#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 -3.20 7.83 6.94 -1.26 -5.06 115.26 120.51 2ju4 n ASN 2 Ca 0.00 0.00 0.01 0.00 -0.02 0.00 0.00 54.58 54.57 2ju4 n ASN 2 Cb 0.00 0.00 -0.01 0.00 -2.36 0.00 0.00 39.78 37.41 2ju4 n ASN 2 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 2ju4 s LEU 3 N -0.72 -1.55 -0.32 -4.53 1.98 -1.26 -5.12 118.68 107.17 2ju4 s LEU 3 Ca 0.00 -0.67 -0.22 0.00 -2.89 0.00 0.00 54.13 50.35 2ju4 s LEU 3 Cb 0.00 1.97 -0.00 0.00 0.66 0.00 0.00 46.19 48.82 2ju4 s LEU 3 CO 0.00 -0.18 0.72 -0.70 -1.89 0.00 0.00 176.35 174.30 2ju4 s GLU 4 N 1.96 3.90 0.80 1.98 2.12 -1.26 -5.02 118.70 123.18 2ju4 s GLU 4 Ca 0.15 0.42 -0.17 0.00 0.36 0.00 0.00 54.97 55.73 2ju4 s GLU 4 Cb -0.05 -3.74 -0.10 0.00 0.26 0.00 0.00 34.13 30.50 2ju4 s GLU 4 CO -0.09 -0.66 -0.19 -2.30 -0.54 0.00 0.00 175.26 171.48 2ju4 n PRO 5 N 6.10 0.03 -1.09 4.30 -0.02 -1.26 -4.93 135.00 138.14 2ju4 n PRO 5 Ca 0.02 0.03 -0.30 0.00 -2.02 0.00 0.00 63.50 61.22 2ju4 n PRO 5 Cb 0.48 -1.29 0.14 0.00 -0.02 0.00 0.00 33.50 32.82 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 -2.09 1.34 0.00 0.52 0.04 -1.26 -4.83 135.00 128.72 2ju4 s PRO 6 Ca 0.52 1.04 -0.00 0.00 0.04 0.00 0.00 61.00 62.60 2ju4 s PRO 6 Cb -0.31 -1.80 -0.02 0.00 0.04 0.00 0.00 34.50 32.42 2ju4 s PRO 6 CO 0.71 -2.24 1.25 0.36 0.04 0.00 0.00 177.00 177.12 2ju4 n LYS 7 N -3.91 0.63 0.00 4.56 2.85 -1.26 -4.91 118.16 116.11 2ju4 n LYS 7 Ca 0.08 -0.06 0.00 0.00 -1.05 0.00 0.00 58.31 57.28 2ju4 n LYS 7 Cb 0.54 -1.28 0.00 0.00 -0.65 0.00 0.00 35.03 33.64 2ju4 n LYS 7 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2ju4 n ALA 8 N 1.82 0.00 -3.58 0.58 0.00 -1.26 -5.18 120.51 112.89 2ju4 n ALA 8 Ca 0.03 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.32 2ju4 n ALA 8 Cb 0.31 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.69 2ju4 n ALA 8 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 2ju4 s GLU 9 N 0.00 0.85 0.00 0.00 2.12 -1.26 -5.27 118.70 115.14 2ju4 s GLU 9 Ca 0.00 0.57 0.00 0.00 0.36 0.00 0.00 54.97 55.90 2ju4 s GLU 9 Cb 0.00 0.41 0.00 0.00 0.26 0.00 0.00 34.13 34.80 2ju4 s GLU 9 CO 0.00 -0.19 0.00 0.54 -0.54 0.00 0.00 175.26 175.07 2ju4 n ARG 11 N 1.74 0.00 -0.02 4.30 5.12 -1.26 -5.08 116.66 121.46 2ju4 n ARG 11 Ca -0.15 0.00 -0.05 0.00 -1.93 0.00 0.00 57.85 55.72 2ju4 n ARG 11 Cb 0.56 0.00 -0.02 0.00 -1.16 0.00 0.00 32.46 31.85 2ju4 n ARG 11 CO 0.00 0.00 0.00 -1.13 -1.93 0.00 0.00 177.63 174.57 2ju4 n SER 12 N 0.00 0.47 0.00 0.55 3.41 -1.26 -4.99 113.62 111.81 2ju4 n SER 12 Ca 0.00 0.08 0.00 0.00 -0.26 0.00 0.00 58.87 58.69 2ju4 n SER 12 Cb 0.00 -0.18 0.00 0.00 -0.26 0.00 0.00 64.21 63.77 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 -3.28 0.00 -3.30 7.33 0.00 -1.26 -2.48 120.51 117.52 2ju4 n ALA 13 Ca -0.08 0.00 -0.25 0.00 0.00 0.00 0.00 53.44 53.10 2ju4 n ALA 13 Cb 0.49 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.87 2ju4 n ALA 13 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2ju4 n THR 14 N 0.00 -0.01 -1.39 0.00 -1.04 -1.26 -4.79 114.28 105.79 2ju4 n THR 14 Ca 0.00 -4.23 0.00 0.00 -2.04 0.00 0.00 64.05 57.78 2ju4 n THR 14 Cb 0.00 -1.96 0.00 0.00 -1.82 0.00 0.00 70.33 66.55 2ju4 n THR 14 CO 0.00 0.00 0.00 -1.14 -0.64 0.00 0.00 175.07 173.29 2ju4 n ARG 15 N 1.51 0.00 -1.95 -2.82 0.63 -1.04 -5.06 116.66 107.93 2ju4 n ARG 15 Ca 0.24 0.00 -0.28 0.00 -0.92 0.00 0.00 57.85 56.89 2ju4 n ARG 15 Cb 0.49 0.00 -0.05 0.00 0.45 0.00 0.00 32.46 33.35 2ju4 n ARG 15 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 2ju4 s VAL 16 N 0.00 3.34 -0.38 5.15 0.11 -1.26 -4.63 120.40 122.74 2ju4 s VAL 16 Ca 0.00 -0.18 -0.01 0.00 -2.93 0.00 0.00 61.98 58.87 2ju4 s VAL 16 Cb 0.00 -3.80 0.26 0.00 -1.53 0.00 0.00 36.38 31.31 2ju4 s VAL 16 CO 0.00 -0.76 1.12 0.80 -3.33 0.00 0.00 175.10 172.93 2ju4 n MET 17 N 8.93 0.29 0.00 1.54 0.00 -1.26 -5.10 117.12 121.52 2ju4 n MET 17 Ca 0.37 -1.00 0.00 0.00 0.00 0.00 0.00 57.70 57.07 2ju4 n MET 17 Cb 0.48 -0.53 0.00 0.00 0.00 0.00 0.00 33.22 33.17 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 1.72 1.52 4.56 -5.12 0.00 -1.26 -4.92 105.19 101.68 2ju4 n GLY 18 Ca 0.05 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.26 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 0.42 0.00 -0.02 0.00 -1.26 -4.47 105.19 99.85 2ju4 n GLY 19 Ca 0.00 0.49 0.00 0.00 0.00 0.00 0.00 46.02 46.51 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 0.00 0.00 -3.71 1.61 -0.02 -1.26 -5.04 135.00 126.57 2ju4 n PRO 20 Ca 0.00 0.00 -0.17 0.00 -2.02 0.00 0.00 63.50 61.31 2ju4 n PRO 20 Cb 0.00 -1.24 -0.17 0.00 -0.02 0.00 0.00 33.50 32.08 2ju4 n PRO 20 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 2ju4 s THR 22 N -0.83 -0.10 0.00 3.45 -1.32 -1.26 -5.21 115.64 110.37 2ju4 s THR 22 Ca 0.00 0.33 0.00 0.00 -1.21 0.00 0.00 61.69 60.81 2ju4 s THR 22 Cb 0.00 -0.14 0.00 0.00 -1.51 0.00 0.00 72.50 70.85 2ju4 s THR 22 CO 0.00 0.14 0.00 -2.65 -2.21 0.00 0.00 174.62 169.90 2ju4 n PRO 23 N 4.82 0.00 -3.53 7.08 -0.02 -1.26 -4.79 135.00 137.30 2ju4 n PRO 23 Ca -0.14 0.00 -0.21 0.00 -2.02 0.00 0.00 63.50 61.13 2ju4 n PRO 23 Cb 0.50 0.00 0.02 0.00 -0.02 0.00 0.00 33.50 34.01 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 0.00 -1.36 -1.65 -0.52 5.12 -1.26 -4.79 116.66 112.20 2ju4 n ARG 24 Ca 0.00 0.81 -0.46 0.00 -1.93 0.00 0.00 57.85 56.27 2ju4 n ARG 24 Cb 0.00 -4.21 -0.03 0.00 -1.16 0.00 0.00 32.46 27.06 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 -3.18 1.83 0.00 5.56 4.01 -1.26 -4.39 118.16 120.73 2ju4 n LYS 25 Ca -0.12 0.65 0.00 0.00 -0.51 0.00 0.00 58.31 58.33 2ju4 n LYS 25 Cb 0.59 -2.27 0.00 0.00 -0.51 0.00 0.00 35.03 32.84 2ju4 n LYS 25 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2ju4 n GLY 26 N 2.12 -0.44 3.69 0.72 0.00 -1.26 -5.12 105.19 104.89 2ju4 n GLY 26 Ca 0.12 0.33 -0.55 0.00 0.00 0.00 0.00 46.02 45.92 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 1.38 -1.55 1.61 -0.02 -1.26 -4.82 135.00 130.33 2ju4 n PRO 27 Ca 0.00 0.50 -0.56 0.00 -2.02 0.00 0.00 63.50 61.43 2ju4 n PRO 27 Cb 0.00 -2.21 -0.07 0.00 -0.02 0.00 0.00 33.50 31.20 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 5.15 0.59 -0.97 0.52 -0.02 -1.26 -5.05 135.00 133.96 2ju4 n PRO 28 Ca 0.24 0.21 -0.03 0.00 -2.02 0.00 0.00 63.50 61.90 2ju4 n PRO 28 Cb 0.17 -1.79 -0.02 0.00 -0.02 0.00 0.00 33.50 31.85 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 2.14 0.11 -0.33 -0.52 4.81 -1.26 -5.05 118.16 118.06 2ju4 n LYS 29 Ca 0.20 -0.54 0.00 0.00 -0.87 0.00 0.00 58.31 57.10 2ju4 n LYS 29 Cb 0.13 0.46 0.00 0.00 0.02 0.00 0.00 35.03 35.64 2ju4 n LYS 29 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 2ju4 n LYS 31 N -0.13 -0.10 0.00 1.64 0.00 -1.26 -4.68 118.16 113.63 2ju4 n LYS 31 Ca -0.14 -0.04 0.00 0.00 0.00 0.00 0.00 58.31 58.13 2ju4 n LYS 31 Cb 0.52 0.07 0.00 0.00 0.00 0.00 0.00 35.03 35.62 2ju4 n LYS 31 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.40 178.34 2ju4 n GLN 32 N -0.09 0.00 0.00 1.64 7.27 -1.26 -5.13 117.38 119.81 2ju4 n GLN 32 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.07 2ju4 n GLN 32 Cb 0.00 0.00 0.00 0.00 2.41 0.00 0.00 30.24 32.65 2ju4 n GLN 32 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 177.06 177.67 2ju4 n ARG 33 N 0.00 3.06 -2.01 3.69 5.12 -1.26 -5.03 116.66 120.22 2ju4 n ARG 33 Ca 0.00 0.00 -0.01 0.00 -1.93 0.00 0.00 57.85 55.91 2ju4 n ARG 33 Cb 0.00 0.00 0.05 0.00 -1.16 0.00 0.00 32.46 31.35 2ju4 n ARG 33 CO 0.00 0.00 0.00 0.94 -1.93 0.00 0.00 177.63 176.64 2ju4 n GLN 34 N 0.00 0.51 0.00 5.56 0.00 -1.26 -5.09 117.38 117.09 2ju4 n GLN 34 Ca 0.00 -0.51 0.00 0.00 -0.00 0.00 0.00 57.00 56.49 2ju4 n GLN 34 Cb 0.00 0.14 0.00 0.00 0.00 0.00 0.00 30.24 30.38 2ju4 n GLN 34 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.06 174.69 2ju4 n THR 35 N -0.58 0.00 -2.01 1.69 5.66 -1.26 -4.85 114.28 112.93 2ju4 n THR 35 Ca -0.08 0.06 -0.05 0.00 -3.05 0.00 0.00 64.05 60.93 2ju4 n THR 35 Cb 0.65 -0.75 -0.03 0.00 -1.55 0.00 0.00 70.33 68.65 2ju4 n THR 35 CO 0.00 0.00 0.00 -1.14 -3.05 0.00 0.00 175.07 170.88 2ju4 n ARG 36 N 0.00 0.18 0.00 1.09 3.00 -1.26 -5.18 116.66 114.49 2ju4 n ARG 36 Ca 0.00 -0.80 0.00 0.00 -0.00 0.00 0.00 57.85 57.05 2ju4 n ARG 36 Cb 0.00 0.47 0.00 0.00 0.00 0.00 0.00 32.46 32.93 2ju4 n ARG 36 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.63 178.67 2ju4 n GLN 37 N -0.20 0.00 0.00 -0.14 6.02 -1.26 -4.95 117.38 116.84 2ju4 n GLN 37 Ca -0.20 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.79 2ju4 n GLN 37 Cb 0.63 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.89 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 -1.57 -1.09 4.01 -1.26 -4.88 118.16 113.37 2ju4 n LYS 39 Ca 0.00 0.00 -0.51 0.00 -0.51 0.00 0.00 58.31 57.29 2ju4 n LYS 39 Cb 0.00 0.00 -0.05 0.00 -0.51 0.00 0.00 35.03 34.47 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 1.22 -4.65 4.39 7.64 -1.26 -4.83 113.62 116.13 2ju4 n SER 40 Ca 0.00 1.14 -0.40 0.00 1.01 0.00 0.00 58.87 60.62 2ju4 n SER 40 Cb 0.00 -1.17 0.03 0.00 -1.01 0.00 0.00 64.21 62.06 2ju4 n SER 40 CO 0.00 0.00 0.00 2.29 -3.01 0.00 0.00 175.04 174.32 2ju4 n LYS 41 N 1.93 1.39 -1.40 1.43 2.85 -1.26 -4.95 118.16 118.15 2ju4 n LYS 41 Ca 0.17 0.51 -0.31 0.00 -1.05 0.00 0.00 58.31 57.63 2ju4 n LYS 41 Cb 0.22 -2.24 0.08 0.00 -0.65 0.00 0.00 35.03 32.43 2ju4 n LYS 41 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 177.40 176.10 2ju4 s PRO 42 N -2.44 2.38 0.86 -1.58 0.04 -1.26 -5.04 135.00 127.96 2ju4 s PRO 42 Ca 0.68 0.99 -0.11 0.00 0.04 0.00 0.00 61.00 62.60 2ju4 s PRO 42 Cb -0.48 -1.92 0.11 0.00 0.04 0.00 0.00 34.50 32.25 2ju4 s PRO 42 CO 0.53 -1.51 1.09 -1.25 0.04 0.00 0.00 177.00 175.91 2ju4 s PRO 43 N -4.99 1.56 0.40 0.56 0.04 -1.26 -4.94 135.00 126.37 2ju4 s PRO 43 Ca 0.60 0.76 0.18 0.00 0.04 0.00 0.00 61.00 62.58 2ju4 s PRO 43 Cb -0.16 -1.85 0.84 0.00 0.04 0.00 0.00 34.50 33.37 2ju4 s PRO 43 CO 0.56 -2.01 1.83 1.57 0.04 0.00 0.00 177.00 178.98 2ju4 h LYS 44 N -1.38 0.00 0.00 4.56 -0.00 -1.98 -3.39 116.57 114.38 2ju4 h LYS 44 Ca -0.48 0.00 -0.06 0.00 -0.00 0.00 0.00 60.65 60.11 2ju4 h LYS 44 Cb 1.28 0.00 -0.05 0.00 -0.00 0.00 0.00 32.23 33.45 2ju4 h LYS 44 CO 0.56 0.33 -0.11 0.36 -0.00 0.00 0.00 179.45 180.59 2ju4 n LYS 45 N -3.77 0.18 0.05 0.07 2.85 -1.26 -4.96 118.16 111.32 2ju4 n LYS 45 Ca -0.01 -0.42 0.12 0.00 -1.05 0.00 0.00 58.31 56.95 2ju4 n LYS 45 Cb 0.42 0.39 0.19 0.00 -0.65 0.00 0.00 35.03 35.38 2ju4 n LYS 45 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2ju4 n GLY 46 N -0.20 -1.40 0.00 2.58 0.00 -1.26 -4.73 105.19 100.18 2ju4 n GLY 46 Ca -0.10 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.66 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 -2.02 0.00 -3.23 1.61 0.31 -1.26 -4.83 118.33 108.90 2ju4 n VAL 47 Ca 0.04 0.00 -0.16 0.00 -0.01 0.00 0.00 64.34 64.21 2ju4 n VAL 47 Cb 0.42 -0.20 0.01 0.00 -0.91 0.00 0.00 33.84 33.16 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 0.00 -1.83 0.02 5.55 6.02 -1.26 -5.02 117.38 120.86 2ju4 n GLN 48 Ca 0.00 1.54 0.00 0.00 -0.01 0.00 0.00 57.00 58.53 2ju4 n GLN 48 Cb 0.00 -4.26 0.00 0.00 1.02 0.00 0.00 30.24 27.00 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 -0.94 -1.88 0.00 1.08 0.00 -1.26 -5.14 105.19 97.05 2ju4 n GLY 49 Ca -0.04 0.61 0.00 0.00 0.00 0.00 0.00 46.02 46.59 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 -1.37 -1.36 2.30 -0.02 0.00 -1.26 -5.21 105.19 98.27 2ju4 n GLY 51 Ca 0.00 0.48 -0.02 0.00 0.00 0.00 0.00 46.02 46.49 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 -0.22 -2.70 1.61 8.00 -1.26 -4.94 116.55 117.04 2ju4 n ASP 52 Ca 0.00 -2.10 -0.07 0.00 0.71 0.00 0.00 54.79 53.33 2ju4 n ASP 52 Cb 0.00 0.17 0.10 0.00 -0.02 0.00 0.00 41.12 41.37 2ju4 n ASP 52 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2ju4 n ASP 53 N -0.78 -1.36 -4.38 -2.24 9.92 -1.26 -5.09 116.55 111.36 2ju4 n ASP 53 Ca -0.10 -2.54 -0.53 0.00 -0.53 0.00 0.00 54.79 51.09 2ju4 n ASP 53 Cb 0.86 0.78 -0.09 0.00 -0.64 0.00 0.00 41.12 42.03 2ju4 n ASP 53 CO 0.00 0.00 0.00 2.30 0.13 0.00 0.00 177.20 179.63 2ju4 n ILE 54 N -0.48 0.09 0.10 0.53 -5.35 -1.26 -4.80 119.36 108.20 2ju4 n ILE 54 Ca -0.01 -0.16 -0.20 0.00 -0.27 0.00 0.00 62.75 62.11 2ju4 n ILE 54 Cb 0.84 -1.17 -0.15 0.00 -1.74 0.00 0.00 39.64 37.42 2ju4 n ILE 54 CO 0.00 0.00 0.00 1.55 -1.76 0.00 0.00 176.55 176.34 2ju4 h PRO 55 N 11.39 0.37 -0.16 6.28 0.13 -2.05 -3.42 132.00 144.54 2ju4 h PRO 55 Ca -0.19 -0.63 -0.24 0.00 -0.87 0.00 0.00 66.00 64.08 2ju4 h PRO 55 Cb 1.35 0.23 -0.19 0.00 0.13 0.00 0.00 31.00 32.53 2ju4 h PRO 55 CO 1.08 1.27 -0.49 0.41 -0.23 0.00 0.00 178.00 180.05 2ju4 n GLY 56 N 1.67 1.38 7.00 1.56 0.00 -1.26 -5.12 105.19 110.42 2ju4 n GLY 56 Ca -0.15 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.56 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 -0.54 0.00 -3.39 1.61 2.81 -1.26 -4.75 117.12 111.60 2ju4 n MET 57 Ca -0.01 0.00 0.03 0.00 -1.81 0.00 0.00 57.70 55.91 2ju4 n MET 57 Cb 0.85 0.00 -0.05 0.00 -0.71 0.00 0.00 33.22 33.31 2ju4 n MET 57 CO 0.00 0.00 0.00 -2.00 1.51 0.00 0.00 175.97 175.48 2ju4 s GLU 58 N 0.00 0.01 0.00 0.03 2.12 -1.26 -5.06 118.70 114.54 2ju4 s GLU 58 Ca 0.00 0.02 0.00 0.00 0.36 0.00 0.00 54.97 55.35 2ju4 s GLU 58 Cb 0.00 0.01 0.00 0.00 0.26 0.00 0.00 34.13 34.40 2ju4 s GLU 58 CO 0.00 -0.00 0.00 0.41 -0.54 0.00 0.00 175.26 175.13 2ju4 n GLY 59 N 3.80 -1.39 0.00 -1.50 0.00 -1.26 -4.75 105.19 100.09 2ju4 n GLY 59 Ca -0.11 -1.11 0.00 0.00 0.00 0.00 0.00 46.02 44.80 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 -0.03 -1.45 0.84 -0.02 0.00 -1.26 -5.00 105.19 98.26 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 -0.38 0.00 -0.30 2.61 -2.24 -1.26 -4.91 114.28 107.80 2ju4 n THR 62 Ca 0.00 -0.28 -0.01 0.00 -2.27 0.00 0.00 64.05 61.49 2ju4 n THR 62 Cb 0.00 0.55 -0.02 0.00 -2.10 0.00 0.00 70.33 68.77 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 0.14 2.73 -2.79 3.42 9.92 -1.26 -4.66 116.55 124.05 2ju4 n ASP 63 Ca -0.01 -1.77 -0.04 0.00 -0.53 0.00 0.00 54.79 52.43 2ju4 n ASP 63 Cb 0.79 -0.60 0.01 0.00 -0.64 0.00 0.00 41.12 40.67 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 1.92-11.60 0.00 0.53 2.08 -1.26 -4.89 119.36 106.14 2ju4 n ILE 64 Ca 0.04 1.38 0.00 0.00 0.56 0.00 0.00 62.75 64.73 2ju4 n ILE 64 Cb 0.29 -7.13 0.00 0.00 -0.75 0.00 0.00 39.64 32.06 2ju4 n ILE 64 CO 0.00 0.00 0.00 0.41 0.56 0.00 0.00 176.55 177.52 2ju4 n THR 65 N 0.20 0.00 0.00 1.39 -1.04 -1.26 -4.37 114.28 109.20 2ju4 n THR 65 Ca 0.06 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.07 2ju4 n THR 65 Cb 0.23 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.74 2ju4 n THR 65 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 2ju4 n VAL 66 N 0.00 0.00 -4.35 12.58 0.31 -1.26 -4.97 118.33 120.63 2ju4 n VAL 66 Ca 0.00 0.00 -0.20 0.00 -0.01 0.00 0.00 64.34 64.13 2ju4 n VAL 66 Cb 0.00 0.00 -0.09 0.00 -0.91 0.00 0.00 33.84 32.84 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 0.29 -1.42 2.52 1.01 -1.26 -4.88 121.20 117.46 2ju4 s ILE 67 Ca 0.00 -2.00 0.22 0.00 0.00 0.00 0.00 60.65 58.87 2ju4 s ILE 67 Cb 0.00 -2.48 -0.14 0.00 0.01 0.00 0.00 42.46 39.85 2ju4 s ILE 67 CO 0.00 0.00 0.97 -0.81 0.00 0.00 0.00 174.94 175.10 2ju4 n PRO 69 N -0.64 0.52 0.05 2.79 -0.04 -1.26 -4.90 135.00 131.52 2ju4 n PRO 69 Ca 0.01 -0.41 0.13 0.00 -0.04 0.00 0.00 63.50 63.20 2ju4 n PRO 69 Cb 0.64 -1.49 0.51 0.00 -0.04 0.00 0.00 33.50 33.12 2ju4 n PRO 69 CO 0.00 0.00 0.00 1.87 -0.04 0.00 0.00 175.50 177.33 2ju4 n TRP 70 N -0.89 0.48 0.03 0.54 -0.00 -1.26 -3.14 117.44 113.20 2ju4 n TRP 70 Ca 0.06 0.14 0.01 0.00 -0.00 0.00 0.00 57.50 57.71 2ju4 n TRP 70 Cb 0.39 -0.73 -0.08 0.00 -0.00 0.00 0.00 31.31 30.89 2ju4 n TRP 70 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 177.69 178.08 2ju4 n GLU 71 N -1.89 0.62 -0.01 5.87 -0.58 -1.26 -4.67 120.64 118.73 2ju4 n GLU 71 Ca 0.06 0.19 0.00 0.00 -0.42 0.00 0.00 57.16 56.99 2ju4 n GLU 71 Cb 0.38 -1.79 0.00 0.00 -0.57 0.00 0.00 31.44 29.46 2ju4 n GLU 71 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2ju4 n ALA 72 N -2.38 0.98 -1.32 0.62 0.00 -1.19 -4.49 120.51 112.73 2ju4 n ALA 72 Ca -0.09 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 52.98 2ju4 n ALA 72 Cb 0.82 -2.33 0.06 0.00 0.00 0.00 0.00 19.45 17.99 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 4.03 -1.35 0.13 0.00 5.03 -1.26 -5.17 115.26 116.67 2ju4 n ASN 74 Ca 0.00 0.63 -0.10 0.00 0.87 0.00 0.00 54.58 55.98 2ju4 n ASN 74 Cb 0.00 -1.18 -0.06 0.00 -1.02 0.00 0.00 39.78 37.52 2ju4 n ASN 74 CO 0.00 0.00 0.00 0.45 -1.83 0.00 0.00 177.26 175.88 2ju4 h HIS 75 N -0.18 -0.38 0.00 3.10 3.86 -2.01 -3.53 115.15 116.01 2ju4 h HIS 75 Ca -0.45 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 58.75 2ju4 h HIS 75 Cb 1.37 0.12 0.00 0.00 1.06 0.00 0.00 27.41 29.96 2ju4 h HIS 75 CO 0.33 -0.06 0.00 -1.91 0.86 0.00 0.00 177.93 177.15 2ju4 n GLU 77 N -5.06 -0.93 0.00 2.45 4.07 -1.26 -4.96 120.64 114.96 2ju4 n GLU 77 Ca -0.08 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.02 2ju4 n GLU 77 Cb 0.25 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.63 2ju4 n GLU 77 CO 0.00 0.00 0.00 1.47 -0.06 0.00 0.00 177.13 178.54 2ju4 n LEU 78 N 0.00 0.00 -0.06 4.31 -0.00 -1.26 -4.78 117.00 115.20 2ju4 n LEU 78 Ca 0.00 -0.22 -0.09 0.00 -0.00 0.00 0.00 56.01 55.71 2ju4 n LEU 78 Cb 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 43.42 43.36 2ju4 n LEU 78 CO 0.00 0.26 -0.92 1.57 -0.00 0.00 0.00 177.39 178.31 2ju4 n HIS 79 N 0.00 0.00 -0.12 1.47 -0.00 -1.26 -4.38 115.22 110.93 2ju4 n HIS 79 Ca 0.00 0.00 -0.23 0.00 0.46 0.00 0.00 57.72 57.95 2ju4 n HIS 79 Cb 0.42 -0.51 -0.08 0.00 -0.12 0.00 0.00 29.99 29.71 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 -2.81 0.57 -0.11 1.57 4.71 -1.26 -4.33 120.64 118.98 2ju4 n GLU 80 Ca -0.22 0.29 -0.01 0.00 -0.01 0.00 0.00 57.16 57.21 2ju4 n GLU 80 Cb 0.76 -1.51 0.03 0.00 -1.01 0.00 0.00 31.44 29.71 2ju4 n GLU 80 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 2ju4 n LEU 81 N -4.34 2.48 -3.69 -4.62 4.77 -1.26 -4.73 117.00 105.61 2ju4 n LEU 81 Ca -0.40 -1.25 -0.41 0.00 -0.03 0.00 0.00 56.01 53.92 2ju4 n LEU 81 Cb 0.74 -0.53 -0.10 0.00 -2.33 0.00 0.00 43.42 41.21 2ju4 n LEU 81 CO 0.10 0.43 1.61 0.00 -1.33 0.00 0.00 177.39 178.20 2ju4 n ALA 82 N 0.21 1.48 -0.92 -1.18 0.00 -1.26 -4.75 120.51 114.08 2ju4 n ALA 82 Ca 0.04 -2.83 0.00 0.00 0.00 0.00 0.00 53.44 50.66 2ju4 n ALA 82 Cb 0.49 -3.67 0.00 0.00 0.00 0.00 0.00 19.45 16.27 2ju4 n ALA 82 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 2ju4 n GLN 83 N 7.76 0.00 -0.05 0.00 -0.06 -1.26 -3.98 117.38 119.79 2ju4 n GLN 83 Ca 0.47 0.43 -0.22 0.00 -2.00 0.00 0.00 57.00 55.68 2ju4 n GLN 83 Cb 0.42 -1.04 -0.13 0.00 -4.06 0.00 0.00 30.24 25.44 2ju4 n GLN 83 CO 0.00 0.00 0.00 0.66 -0.20 0.00 0.00 177.06 177.52 2ju4 n TYR 84 N -1.04 0.99 0.00 3.69 4.01 -1.26 -4.97 117.16 118.58 2ju4 n TYR 84 Ca 0.00 0.28 0.00 0.00 -0.16 0.00 0.00 57.90 58.02 2ju4 n TYR 84 Cb 0.00 -1.12 0.00 0.00 -0.31 0.00 0.00 39.34 37.91 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 1.80 2.67 0.20 2.72 0.00 -1.26 -5.25 105.19 106.08 2ju4 n GLY 85 Ca -0.35 0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.78 2ju4 n GLY 85 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61