 0.00 0.00 0.46 0.00 0.00 57.72 59.88 2ju4 n HIS 75 Cb 0.00 -2.86 0.00 0.00 -0.12 0.00 0.00 29.99 27.01 2ju4 n HIS 75 CO 0.00 0.00 0.00 -1.91 0.46 0.00 0.00 176.34 174.89 2ju4 n GLU 77 N -4.02 0.00 -1.39 1.57 4.07 -1.26 -5.15 120.64 114.46 2ju4 n GLU 77 Ca -0.06 0.00 -0.37 0.00 -0.06 0.00 0.00 57.16 56.67 2ju4 n GLU 77 Cb 0.61 0.00 0.05 0.00 -0.06 0.00 0.00 31.44 32.04 2ju4 n GLU 77 CO 0.00 0.00 0.00 1.28 -0.06 0.00 0.00 177.13 178.35 2ju4 n LEU 78 N -0.29 0.84 -0.57 4.31 4.77 -1.26 -4.89 117.00 119.91 2ju4 n LEU 78 Ca 0.00 0.68 -0.02 0.00 -0.03 0.00 0.00 56.01 56.64 2ju4 n LEU 78 Cb 0.00 -1.19 -0.02 0.00 -2.33 0.00 0.00 43.42 39.87 2ju4 n LEU 78 CO 0.00 -3.06 0.16 1.57 -1.33 0.00 0.00 177.39 174.73 2ju4 n HIS 79 N -1.96 0.00 -0.10 -1.77 -0.00 -1.26 -4.98 115.22 105.15 2ju4 n HIS 79 Ca 0.11 -0.16 -0.17 0.00 0.46 0.00 0.00 57.72 57.95 2ju4 n HIS 79 Cb 0.48 0.31 -0.13 0.00 -0.12 0.00 0.00 29.99 30.54 2ju4 n HIS 79 CO 0.00 0.00 0.00 0.39 0.46 0.00 0.00 176.34 177.19 2ju4 n GLU 80 N 0.00 0.67 0.29 1.57 4.71 -1.26 -4.15 120.64 122.47 2ju4 n GLU 80 Ca -0.09 0.16 0.11 0.00 -0.01 0.00 0.00 57.16 57.32 2ju4 n GLU 80 Cb 0.40 -1.56 0.59 0.00 -1.01 0.00 0.00 31.44 29.86 2ju4 n GLU 80 CO 0.00 0.00 0.00 -0.07 0.09 0.00 0.00 177.13 177.15 2ju4 h LEU 81 N 0.01 0.00 -1.68 -4.62 -0.00 -1.94 -0.95 115.31 106.14 2ju4 h LEU 81 Ca -0.54 0.00 0.32 0.00 -0.00 0.00 0.00 57.88 57.66 2ju4 h LEU 81 Cb 1.96 0.00 -0.07 0.00 -0.00 0.00 0.00 40.66 42.55 2ju4 h LEU 81 CO -0.04 0.00 0.78 0.00 -0.00 0.00 0.00 178.44 179.18 2ju4 h ALA 82 N 1.12 2.72 -0.81 1.53 0.00 -1.98 0.53 119.26 122.37 2ju4 h ALA 82 Ca 0.00 0.01 0.23 0.00 0.00 0.00 0.00 54.91 55.16 2ju4 h ALA 82 Cb 0.82 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.65 2ju4 h ALA 82 CO 0.00 -1.11 0.73 1.96 0.00 0.00 0.00 179.25 180.83 2ju4 h GLN 83 N 0.17 0.00 -2.18 0.00 1.08 -1.48 -3.40 115.11 109.30 2ju4 h GLN 83 Ca 0.60 0.00 -0.06 0.00 -1.45 0.00 0.00 58.65 57.74 2ju4 h GLN 83 Cb 1.98 0.00 -0.22 0.00 -0.05 0.00 0.00 27.48 29.19 2ju4 h GLN 83 CO -0.16 0.00 0.04 0.71 -0.95 0.00 0.00 178.83 178.47 2ju4 s TYR 84 N -4.71 -0.70 -0.46 2.96 2.02 0.19 -5.10 117.35 111.54 2ju4 s TYR 84 Ca -0.04 1.69 -0.28 0.00 -0.37 0.00 0.00 57.07 58.07 2ju4 s TYR 84 Cb 0.18 0.25 -0.01 0.00 -0.40 0.00 0.00 41.96 41.98 2ju4 s TYR 84 CO 0.63 -0.35 1.64 0.20 -1.57 0.00 0.00 175.55 176.10 2ju4 s GLY 85 N 0.27 0.75 0.00 0.71 0.00 -1.26 -4.85 107.32 102.94 2ju4 s GLY 85 Ca -0.01 -0.23 0.00 0.00 0.00 0.00 0.00 44.72 44.48 2ju4 s GLY 85 CO 0.01 3.09 0.11 1.39 0.00 0.00 0.00 173.10 177.70