#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 1.37 -3.21 7.83 5.15 -1.26 -4.72 115.26 120.42 2ju4 n ASN 2 Ca 0.00 -2.22 0.00 0.00 -0.60 0.00 0.00 54.58 51.76 2ju4 n ASN 2 Cb 0.00 -1.70 -0.03 0.00 -0.53 0.00 0.00 39.78 37.52 2ju4 n ASN 2 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 2ju4 s LEU 3 N 16.56 -1.21 0.16 1.20 2.96 -1.26 -5.14 118.68 131.96 2ju4 s LEU 3 Ca 0.84 0.54 -0.30 0.00 -0.22 0.00 0.00 54.13 54.99 2ju4 s LEU 3 Cb -0.07 1.83 -0.07 0.00 0.50 0.00 0.00 46.19 48.38 2ju4 s LEU 3 CO 0.16 -0.28 0.99 -1.61 -1.32 0.00 0.00 176.35 174.29 2ju4 s GLU 4 N 2.76 4.72 -0.47 1.98 8.01 -1.26 -4.92 118.70 129.51 2ju4 s GLU 4 Ca 0.17 1.52 -0.45 0.00 0.01 0.00 0.00 54.97 56.22 2ju4 s GLU 4 Cb -0.14 -3.33 -0.19 0.00 -4.31 0.00 0.00 34.13 26.16 2ju4 s GLU 4 CO -0.21 0.26 1.77 -2.30 0.01 0.00 0.00 175.26 174.79 2ju4 n PRO 5 N 2.33 0.15 -2.66 0.39 -0.02 -1.26 -4.88 135.00 129.05 2ju4 n PRO 5 Ca 0.01 0.05 -0.42 0.00 -2.02 0.00 0.00 63.50 61.12 2ju4 n PRO 5 Cb 0.48 -1.59 -0.03 0.00 -0.02 0.00 0.00 33.50 32.34 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 3.90 4.55 -0.14 0.52 0.04 -1.26 -4.93 135.00 137.68 2ju4 s PRO 6 Ca 1.08 1.49 -0.04 0.00 0.04 0.00 0.00 61.00 63.58 2ju4 s PRO 6 Cb -1.44 -3.43 -0.07 0.00 0.04 0.00 0.00 34.50 29.60 2ju4 s PRO 6 CO 0.75 -0.07 2.86 0.36 0.04 0.00 0.00 177.00 180.95 2ju4 n LYS 7 N 3.81 1.83 0.00 4.56 0.00 -1.26 -4.74 118.16 122.36 2ju4 n LYS 7 Ca 0.06 -1.12 0.00 0.00 -0.00 0.00 0.00 58.31 57.25 2ju4 n LYS 7 Cb 0.50 -1.75 0.00 0.00 -0.00 0.00 0.00 35.03 33.78 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 1.65 0.00 -1.13 0.58 0.00 -1.26 -5.14 120.51 115.20 2ju4 n ALA 8 Ca 0.33 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.89 2ju4 n ALA 8 Cb 0.70 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 20.11 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 -0.02 -2.13 0.00 0.00 -0.58 -1.26 -5.15 120.64 111.50 2ju4 n GLU 9 Ca 0.00 1.56 0.00 0.00 -0.42 0.00 0.00 57.16 58.30 2ju4 n GLU 9 Cb 0.00 -2.68 0.00 0.00 -0.57 0.00 0.00 31.44 28.19 2ju4 n GLU 9 CO 0.00 0.00 0.00 2.89 -0.48 0.00 0.00 177.13 179.54 2ju4 n ARG 11 N -3.50 0.00 0.00 3.49 1.85 -1.26 -5.21 116.66 112.04 2ju4 n ARG 11 Ca -0.02 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.83 2ju4 n ARG 11 Cb 0.63 -0.65 0.00 0.00 -1.05 0.00 0.00 32.46 31.39 2ju4 n ARG 11 CO 0.00 0.00 0.00 -1.13 -0.01 0.00 0.00 177.63 176.49 2ju4 n SER 12 N -2.25 -1.87 0.00 2.89 3.41 -1.26 -4.86 113.62 109.68 2ju4 n SER 12 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 2ju4 n SER 12 Cb 0.28 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.23 2ju4 n SER 12 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ju4 n ALA 13 N 1.92 0.00 -2.23 7.33 0.00 -1.26 -5.08 120.51 121.19 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 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 0.00-12.20 -0.93 0.00 -2.24 -1.26 -4.47 114.28 93.19 2ju4 n THR 14 Ca 0.00 2.96 -0.43 0.00 -2.27 0.00 0.00 64.05 64.31 2ju4 n THR 14 Cb 0.00 -5.44 -0.08 0.00 -2.10 0.00 0.00 70.33 62.71 2ju4 n THR 14 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2ju4 n ARG 15 N 1.90 0.86 -3.77 -0.78 1.74 -1.26 -4.87 116.66 110.48 2ju4 n ARG 15 Ca 0.00 -1.52 -0.33 0.00 -0.77 0.00 0.00 57.85 55.23 2ju4 n ARG 15 Cb 0.00 -2.80 -0.05 0.00 -1.02 0.00 0.00 32.46 28.59 2ju4 n ARG 15 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2ju4 s VAL 16 N 6.34 5.29 0.00 1.55 1.01 -1.26 -4.92 120.40 128.41 2ju4 s VAL 16 Ca 0.63 0.06 0.00 0.00 0.00 0.00 0.00 61.98 62.67 2ju4 s VAL 16 Cb 0.14 -3.59 0.00 0.00 0.00 0.00 0.00 36.38 32.93 2ju4 s VAL 16 CO 0.22 0.27 0.00 1.15 0.00 0.00 0.00 175.10 176.74 2ju4 n MET 17 N 0.80 0.00 0.00 2.72 0.00 -1.26 -5.12 117.12 114.26 2ju4 n MET 17 Ca -0.09 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.61 2ju4 n MET 17 Cb 0.52 -0.02 0.00 0.00 0.00 0.00 0.00 33.22 33.72 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 -0.90 1.36 0.00 3.17 0.00 -1.26 -5.04 105.19 102.52 2ju4 n GLY 18 Ca 0.00 -0.60 0.00 0.00 0.00 0.00 0.00 46.02 45.42 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 0.35 2.72 -0.02 0.00 -1.26 -5.17 105.19 101.81 2ju4 n GLY 19 Ca 0.00 -1.82 -0.06 0.00 0.00 0.00 0.00 46.02 44.14 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 0.58 0.73 0.00 1.61 -0.02 -1.26 -5.22 135.00 131.42 2ju4 n PRO 20 Ca 0.00 -0.26 0.00 0.00 -2.02 0.00 0.00 63.50 61.22 2ju4 n PRO 20 Cb 0.00 -1.12 0.00 0.00 -0.02 0.00 0.00 33.50 32.36 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 -3.48 0.00 0.00 3.45 -1.04 -1.26 -5.21 114.28 106.74 2ju4 n THR 22 Ca 0.02 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.03 2ju4 n THR 22 Cb 0.11 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.62 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 0.33 -2.70 -2.82 -0.02 -1.26 -4.99 135.00 123.54 2ju4 n PRO 23 Ca 0.00 0.00 -0.07 0.00 -2.02 0.00 0.00 63.50 61.41 2ju4 n PRO 23 Cb 0.00 0.00 0.03 0.00 -0.02 0.00 0.00 33.50 33.51 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 -0.72 1.35 0.00 -0.52 1.74 -1.26 -5.03 116.66 112.22 2ju4 n ARG 24 Ca 0.00 -3.34 0.00 0.00 -0.77 0.00 0.00 57.85 53.74 2ju4 n ARG 24 Cb 0.00 -1.36 0.00 0.00 -1.02 0.00 0.00 32.46 30.08 2ju4 n ARG 24 CO 0.00 0.00 0.00 1.17 -1.52 0.00 0.00 177.63 177.28 2ju4 n LYS 25 N -0.22 0.00 0.00 5.56 3.00 -1.26 -4.89 118.16 120.36 2ju4 n LYS 25 Ca 0.09 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.40 2ju4 n LYS 25 Cb 0.81 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.84 2ju4 n LYS 25 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2ju4 n GLY 26 N 0.00 -0.00 3.25 3.14 0.00 -1.26 -4.83 105.19 105.49 2ju4 n GLY 26 Ca 0.00 -0.98 -0.34 0.00 0.00 0.00 0.00 46.02 44.70 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 -0.17 -0.90 1.61 -0.02 -1.26 -4.86 135.00 129.40 2ju4 n PRO 27 Ca 0.00 -0.02 -0.33 0.00 -2.02 0.00 0.00 63.50 61.13 2ju4 n PRO 27 Cb 0.00 -1.52 0.03 0.00 -0.02 0.00 0.00 33.50 31.99 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 -0.05 0.00 0.00 0.52 -0.02 -1.26 -5.13 135.00 129.05 2ju4 n PRO 28 Ca 0.03 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.51 2ju4 n PRO 28 Cb 0.54 -0.90 0.00 0.00 -0.02 0.00 0.00 33.50 33.13 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 2.24 2.64 0.00 -0.52 2.85 -1.26 -5.09 118.16 119.02 2ju4 n LYS 29 Ca -0.02 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.24 2ju4 n LYS 29 Cb 0.55 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.93 2ju4 n LYS 29 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 177.40 177.71 2ju4 n LYS 31 N 0.00 0.00 -3.89 -1.58 2.85 -1.26 -5.10 118.16 109.18 2ju4 n LYS 31 Ca 0.00 0.00 -0.08 0.00 -1.05 0.00 0.00 58.31 57.18 2ju4 n LYS 31 Cb 0.00 0.00 -0.02 0.00 -0.65 0.00 0.00 35.03 34.36 2ju4 n LYS 31 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 177.40 176.70 2ju4 s GLN 32 N 3.30 1.81 0.00 -1.58 -0.21 -1.26 -5.00 119.66 116.72 2ju4 s GLN 32 Ca 0.00 -1.15 0.00 0.00 0.02 0.00 0.00 55.36 54.23 2ju4 s GLN 32 Cb 0.00 0.57 0.00 0.00 1.00 0.00 0.00 33.01 34.58 2ju4 s GLN 32 CO 0.00 -0.81 0.44 0.54 -2.12 0.00 0.00 175.29 173.33 2ju4 n ARG 33 N -0.46 0.83 -2.58 2.91 3.00 -1.26 -4.77 116.66 114.34 2ju4 n ARG 33 Ca -0.04 0.00 -0.17 0.00 -0.01 0.00 0.00 57.85 57.63 2ju4 n ARG 33 Cb 0.60 -1.39 -0.00 0.00 0.00 0.00 0.00 32.46 31.66 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 0.06 -2.46 0.00 5.56 3.00 -1.26 -4.92 117.38 117.36 2ju4 n GLN 34 Ca 0.00 0.74 0.00 0.00 -0.01 0.00 0.00 57.00 57.73 2ju4 n GLN 34 Cb 0.20 -5.40 0.00 0.00 0.00 0.00 0.00 30.24 25.04 2ju4 n GLN 34 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.06 177.31 2ju4 n THR 35 N -3.74 0.00 0.00 5.09 -2.24 -1.26 -5.05 114.28 107.08 2ju4 n THR 35 Ca -0.16 0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.63 2ju4 n THR 35 Cb 0.63 -0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.76 2ju4 n THR 35 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 2ju4 n ARG 36 N 0.00 0.00 0.01 -0.78 0.63 -1.26 -5.18 116.66 110.08 2ju4 n ARG 36 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 2ju4 n ARG 36 Cb 0.00 0.00 0.00 0.00 0.45 0.00 0.00 32.46 32.91 2ju4 n ARG 36 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 2ju4 n GLN 37 N -0.65 0.00 0.00 -0.14 10.64 -1.26 -4.29 117.38 121.68 2ju4 n GLN 37 Ca 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.17 2ju4 n GLN 37 Cb 0.00 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.38 2ju4 n GLN 37 CO 0.00 0.00 0.00 0.36 -1.83 0.00 0.00 177.06 175.59 2ju4 n LYS 39 N -2.23 0.00 0.00 2.61 0.00 -1.26 -4.50 118.16 112.78 2ju4 n LYS 39 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 2ju4 n LYS 39 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.03 2ju4 n LYS 39 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.40 177.83 2ju4 n SER 40 N 0.00 0.00 -4.75 -5.58 7.64 -1.26 -4.52 113.62 105.15 2ju4 n SER 40 Ca 0.00 0.60 -0.33 0.00 1.01 0.00 0.00 58.87 60.15 2ju4 n SER 40 Cb 0.00 -0.10 0.07 0.00 -1.01 0.00 0.00 64.21 63.17 2ju4 n SER 40 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2ju4 s LYS 41 N -1.41 2.46 1.01 1.43 1.02 -1.26 -5.00 119.74 118.00 2ju4 s LYS 41 Ca 0.00 1.51 -0.12 0.00 0.02 0.00 0.00 55.97 57.38 2ju4 s LYS 41 Cb 0.00 -1.90 0.19 0.00 -0.52 0.00 0.00 37.83 35.61 2ju4 s LYS 41 CO 0.00 -1.53 1.08 -2.14 -0.92 0.00 0.00 175.35 171.83 2ju4 s PRO 42 N -4.11 0.34 -0.06 -1.68 0.02 -1.26 -4.95 135.00 123.30 2ju4 s PRO 42 Ca 0.69 0.95 -0.30 0.00 0.02 0.00 0.00 61.00 62.36 2ju4 s PRO 42 Cb -0.23 -1.69 -0.04 0.00 0.02 0.00 0.00 34.50 32.56 2ju4 s PRO 42 CO 0.44 -2.91 1.34 -1.25 -0.33 0.00 0.00 177.00 174.30 2ju4 s PRO 43 N -4.71 4.28 0.23 5.54 0.04 -1.26 -4.86 135.00 134.26 2ju4 s PRO 43 Ca 0.66 1.83 0.00 0.00 0.04 0.00 0.00 61.00 63.53 2ju4 s PRO 43 Cb -0.21 -3.66 0.00 0.00 0.04 0.00 0.00 34.50 30.66 2ju4 s PRO 43 CO 0.60 -0.60 0.00 1.63 0.04 0.00 0.00 177.00 178.67 2ju4 n LYS 44 N 5.83 0.00 0.00 4.56 4.76 -1.26 -5.11 118.16 126.94 2ju4 n LYS 44 Ca 0.13 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.57 2ju4 n LYS 44 Cb 0.45 -0.16 0.00 0.00 -1.84 0.00 0.00 35.03 33.48 2ju4 n LYS 44 CO 0.00 0.00 0.00 0.36 -1.37 0.00 0.00 177.40 176.39 2ju4 n LYS 45 N -3.49 0.00 0.00 1.97 -0.00 -1.26 -4.98 118.16 110.40 2ju4 n LYS 45 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 2ju4 n LYS 45 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.03 2ju4 n LYS 45 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2ju4 n GLY 46 N -0.43 4.07 1.22 2.58 0.00 -1.26 -4.88 105.19 106.49 2ju4 n GLY 46 Ca 0.00 -1.11 0.00 0.00 0.00 0.00 0.00 46.02 44.91 2ju4 n GLY 46 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2ju4 n VAL 47 N -0.06 1.25 -0.19 1.61 0.31 -1.26 -4.44 118.33 115.55 2ju4 n VAL 47 Ca 0.00 -0.18 -0.05 0.00 -0.01 0.00 0.00 64.34 64.10 2ju4 n VAL 47 Cb 0.00 -1.15 0.01 0.00 -0.91 0.00 0.00 33.84 31.79 2ju4 n VAL 47 CO 0.00 0.00 0.00 -0.61 -1.32 0.00 0.00 176.83 174.90 2ju4 h GLN 48 N 0.67 -0.15 0.00 5.55 4.15 -2.04 -3.48 115.11 119.80 2ju4 h GLN 48 Ca 0.00 0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.43 2ju4 h GLN 48 Cb 0.89 0.04 0.00 0.00 0.21 0.00 0.00 27.48 28.61 2ju4 h GLN 48 CO 0.00 -0.10 -0.02 0.41 -1.93 0.00 0.00 178.83 177.19 2ju4 n GLY 49 N -1.43 0.22 0.00 2.39 0.00 -1.26 -5.28 105.19 99.83 2ju4 n GLY 49 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 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 0.89 3.15 -0.02 0.00 -1.26 -5.22 105.19 102.74 2ju4 n GLY 51 Ca 0.00 -1.90 0.06 0.00 0.00 0.00 0.00 46.02 44.18 2ju4 n GLY 51 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2ju4 s ASP 52 N -2.66 -0.11 0.09 1.61 1.01 -1.26 -4.96 116.67 110.39 2ju4 s ASP 52 Ca 0.00 0.05 -0.33 0.00 0.71 0.00 0.00 52.55 52.98 2ju4 s ASP 52 Cb 0.00 1.08 -0.16 0.00 1.01 0.00 0.00 42.92 44.86 2ju4 s ASP 52 CO 0.00 -0.02 1.60 0.44 0.21 0.00 0.00 175.17 177.40 2ju4 h ASP 53 N 7.73 -1.08 -0.61 0.27 5.19 -1.94 -3.39 116.42 122.58 2ju4 h ASP 53 Ca -0.10 0.08 -0.69 0.00 -0.62 0.00 0.00 57.03 55.70 2ju4 h ASP 53 Cb 1.18 0.34 -0.03 0.00 0.18 0.00 0.00 39.33 41.00 2ju4 h ASP 53 CO -0.21 -0.59 1.41 2.30 -3.12 0.00 0.00 179.24 179.04 2ju4 n ILE 54 N -5.52 0.09 -1.06 0.35 -6.64 -1.26 -4.76 119.36 100.57 2ju4 n ILE 54 Ca -0.12 -0.16 -0.18 0.00 -1.77 0.00 0.00 62.75 60.52 2ju4 n ILE 54 Cb 0.41 -1.16 -0.14 0.00 -1.44 0.00 0.00 39.64 37.32 2ju4 n ILE 54 CO 0.00 0.00 0.00 -0.81 -1.77 0.00 0.00 176.55 173.97 2ju4 n PRO 55 N 7.98 2.37 -1.89 6.28 -0.04 -1.26 -4.48 135.00 143.96 2ju4 n PRO 55 Ca 0.48 -1.27 -0.09 0.00 -0.04 0.00 0.00 63.50 62.59 2ju4 n PRO 55 Cb 0.12 -2.18 -0.01 0.00 -0.04 0.00 0.00 33.50 31.39 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 2.76 0.32 4.94 0.55 0.00 -1.26 -3.60 105.19 108.91 2ju4 n GLY 56 Ca 0.51 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.96 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 -2.10 0.00 -0.44 1.61 2.81 -1.26 -1.85 117.12 115.89 2ju4 n MET 57 Ca -0.10 0.00 -0.01 0.00 -1.81 0.00 0.00 57.70 55.79 2ju4 n MET 57 Cb 0.49 -0.15 -0.01 0.00 -0.71 0.00 0.00 33.22 32.84 2ju4 n MET 57 CO 0.00 0.00 0.00 -0.85 1.51 0.00 0.00 175.97 176.63 2ju4 n GLU 58 N 0.00 0.00 -1.59 0.03 0.28 -1.25 -5.16 120.64 112.95 2ju4 n GLU 58 Ca 0.00 -0.12 0.00 0.00 -0.16 0.00 0.00 57.16 56.88 2ju4 n GLU 58 Cb 0.00 0.36 0.00 0.00 1.43 0.00 0.00 31.44 33.23 2ju4 n GLU 58 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2ju4 n GLY 59 N 0.00 -4.45 0.00 -1.84 0.00 -0.77 -4.86 105.19 93.27 2ju4 n GLY 59 Ca -0.03 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.24 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 -1.52 3.44 0.51 -0.02 0.00 -1.26 -4.98 105.19 101.38 2ju4 n GLY 61 Ca 0.00 -0.74 0.41 0.00 0.00 0.00 0.00 46.02 45.69 2ju4 n GLY 61 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2ju4 h THR 62 N 0.00 0.08 0.00 2.61 1.35 -2.01 2.40 112.91 117.33 2ju4 h THR 62 Ca 0.00 -0.02 0.00 0.00 -0.55 0.00 0.00 66.41 65.84 2ju4 h THR 62 Cb 0.00 0.03 0.00 0.00 -1.73 0.00 0.00 68.15 66.45 2ju4 h THR 62 CO 0.00 0.01 0.00 -0.67 -0.25 0.00 0.00 175.52 174.61 2ju4 n ASP 63 N -4.56 0.06 0.09 5.36 2.03 -1.26 -2.44 116.55 115.83 2ju4 n ASP 63 Ca 0.39 -1.05 0.11 0.00 0.52 0.00 0.00 54.79 54.76 2ju4 n ASP 63 Cb 1.57 -0.03 -0.03 0.00 -0.72 0.00 0.00 41.12 41.91 2ju4 n ASP 63 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2ju4 n ILE 64 N -0.41 0.53 -2.04 5.18 3.06 0.81 -4.90 119.36 121.59 2ju4 n ILE 64 Ca 0.00 -0.54 -0.06 0.00 -2.50 0.00 0.00 62.75 59.65 2ju4 n ILE 64 Cb 0.02 -0.29 -0.01 0.00 0.54 0.00 0.00 39.64 39.90 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 -2.61 -0.18 0.00 9.51 -2.24 -1.02 0.55 114.28 118.28 2ju4 n THR 65 Ca -0.01 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.77 2ju4 n THR 65 Cb 0.56 -0.74 0.00 0.00 -2.10 0.00 0.00 70.33 68.05 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 -2.41 0.00 -4.14 2.28 0.31 -1.26 -5.15 118.33 107.97 2ju4 n VAL 66 Ca -0.07 0.00 -0.09 0.00 -0.01 0.00 0.00 64.34 64.17 2ju4 n VAL 66 Cb 0.43 0.00 -0.10 0.00 -0.91 0.00 0.00 33.84 33.26 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 0.40 0.14 2.52 -1.09 0.19 -4.92 121.20 118.43 2ju4 s ILE 67 Ca 0.00 -1.88 0.01 0.00 -2.23 0.00 0.00 60.65 56.55 2ju4 s ILE 67 Cb 0.00 -1.70 -0.18 0.00 -1.58 0.00 0.00 42.46 39.00 2ju4 s ILE 67 CO 0.00 -0.84 1.32 -0.65 -1.23 0.00 0.00 174.94 173.54 2ju4 h PRO 69 N 3.01 0.21 0.18 2.79 0.11 -1.93 -3.45 132.00 132.91 2ju4 h PRO 69 Ca -0.35 -0.26 -0.31 0.00 0.11 0.00 0.00 66.00 65.20 2ju4 h PRO 69 Cb 1.16 0.08 0.02 0.00 0.11 0.00 0.00 31.00 32.37 2ju4 h PRO 69 CO 0.64 1.02 -1.39 -1.49 -0.21 0.00 0.00 178.00 176.57 2ju4 h TRP 70 N 0.10 0.69 -0.78 0.65 6.55 -2.00 -3.30 115.95 117.87 2ju4 h TRP 70 Ca -0.06 -0.50 0.18 0.00 0.95 0.00 0.00 58.89 59.46 2ju4 h TRP 70 Cb 1.63 -0.03 -0.12 0.00 -0.86 0.00 0.00 29.16 29.78 2ju4 h TRP 70 CO 0.04 1.42 0.20 0.93 -1.05 0.00 0.00 178.44 179.97 2ju4 h GLU 71 N 0.10 0.26 0.00 0.49 4.39 -1.96 -3.42 114.58 114.43 2ju4 h GLU 71 Ca -0.20 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.48 2ju4 h GLU 71 Cb 2.06 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 30.65 2ju4 h GLU 71 CO 0.23 0.17 0.00 0.00 -1.16 0.00 0.00 179.01 178.25 2ju4 n ALA 72 N -2.67 0.00 0.00 3.43 0.00 -1.24 -5.12 120.51 114.90 2ju4 n ALA 72 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.60 2ju4 n ALA 72 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.96 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 0.00 0.00 0.00 0.00 4.05 -1.26 -5.05 115.26 113.00 2ju4 n ASN 74 Ca 0.00 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.03 2ju4 n ASN 74 Cb 0.00 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.01 2ju4 n ASN 74 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 177.26 175.62 2ju4 n HIS 75 N 0.00 0.00 0.00 1.20 8.25 -1.26 -4.62 115.22 118.79 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 -1.91 0.64 0.00 0.00 176.34 175.07 2ju4 n GLU 77 N -0.00 1.87 -1.06 -0.41 4.07 -1.26 -5.16 120.64 118.68 2ju4 n GLU 77 Ca 0.00 0.00 0.13 0.00 -0.06 0.00 0.00 57.16 57.23 2ju4 n GLU 77 Cb 0.00 0.00 -0.04 0.00 -0.06 0.00 0.00 31.44 31.34 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 0.00 -0.53 0.00 4.31 7.99 -1.26 -4.73 117.00 122.78 2ju4 n LEU 78 Ca 0.00 1.19 0.00 0.00 -0.01 0.00 0.00 56.01 57.19 2ju4 n LEU 78 Cb 0.00 -3.38 0.00 0.00 -0.11 0.00 0.00 43.42 39.93 2ju4 n LEU 78 CO 0.00 -2.43 0.00 1.57 -1.51 0.00 0.00 177.39 175.02 2ju4 n HIS 79 N -3.27 0.00 -0.06 -1.77 -0.00 -1.26 -4.73 115.22 104.13 2ju4 n HIS 79 Ca -0.01 0.00 -0.06 0.00 -0.00 0.00 0.00 57.72 57.66 2ju4 n HIS 79 Cb 0.62 0.00 -0.05 0.00 -0.00 0.00 0.00 29.99 30.56 2ju4 n HIS 79 CO 0.00 0.00 0.00 1.05 -0.00 0.00 0.00 176.34 177.39 2ju4 h GLU 80 N 0.00 0.00 -0.59 1.57 4.11 -2.03 -3.35 114.58 114.29 2ju4 h GLU 80 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2ju4 h GLU 80 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2ju4 h GLU 80 CO 0.00 0.38 0.00 1.47 0.07 0.00 0.00 179.01 180.93 2ju4 n LEU 81 N -4.71 5.62 0.08 3.06 -0.00 -1.26 -4.55 117.00 115.24 2ju4 n LEU 81 Ca -0.04 -2.87 -0.13 0.00 -0.00 0.00 0.00 56.01 52.97 2ju4 n LEU 81 Cb 0.19 -0.67 -0.08 0.00 -0.00 0.00 0.00 43.42 42.86 2ju4 n LEU 81 CO 0.13 0.66 0.73 0.00 -0.00 0.00 0.00 177.39 178.91 2ju4 h ALA 82 N 4.03 -0.17 0.00 1.47 0.00 -1.85 -3.15 119.26 119.59 2ju4 h ALA 82 Ca 0.00 -0.11 -0.37 0.00 0.00 0.00 0.00 54.91 54.42 2ju4 h ALA 82 Cb 1.91 0.07 -0.06 0.00 0.00 0.00 0.00 17.79 19.70 2ju4 h ALA 82 CO 0.46 -0.51 1.27 1.04 0.00 0.00 0.00 179.25 181.51 2ju4 n GLN 83 N -5.08 0.00 0.00 0.00 1.13 -1.26 -0.96 117.38 111.20 2ju4 n GLN 83 Ca -0.09 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 54.97 2ju4 n GLN 83 Cb 0.16 -1.10 0.00 0.00 0.11 0.00 0.00 30.24 29.41 2ju4 n GLN 83 CO 0.00 0.00 0.00 0.66 -1.44 0.00 0.00 177.06 176.28 2ju4 n TYR 84 N 7.57 0.00 -0.76 1.08 4.01 -1.26 -4.31 117.16 123.49 2ju4 n TYR 84 Ca 0.48 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 58.22 2ju4 n TYR 84 Cb 0.02 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.05 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 0.00 -1.47 0.00 2.72 0.00 -0.14 -4.84 105.19 101.46 2ju4 n GLY 85 Ca 0.00 -0.54 0.00 0.00 0.00 0.00 0.00 46.02 45.48 2ju4 n GLY 85 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83