#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ju4 s ASN 2 N 0.00 -1.41 -0.39 6.12 4.22 -1.26 -5.03 114.94 117.19 2ju4 s ASN 2 Ca 0.00 0.84 0.06 0.00 -2.14 0.00 0.00 52.86 51.62 2ju4 s ASN 2 Cb 0.00 -1.17 0.17 0.00 1.28 0.00 0.00 41.25 41.53 2ju4 s ASN 2 CO 0.00 -5.58 0.52 -0.22 -2.04 0.00 0.00 177.10 169.78 2ju4 s LEU 3 N -7.99 -0.88 0.06 3.54 1.98 -1.26 -5.14 118.68 108.99 2ju4 s LEU 3 Ca 0.68 -1.11 -0.04 0.00 -2.89 0.00 0.00 54.13 50.78 2ju4 s LEU 3 Cb -0.13 1.34 -0.05 0.00 0.66 0.00 0.00 46.19 48.02 2ju4 s LEU 3 CO 0.58 -0.21 0.27 -1.61 -1.89 0.00 0.00 176.35 173.48 2ju4 s GLU 4 N 1.69 3.53 -0.28 1.98 0.41 -1.26 -5.04 118.70 119.74 2ju4 s GLU 4 Ca 0.16 -0.22 -0.29 0.00 -0.41 0.00 0.00 54.97 54.22 2ju4 s GLU 4 Cb -0.09 -3.00 -0.02 0.00 -1.78 0.00 0.00 34.13 29.24 2ju4 s GLU 4 CO -0.06 0.59 1.60 -1.25 -0.49 0.00 0.00 175.26 175.64 2ju4 s PRO 5 N -2.27 3.67 0.64 0.39 0.04 -1.26 -5.01 135.00 131.21 2ju4 s PRO 5 Ca 0.34 1.47 -0.09 0.00 0.04 0.00 0.00 61.00 62.75 2ju4 s PRO 5 Cb -0.13 -4.05 0.00 0.00 0.04 0.00 0.00 34.50 30.36 2ju4 s PRO 5 CO 0.23 -1.44 1.01 -1.25 0.04 0.00 0.00 177.00 175.58 2ju4 s PRO 6 N 4.88 3.04 0.95 0.56 0.04 -1.26 -5.04 135.00 138.17 2ju4 s PRO 6 Ca 0.70 0.36 -0.11 0.00 0.04 0.00 0.00 61.00 61.99 2ju4 s PRO 6 Cb -0.22 -2.13 0.17 0.00 0.04 0.00 0.00 34.50 32.36 2ju4 s PRO 6 CO 0.30 -0.80 1.11 -1.59 0.04 0.00 0.00 177.00 176.06 2ju4 s LYS 7 N -5.18 0.74 0.06 4.56 -2.85 -1.26 -4.95 119.74 110.86 2ju4 s LYS 7 Ca 0.56 1.29 0.00 0.00 -1.00 0.00 0.00 55.97 56.82 2ju4 s LYS 7 Cb -0.11 -1.71 0.00 0.00 -2.06 0.00 0.00 37.83 33.95 2ju4 s LYS 7 CO 0.50 -2.73 0.00 0.00 0.10 0.00 0.00 175.35 173.21 2ju4 n ALA 8 N -4.28 1.37 -0.59 0.59 0.00 -1.26 -5.24 120.51 111.10 2ju4 n ALA 8 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.53 2ju4 n ALA 8 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 2ju4 n ALA 8 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2ju4 n GLU 9 N -2.65 -0.16 0.00 0.00 -0.00 -1.26 -5.19 120.64 111.38 2ju4 n GLU 9 Ca 0.00 0.17 0.00 0.00 -0.00 0.00 0.00 57.16 57.33 2ju4 n GLU 9 Cb 0.00 -0.13 0.00 0.00 -0.00 0.00 0.00 31.44 31.31 2ju4 n GLU 9 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.13 175.00 2ju4 n ARG 11 N 1.07 0.00 -0.37 3.44 3.00 -1.26 -5.28 116.66 117.26 2ju4 n ARG 11 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 2ju4 n ARG 11 Cb 0.02 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.48 2ju4 n ARG 11 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 2ju4 n SER 12 N 0.00 0.00 -3.41 6.15 2.88 -1.26 -5.02 113.62 112.95 2ju4 n SER 12 Ca 0.00 -1.46 -0.19 0.00 -1.33 0.00 0.00 58.87 55.89 2ju4 n SER 12 Cb 0.00 -0.09 0.06 0.00 -0.75 0.00 0.00 64.21 63.43 2ju4 n SER 12 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2ju4 n ALA 13 N 0.00 -2.38 -3.73 -1.46 0.00 -1.26 -5.00 120.51 106.69 2ju4 n ALA 13 Ca 0.00 -0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.21 2ju4 n ALA 13 Cb 0.59 -4.53 -0.17 0.00 0.00 0.00 0.00 19.45 15.35 2ju4 n ALA 13 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2ju4 s THR 14 N -3.43 0.70 0.00 0.00 -4.23 -1.26 -4.97 115.64 102.44 2ju4 s THR 14 Ca 0.34 -0.14 0.00 0.00 -1.18 0.00 0.00 61.69 60.71 2ju4 s THR 14 Cb -0.07 -0.75 0.00 0.00 1.34 0.00 0.00 72.50 73.03 2ju4 s THR 14 CO 0.77 0.29 0.42 -1.14 -0.54 0.00 0.00 174.62 174.42 2ju4 n ARG 15 N 4.60 0.00 0.00 3.99 3.00 -1.26 -4.91 116.66 122.08 2ju4 n ARG 15 Ca -0.16 -0.41 0.00 0.00 -0.00 0.00 0.00 57.85 57.29 2ju4 n ARG 15 Cb 0.50 -0.38 0.00 0.00 0.00 0.00 0.00 32.46 32.59 2ju4 n ARG 15 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.63 179.18 2ju4 n VAL 16 N 0.00 0.00 -1.19 5.15 3.14 -1.26 -5.16 118.33 119.02 2ju4 n VAL 16 Ca 0.00 0.00 0.13 0.00 -2.96 0.00 0.00 64.34 61.51 2ju4 n VAL 16 Cb 0.51 0.00 -0.05 0.00 -1.06 0.00 0.00 33.84 33.24 2ju4 n VAL 16 CO 0.00 0.00 0.00 0.23 -6.46 0.00 0.00 176.83 170.60 2ju4 n MET 17 N -0.34 -2.26 0.00 1.45 2.81 -1.26 -5.04 117.12 112.47 2ju4 n MET 17 Ca 0.00 1.70 0.00 0.00 -1.81 0.00 0.00 57.70 57.59 2ju4 n MET 17 Cb 0.00 -2.84 0.00 0.00 -0.71 0.00 0.00 33.22 29.67 2ju4 n MET 17 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2ju4 n GLY 18 N -3.68 0.11 0.75 3.03 0.00 -1.26 -5.15 105.19 98.98 2ju4 n GLY 18 Ca -0.03 -1.11 0.00 0.00 0.00 0.00 0.00 46.02 44.88 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 -4.00 0.00 -0.02 0.00 -1.26 -5.20 105.19 94.71 2ju4 n GLY 19 Ca 0.00 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.29 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 0.10 3.04 -3.30 1.61 -0.02 -1.26 -5.24 135.00 129.92 2ju4 n PRO 20 Ca 0.00 0.00 0.01 0.00 -2.02 0.00 0.00 63.50 61.49 2ju4 n PRO 20 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 33.50 33.45 2ju4 n PRO 20 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 2ju4 s THR 22 N 0.00 -0.95 0.37 3.45 -4.23 -1.26 -5.28 115.64 107.74 2ju4 s THR 22 Ca 0.00 -0.00 -0.24 0.00 -1.18 0.00 0.00 61.69 60.27 2ju4 s THR 22 Cb 0.00 -0.97 -0.13 0.00 1.34 0.00 0.00 72.50 72.74 2ju4 s THR 22 CO 0.00 -0.01 0.68 -2.65 -0.54 0.00 0.00 174.62 172.10 2ju4 n PRO 23 N 5.43 0.73 0.00 3.99 -0.02 -1.26 -4.98 135.00 138.88 2ju4 n PRO 23 Ca -0.04 0.26 0.00 0.00 -2.02 0.00 0.00 63.50 61.70 2ju4 n PRO 23 Cb 0.50 -1.56 0.00 0.00 -0.02 0.00 0.00 33.50 32.42 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 0.63 0.00 0.02 -0.52 5.12 -1.26 -5.13 116.66 115.52 2ju4 n ARG 24 Ca 0.12 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 56.04 2ju4 n ARG 24 Cb 0.36 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.66 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 0.00 0.00 5.56 4.01 -1.26 -5.17 118.16 121.30 2ju4 n LYS 25 Ca 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.80 2ju4 n LYS 25 Cb 0.00 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 34.52 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 1.36 -1.96 3.58 0.72 0.00 -1.26 -4.87 105.19 102.76 2ju4 n GLY 26 Ca 0.00 -1.51 -0.57 0.00 0.00 0.00 0.00 46.02 43.93 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 -1.98 0.52 -0.92 1.61 -0.02 -1.26 -4.88 135.00 128.08 2ju4 n PRO 27 Ca 0.00 0.19 -0.36 0.00 -2.02 0.00 0.00 63.50 61.31 2ju4 n PRO 27 Cb 0.00 -1.76 0.07 0.00 -0.02 0.00 0.00 33.50 31.79 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 2.56 -0.28 -2.18 0.52 -0.02 -1.26 -5.24 135.00 129.10 2ju4 n PRO 28 Ca 0.21 -0.07 -0.28 0.00 -2.02 0.00 0.00 63.50 61.35 2ju4 n PRO 28 Cb 0.11 -1.26 0.17 0.00 -0.02 0.00 0.00 33.50 32.50 2ju4 n PRO 28 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2ju4 s LYS 29 N -2.51 0.86 -0.38 -0.52 1.02 -1.26 -5.23 119.74 111.72 2ju4 s LYS 29 Ca 0.44 -0.75 0.12 0.00 0.02 0.00 0.00 55.97 55.80 2ju4 s LYS 29 Cb -0.10 -2.01 0.38 0.00 -0.52 0.00 0.00 37.83 35.58 2ju4 s LYS 29 CO 0.73 -2.17 1.03 0.36 -0.92 0.00 0.00 175.35 174.38 2ju4 n LYS 31 N -3.48 1.08 -2.91 1.68 0.00 -1.26 -5.21 118.16 108.06 2ju4 n LYS 31 Ca 0.16 -2.65 -0.01 0.00 -0.00 0.00 0.00 58.31 55.81 2ju4 n LYS 31 Cb 0.60 -1.03 0.00 0.00 -0.00 0.00 0.00 35.03 34.60 2ju4 n LYS 31 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 2ju4 n GLN 32 N -0.01 -2.27 0.23 -1.58 6.02 -1.26 -4.83 117.38 113.69 2ju4 n GLN 32 Ca 0.10 2.02 0.10 0.00 -0.01 0.00 0.00 57.00 59.21 2ju4 n GLN 32 Cb 0.76 -3.73 0.49 0.00 1.02 0.00 0.00 30.24 28.78 2ju4 n GLN 32 CO 0.00 0.00 0.00 -0.09 -1.01 0.00 0.00 177.06 175.96 2ju4 h ARG 33 N 3.20 0.00 -1.79 -1.09 2.43 -2.06 -3.44 114.38 111.64 2ju4 h ARG 33 Ca -0.01 0.00 0.05 0.00 -0.81 0.00 0.00 59.98 59.21 2ju4 h ARG 33 Cb 0.43 0.00 -0.24 0.00 -0.42 0.00 0.00 29.97 29.74 2ju4 h ARG 33 CO 0.07 0.21 0.21 -0.65 -1.51 0.00 0.00 179.97 178.30 2ju4 s GLN 34 N -3.70 0.59 -1.08 0.20 -1.52 -1.26 -5.08 119.66 107.80 2ju4 s GLN 34 Ca 0.00 0.93 -0.21 0.00 -1.95 0.00 0.00 55.36 54.14 2ju4 s GLN 34 Cb 0.10 0.16 0.08 0.00 -0.22 0.00 0.00 33.01 33.13 2ju4 s GLN 34 CO 0.63 -0.11 1.46 0.95 -0.25 0.00 0.00 175.29 177.97 2ju4 s THR 35 N 1.22 4.18 -1.75 -0.19 -4.23 -1.26 -4.76 115.64 108.84 2ju4 s THR 35 Ca -0.07 -1.29 0.23 0.00 -1.18 0.00 0.00 61.69 59.38 2ju4 s THR 35 Cb -0.05 -5.03 0.55 0.00 1.34 0.00 0.00 72.50 69.31 2ju4 s THR 35 CO -0.14 -1.86 1.76 -1.14 -0.54 0.00 0.00 174.62 172.69 2ju4 n ARG 36 N 8.16 0.55 0.00 3.99 3.00 -1.26 -5.08 116.66 126.02 2ju4 n ARG 36 Ca 0.35 0.03 0.00 0.00 -0.00 0.00 0.00 57.85 58.24 2ju4 n ARG 36 Cb 0.49 -1.50 0.00 0.00 0.00 0.00 0.00 32.46 31.45 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 -1.12 0.00 -3.58 -0.14 1.13 -1.26 -5.02 117.38 107.38 2ju4 n GLN 37 Ca 0.15 0.00 -0.00 0.00 -1.94 0.00 0.00 57.00 55.20 2ju4 n GLN 37 Cb 0.12 0.00 -0.04 0.00 0.11 0.00 0.00 30.24 30.43 2ju4 n GLN 37 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 2ju4 s LYS 39 N 0.00 0.50 0.00 -1.09 -0.14 -1.26 -5.05 119.74 112.70 2ju4 s LYS 39 Ca 0.00 1.26 0.00 0.00 -1.36 0.00 0.00 55.97 55.87 2ju4 s LYS 39 Cb 0.00 0.76 0.00 0.00 -1.68 0.00 0.00 37.83 36.91 2ju4 s LYS 39 CO 0.00 -0.17 0.00 -1.13 -0.76 0.00 0.00 175.35 173.29 2ju4 n SER 40 N 5.32 0.00 -4.71 2.83 3.41 -1.26 -5.14 113.62 114.07 2ju4 n SER 40 Ca -0.11 0.00 -0.31 0.00 -0.26 0.00 0.00 58.87 58.19 2ju4 n SER 40 Cb 0.50 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.37 2ju4 n SER 40 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2ju4 s LYS 41 N 0.00 2.70 0.88 4.33 3.01 -1.26 -5.11 119.74 124.30 2ju4 s LYS 41 Ca 0.00 -0.73 -0.11 0.00 -1.01 0.00 0.00 55.97 54.12 2ju4 s LYS 41 Cb 0.00 -2.63 0.12 0.00 -1.01 0.00 0.00 37.83 34.32 2ju4 s LYS 41 CO 0.00 0.57 1.10 -1.25 0.51 0.00 0.00 175.35 176.28 2ju4 s PRO 42 N -2.10 1.32 -0.00 -1.68 0.04 -1.26 -4.94 135.00 126.38 2ju4 s PRO 42 Ca 0.25 1.14 -0.30 0.00 0.04 0.00 0.00 61.00 62.13 2ju4 s PRO 42 Cb -0.12 -1.79 -0.06 0.00 0.04 0.00 0.00 34.50 32.57 2ju4 s PRO 42 CO 0.17 -2.29 1.57 -1.25 0.04 0.00 0.00 177.00 175.24 2ju4 s PRO 43 N -4.80 4.22 -0.30 0.56 0.04 -1.26 -4.94 135.00 128.51 2ju4 s PRO 43 Ca 0.64 2.16 -0.16 0.00 0.04 0.00 0.00 61.00 63.68 2ju4 s PRO 43 Cb -0.20 -3.74 0.18 0.00 0.04 0.00 0.00 34.50 30.79 2ju4 s PRO 43 CO 0.58 -0.73 1.16 0.15 0.04 0.00 0.00 177.00 178.20 2ju4 s LYS 44 N 3.11 0.03 0.15 4.56 1.02 -1.26 -5.18 119.74 122.18 2ju4 s LYS 44 Ca 0.70 0.03 -0.19 0.00 0.02 0.00 0.00 55.97 56.54 2ju4 s LYS 44 Cb -0.35 0.01 0.07 0.00 -0.52 0.00 0.00 37.83 37.04 2ju4 s LYS 44 CO 0.29 -0.06 0.90 1.17 -0.92 0.00 0.00 175.35 176.73 2ju4 n LYS 45 N 5.01 0.55 0.00 1.68 4.81 -1.26 -5.14 118.16 123.82 2ju4 n LYS 45 Ca 0.11 -1.27 0.00 0.00 -0.87 0.00 0.00 58.31 56.28 2ju4 n LYS 45 Cb 0.59 1.72 0.00 0.00 0.02 0.00 0.00 35.03 37.36 2ju4 n LYS 45 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2ju4 n GLY 46 N -0.63 -1.12 0.15 3.14 0.00 -1.26 -4.99 105.19 100.49 2ju4 n GLY 46 Ca -0.02 0.43 -0.13 0.00 0.00 0.00 0.00 46.02 46.31 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 0.00 1.48 -0.58 1.61 0.24 -1.26 -4.84 118.33 114.98 2ju4 n VAL 47 Ca 0.00 0.05 0.00 0.00 -2.04 0.00 0.00 64.34 62.35 2ju4 n VAL 47 Cb 0.00 -2.21 0.00 0.00 -1.47 0.00 0.00 33.84 30.16 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 -4.36 -1.64 -1.92 7.34 6.02 -1.26 -4.63 117.38 116.93 2ju4 n GLN 48 Ca -0.21 0.26 -0.02 0.00 -0.01 0.00 0.00 57.00 57.02 2ju4 n GLN 48 Cb 0.57 -3.94 0.01 0.00 1.02 0.00 0.00 30.24 27.90 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 0.36 0.51 6.63 1.08 0.00 -1.26 -4.22 105.19 108.28 2ju4 n GLY 49 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 46.02 45.78 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 -1.30 2.09 2.56 -0.02 0.00 -1.26 -5.02 105.19 102.24 2ju4 n GLY 51 Ca -0.02 -0.12 -0.01 0.00 0.00 0.00 0.00 46.02 45.87 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 6.64 -3.71 0.00 1.61 2.03 -1.26 -4.72 116.55 117.15 2ju4 n ASP 52 Ca 0.00 0.03 0.00 0.00 0.52 0.00 0.00 54.79 55.34 2ju4 n ASP 52 Cb 0.00 -2.46 0.00 0.00 -0.72 0.00 0.00 41.12 37.94 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 0.41 0.00 -3.85 1.67 5.75 -1.26 -5.10 116.55 114.17 2ju4 n ASP 53 Ca -0.01 0.00 -0.28 0.00 -0.01 0.00 0.00 54.79 54.49 2ju4 n ASP 53 Cb 0.32 0.00 -0.12 0.00 -1.03 0.00 0.00 41.12 40.30 2ju4 n ASP 53 CO 0.00 0.00 0.00 -0.38 -0.11 0.00 0.00 177.20 176.71 2ju4 n ILE 54 N 0.00 1.54 -2.54 2.12 2.08 -1.26 -5.09 119.36 116.20 2ju4 n ILE 54 Ca 0.00 -4.82 -0.28 0.00 0.56 0.00 0.00 62.75 58.21 2ju4 n ILE 54 Cb 0.00 -2.16 -0.00 0.00 -0.75 0.00 0.00 39.64 36.73 2ju4 n ILE 54 CO 0.00 0.00 0.00 -2.16 0.56 0.00 0.00 176.55 174.95 2ju4 s PRO 55 N -1.45 3.58 0.00 0.38 0.04 -1.26 -4.29 135.00 132.00 2ju4 s PRO 55 Ca 0.26 0.33 0.00 0.00 0.04 0.00 0.00 61.00 61.63 2ju4 s PRO 55 Cb -0.03 -2.33 0.00 0.00 0.04 0.00 0.00 34.50 32.18 2ju4 s PRO 55 CO -0.16 -0.24 0.00 0.41 0.04 0.00 0.00 177.00 177.05 2ju4 n GLY 56 N -2.21 0.62 0.13 0.56 0.00 -1.26 -4.98 105.19 98.05 2ju4 n GLY 56 Ca 0.02 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.99 2ju4 n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ju4 h MET 57 N 4.50 -0.30 0.00 1.61 -0.00 -2.04 -3.46 114.93 115.24 2ju4 h MET 57 Ca 0.00 0.02 0.00 0.00 -0.00 0.00 0.00 59.70 59.72 2ju4 h MET 57 Cb 0.00 0.07 0.00 0.00 -0.00 0.00 0.00 31.60 31.67 2ju4 h MET 57 CO 0.00 -0.20 0.00 -0.85 -0.00 0.00 0.00 176.91 175.86 2ju4 n GLU 58 N -3.22 0.00 0.00 -0.10 0.28 -1.26 -5.10 120.64 111.23 2ju4 n GLU 58 Ca -0.04 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.96 2ju4 n GLU 58 Cb 0.12 0.00 0.00 0.00 1.43 0.00 0.00 31.44 32.99 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 3.26 0.00 -1.84 0.00 -1.26 -5.21 105.19 100.14 2ju4 n GLY 59 Ca 0.00 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 44.94 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 -1.26 0.24 3.44 -0.02 0.00 -1.26 -4.71 105.19 101.63 2ju4 n GLY 61 Ca 0.00 0.13 -0.46 0.00 0.00 0.00 0.00 46.02 45.69 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 0.01 -0.58 2.61 -2.24 -1.26 -4.66 114.28 108.15 2ju4 n THR 62 Ca 0.00 -0.09 -0.21 0.00 -2.27 0.00 0.00 64.05 61.48 2ju4 n THR 62 Cb 0.00 -0.79 -0.03 0.00 -2.10 0.00 0.00 70.33 67.41 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 10.26 2.83 -2.78 3.42 8.00 -1.26 -4.52 116.55 132.49 2ju4 n ASP 63 Ca 0.59 -2.31 -0.25 0.00 0.71 0.00 0.00 54.79 53.53 2ju4 n ASP 63 Cb 0.08 -0.88 0.02 0.00 -0.02 0.00 0.00 41.12 40.32 2ju4 n ASP 63 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2ju4 n ILE 64 N 4.96 -2.52 -0.54 0.53 3.06 -1.26 -4.56 119.36 119.03 2ju4 n ILE 64 Ca 0.33 0.04 -0.06 0.00 -2.50 0.00 0.00 62.75 60.56 2ju4 n ILE 64 Cb 0.16 -2.29 -0.09 0.00 0.54 0.00 0.00 39.64 37.96 2ju4 n ILE 64 CO 0.00 0.00 0.00 1.07 -2.50 0.00 0.00 176.55 175.12 2ju4 n THR 65 N -0.37 1.65 0.00 9.51 5.66 -1.26 -4.45 114.28 125.02 2ju4 n THR 65 Ca -0.08 -0.81 0.00 0.00 -3.05 0.00 0.00 64.05 60.11 2ju4 n THR 65 Cb 0.46 -1.75 0.00 0.00 -1.55 0.00 0.00 70.33 67.50 2ju4 n THR 65 CO 0.00 0.00 0.00 0.52 -3.05 0.00 0.00 175.07 172.54 2ju4 n VAL 66 N 2.65 0.00 -2.31 1.08 0.31 -1.26 -5.08 118.33 113.72 2ju4 n VAL 66 Ca 0.23 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.56 2ju4 n VAL 66 Cb 0.50 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.43 2ju4 n VAL 66 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 2ju4 n ILE 67 N 0.00 0.00 0.00 2.52 5.41 -1.26 -5.17 119.36 120.85 2ju4 n ILE 67 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 2ju4 n ILE 67 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 38.93 2ju4 n ILE 67 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 2ju4 n PRO 69 N 0.00 0.00 -0.35 0.38 -0.02 -1.26 -4.96 135.00 128.79 2ju4 n PRO 69 Ca 0.00 0.00 -0.03 0.00 -2.02 0.00 0.00 63.50 61.45 2ju4 n PRO 69 Cb 0.00 -0.22 -0.04 0.00 -0.02 0.00 0.00 33.50 33.23 2ju4 n PRO 69 CO 0.00 0.00 0.00 -2.67 1.98 0.00 0.00 175.50 174.81 2ju4 n TRP 70 N -2.07 0.00 -0.59 6.00 2.14 -1.26 -2.31 117.44 119.35 2ju4 n TRP 70 Ca 0.00 -0.58 0.00 0.00 2.07 0.00 0.00 57.50 58.99 2ju4 n TRP 70 Cb 0.00 -0.65 0.00 0.00 -0.81 0.00 0.00 31.31 29.85 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 2.22 0.00 -1.18 -2.67 0.00 -1.26 -5.10 120.64 112.66 2ju4 n GLU 71 Ca 0.09 0.00 -0.30 0.00 0.00 0.00 0.00 57.16 56.95 2ju4 n GLU 71 Cb 0.33 -0.20 0.13 0.00 0.00 0.00 0.00 31.44 31.70 2ju4 n GLU 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2ju4 s ALA 72 N 0.00 1.65 0.34 4.31 0.00 -0.98 -4.89 121.76 122.18 2ju4 s ALA 72 Ca 0.00 0.03 -0.01 0.00 0.00 0.00 0.00 51.96 51.98 2ju4 s ALA 72 Cb 0.00 -3.22 -0.04 0.00 0.00 0.00 0.00 23.12 19.86 2ju4 s ALA 72 CO 0.00 -2.28 0.56 -0.80 0.00 0.00 0.00 175.76 173.24 2ju4 s ASN 74 N -3.36 6.32 -0.20 0.00 0.01 -1.26 -3.41 114.94 113.04 2ju4 s ASN 74 Ca 0.63 0.53 -0.00 0.00 -0.71 0.00 0.00 52.86 53.31 2ju4 s ASN 74 Cb -0.18 -2.07 0.00 0.00 0.41 0.00 0.00 41.25 39.41 2ju4 s ASN 74 CO 0.57 -0.28 0.00 1.57 -1.51 0.00 0.00 177.10 177.45 2ju4 n HIS 75 N -1.60 -0.12 -0.20 2.20 -0.00 -1.26 -4.83 115.22 109.42 2ju4 n HIS 75 Ca -0.04 0.00 -0.12 0.00 0.46 0.00 0.00 57.72 58.03 2ju4 n HIS 75 Cb 0.56 -1.34 -0.09 0.00 -0.12 0.00 0.00 29.99 28.99 2ju4 n HIS 75 CO 0.00 0.00 0.00 1.49 0.46 0.00 0.00 176.34 178.29 2ju4 h GLU 77 N -0.00 -0.24 0.00 1.57 4.57 -1.90 -3.53 114.58 115.04 2ju4 h GLU 77 Ca -0.06 0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.14 2ju4 h GLU 77 Cb 1.04 0.05 0.00 0.00 -0.16 0.00 0.00 28.75 29.69 2ju4 h GLU 77 CO 0.07 -0.16 0.00 -0.11 -1.18 0.00 0.00 179.01 177.63 2ju4 n LEU 78 N -5.08 0.00 -3.64 1.64 7.94 -1.26 -5.17 117.00 111.42 2ju4 n LEU 78 Ca -0.02 0.00 -0.06 0.00 -1.11 0.00 0.00 56.01 54.82 2ju4 n LEU 78 Cb 0.29 0.00 -0.07 0.00 0.53 0.00 0.00 43.42 44.17 2ju4 n LEU 78 CO -0.04 0.00 0.72 -2.28 -1.11 0.00 0.00 177.39 174.68 2ju4 s HIS 79 N 2.90 -0.51 0.00 1.96 5.65 -1.22 -4.12 115.29 119.95 2ju4 s HIS 79 Ca 0.00 1.14 0.00 0.00 0.25 0.00 0.00 55.06 56.45 2ju4 s HIS 79 Cb 0.00 0.37 0.00 0.00 -1.18 0.00 0.00 32.58 31.77 2ju4 s HIS 79 CO 0.00 -0.25 0.00 0.39 -0.65 0.00 0.00 174.74 174.23 2ju4 n GLU 80 N 2.81 0.00 -0.98 2.88 -0.58 -1.22 -4.94 120.64 118.61 2ju4 n GLU 80 Ca -0.15 0.00 -0.08 0.00 -0.42 0.00 0.00 57.16 56.51 2ju4 n GLU 80 Cb 0.57 0.00 0.26 0.00 -0.57 0.00 0.00 31.44 31.70 2ju4 n GLU 80 CO 0.00 0.00 0.00 1.47 -0.48 0.00 0.00 177.13 178.12 2ju4 n LEU 81 N -0.21 5.90 -4.49 -4.62 -0.00 -1.26 -5.00 117.00 107.32 2ju4 n LEU 81 Ca 0.00 -3.08 -0.43 0.00 -0.00 0.00 0.00 56.01 52.51 2ju4 n LEU 81 Cb 0.00 -0.74 0.00 0.00 -0.00 0.00 0.00 43.42 42.68 2ju4 n LEU 81 CO 0.00 0.80 0.22 0.00 -0.00 0.00 0.00 177.39 178.41 2ju4 n ALA 82 N -0.24 -1.16 -0.30 1.47 0.00 -1.26 -4.84 120.51 114.19 2ju4 n ALA 82 Ca 0.40 0.23 0.00 0.00 0.00 0.00 0.00 53.44 54.08 2ju4 n ALA 82 Cb 1.35 -1.85 0.00 0.00 0.00 0.00 0.00 19.45 18.96 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 0.57 0.00 0.00 0.00 -0.06 -1.26 -4.99 117.38 111.64 2ju4 n GLN 83 Ca 0.11 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.11 2ju4 n GLN 83 Cb 0.37 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.55 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 -2.06 0.00 0.65 3.69 4.01 -1.26 -4.66 117.16 117.53 2ju4 n TYR 84 Ca 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 2ju4 n TYR 84 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.03 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 1.54 1.87 0.00 2.72 0.00 -1.26 -5.13 105.19 104.93 2ju4 n GLY 85 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2ju4 n GLY 85 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61