#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 -8.46 -4.50 6.12 0.23 -1.26 -4.96 115.26 102.44 2ju4 n ASN 2 Ca 0.00 1.73 -0.30 0.00 -0.53 0.00 0.00 54.58 55.49 2ju4 n ASN 2 Cb 0.00 -5.12 -0.11 0.00 -2.08 0.00 0.00 39.78 32.47 2ju4 n ASN 2 CO 0.00 0.00 0.00 -0.22 -0.93 0.00 0.00 177.26 176.11 2ju4 s LEU 3 N -5.01 2.74 -0.05 -4.53 2.96 -1.26 -5.06 118.68 108.48 2ju4 s LEU 3 Ca 0.00 -0.52 -0.37 0.00 -0.22 0.00 0.00 54.13 53.01 2ju4 s LEU 3 Cb 0.00 -1.58 -0.16 0.00 0.50 0.00 0.00 46.19 44.95 2ju4 s LEU 3 CO 0.00 0.18 1.56 1.21 -1.32 0.00 0.00 176.35 177.98 2ju4 n GLU 4 N 0.84 1.35 -1.08 1.98 0.00 -1.26 -4.84 120.64 117.64 2ju4 n GLU 4 Ca -0.15 0.49 -0.37 0.00 0.00 0.00 0.00 57.16 57.13 2ju4 n GLU 4 Cb 0.53 -2.18 0.03 0.00 0.00 0.00 0.00 31.44 29.82 2ju4 n GLU 4 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.13 174.83 2ju4 n PRO 5 N 3.98 0.00 -2.13 5.31 -0.02 -1.26 -4.82 135.00 136.06 2ju4 n PRO 5 Ca 0.21 0.00 -0.42 0.00 -2.02 0.00 0.00 63.50 61.28 2ju4 n PRO 5 Cb 0.19 -1.02 -0.03 0.00 -0.02 0.00 0.00 33.50 32.62 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 -1.73 4.30 -0.28 0.52 0.04 -1.26 -4.98 135.00 131.61 2ju4 s PRO 6 Ca 0.46 2.12 -0.35 0.00 0.04 0.00 0.00 61.00 63.27 2ju4 s PRO 6 Cb -0.28 -3.25 0.17 0.00 0.04 0.00 0.00 34.50 31.19 2ju4 s PRO 6 CO 0.77 -0.47 1.36 0.21 0.04 0.00 0.00 177.00 178.92 2ju4 s LYS 7 N 1.17 0.05 0.04 4.56 2.47 -1.26 -5.07 119.74 121.70 2ju4 s LYS 7 Ca 0.65 -0.01 0.00 0.00 -1.56 0.00 0.00 55.97 55.06 2ju4 s LYS 7 Cb -0.38 0.03 0.00 0.00 -1.46 0.00 0.00 37.83 36.02 2ju4 s LYS 7 CO 0.30 -0.02 0.00 0.00 0.16 0.00 0.00 175.35 175.79 2ju4 n ALA 8 N 0.20 1.15 0.00 3.13 0.00 -1.26 -5.22 120.51 118.50 2ju4 n ALA 8 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 2ju4 n ALA 8 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.02 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 -2.59 0.00 -3.38 0.00 2.13 -1.26 -5.33 120.64 110.22 2ju4 n GLU 9 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 2ju4 n GLU 9 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 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 0.00 -2.89 -3.56 5.31 3.00 -1.26 -5.28 116.66 111.98 2ju4 n ARG 11 Ca 0.00 0.00 -0.37 0.00 -0.00 0.00 0.00 57.85 57.48 2ju4 n ARG 11 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 32.46 32.38 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 -0.96 6.29 -0.41 6.15 0.01 -1.26 -4.98 113.70 118.53 2ju4 s SER 12 Ca 0.00 0.33 0.09 0.00 1.31 0.00 0.00 55.95 57.67 2ju4 s SER 12 Cb 0.00 -2.16 0.43 0.00 0.21 0.00 0.00 66.02 64.50 2ju4 s SER 12 CO 0.00 0.04 1.05 0.00 0.41 0.00 0.00 173.24 174.74 2ju4 n ALA 13 N 4.12 4.54 -0.09 1.44 0.00 -1.26 -4.83 120.51 124.43 2ju4 n ALA 13 Ca -0.12 -4.01 -0.14 0.00 0.00 0.00 0.00 53.44 49.16 2ju4 n ALA 13 Cb 0.52 -0.67 -0.05 0.00 0.00 0.00 0.00 19.45 19.25 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 -0.34 1.44 0.00 0.00 -2.24 -1.26 -4.95 114.28 106.93 2ju4 n THR 14 Ca 0.30 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 62.07 2ju4 n THR 14 Cb 0.69 -2.13 0.00 0.00 -2.10 0.00 0.00 70.33 66.79 2ju4 n THR 14 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 2ju4 n ARG 15 N -4.28 0.00 0.00 -0.78 1.85 -1.26 -4.54 116.66 107.65 2ju4 n ARG 15 Ca -0.25 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.60 2ju4 n ARG 15 Cb 0.60 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 32.01 2ju4 n ARG 15 CO 0.00 0.00 0.00 1.55 -0.01 0.00 0.00 177.63 179.17 2ju4 n VAL 16 N 0.00 0.00 0.00 8.89 3.14 -1.26 -5.05 118.33 124.05 2ju4 n VAL 16 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 2ju4 n VAL 16 Cb 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.78 2ju4 n VAL 16 CO 0.00 0.00 0.00 0.80 -6.46 0.00 0.00 176.83 171.17 2ju4 n MET 17 N -1.23 0.00 -3.14 1.45 1.56 -1.26 -4.76 117.12 109.75 2ju4 n MET 17 Ca 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.43 2ju4 n MET 17 Cb 0.00 0.00 0.00 0.00 2.15 0.00 0.00 33.22 35.37 2ju4 n MET 17 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 2ju4 n GLY 18 N 0.00 -0.65 0.00 -5.12 0.00 -1.26 -5.13 105.19 93.03 2ju4 n GLY 18 Ca 0.00 -1.35 0.00 0.00 0.00 0.00 0.00 46.02 44.67 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 -2.44 0.00 -0.02 0.00 -1.26 -5.20 105.19 96.27 2ju4 n GLY 19 Ca 0.00 -1.18 0.00 0.00 0.00 0.00 0.00 46.02 44.84 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 0.00 1.61 -0.02 -1.26 -5.23 135.00 130.10 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 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 2ju4 n PRO 20 CO 0.00 0.00 0.00 -2.37 1.98 0.00 0.00 175.50 175.11 2ju4 n THR 22 N 0.00 0.00 -0.95 3.45 5.66 -1.26 -5.15 114.28 116.02 2ju4 n THR 22 Ca 0.00 0.00 -0.11 0.00 -3.05 0.00 0.00 64.05 60.89 2ju4 n THR 22 Cb 0.00 0.00 -0.04 0.00 -1.55 0.00 0.00 70.33 68.74 2ju4 n THR 22 CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 175.07 169.37 2ju4 n PRO 23 N 0.00 0.01 0.00 1.09 -0.02 -1.26 -4.59 135.00 130.23 2ju4 n PRO 23 Ca 0.00 -0.40 0.00 0.00 -2.02 0.00 0.00 63.50 61.08 2ju4 n PRO 23 Cb 0.00 -1.65 0.00 0.00 -0.02 0.00 0.00 33.50 31.83 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 5.21 0.00 -0.04 -0.52 5.12 -1.26 0.97 116.66 126.14 2ju4 n ARG 24 Ca 0.15 0.00 -0.18 0.00 -1.93 0.00 0.00 57.85 55.89 2ju4 n ARG 24 Cb 0.37 0.00 -0.14 0.00 -1.16 0.00 0.00 32.46 31.53 2ju4 n ARG 24 CO 0.00 0.00 0.00 1.17 -1.93 0.00 0.00 177.63 176.87 2ju4 n LYS 25 N 0.00 0.71 -4.00 5.56 3.00 -1.26 -5.02 118.16 117.15 2ju4 n LYS 25 Ca 0.00 0.21 0.00 0.00 -0.00 0.00 0.00 58.31 58.52 2ju4 n LYS 25 Cb 0.00 -1.65 0.00 0.00 0.00 0.00 0.00 35.03 33.38 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 1.99 -1.80 3.69 3.14 0.00 0.27 -5.10 105.19 107.38 2ju4 n GLY 26 Ca -0.34 -1.25 -0.59 0.00 0.00 0.00 0.00 46.02 43.84 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 -0.26 0.90 -1.38 1.61 -0.02 -1.26 -4.73 135.00 129.85 2ju4 n PRO 27 Ca 0.00 0.33 -0.43 0.00 -2.02 0.00 0.00 63.50 61.37 2ju4 n PRO 27 Cb 0.00 -1.97 -0.01 0.00 -0.02 0.00 0.00 33.50 31.51 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 4.59 0.22 0.14 0.52 -0.02 -1.26 -5.16 135.00 134.03 2ju4 n PRO 28 Ca 0.26 0.08 -0.06 0.00 -2.02 0.00 0.00 63.50 61.76 2ju4 n PRO 28 Cb 0.10 -1.18 -0.03 0.00 -0.02 0.00 0.00 33.50 32.37 2ju4 n PRO 28 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 2ju4 h LYS 29 N 0.69 -0.39 0.00 -0.52 3.64 -2.03 -3.52 116.57 114.44 2ju4 h LYS 29 Ca -0.36 0.03 -0.07 0.00 -1.27 0.00 0.00 60.65 58.98 2ju4 h LYS 29 Cb 1.43 0.09 -0.16 0.00 -0.41 0.00 0.00 32.23 33.18 2ju4 h LYS 29 CO 0.51 -0.26 -0.70 1.63 -2.27 0.00 0.00 179.45 178.35 2ju4 n LYS 31 N -4.01 0.07 -3.66 1.90 4.01 -1.26 -5.10 118.16 110.12 2ju4 n LYS 31 Ca -0.05 -1.50 -0.06 0.00 -0.51 0.00 0.00 58.31 56.19 2ju4 n LYS 31 Cb 0.16 -0.35 -0.08 0.00 -0.51 0.00 0.00 35.03 34.26 2ju4 n LYS 31 CO 0.00 0.00 0.00 -0.65 -1.11 0.00 0.00 177.40 175.64 2ju4 s GLN 32 N -0.15 0.43 -0.37 1.97 -0.21 -1.26 -5.11 119.66 114.97 2ju4 s GLN 32 Ca 0.15 1.18 0.01 0.00 0.02 0.00 0.00 55.36 56.71 2ju4 s GLN 32 Cb 0.17 0.49 0.14 0.00 1.00 0.00 0.00 33.01 34.82 2ju4 s GLN 32 CO -0.07 -0.22 0.22 1.03 -2.12 0.00 0.00 175.29 174.12 2ju4 s ARG 33 N 2.61 0.71 -0.09 2.91 1.81 -1.26 -5.10 118.95 120.54 2ju4 s ARG 33 Ca -0.04 -1.49 -0.30 0.00 -1.72 0.00 0.00 55.73 52.19 2ju4 s ARG 33 Cb -0.12 -1.53 0.11 0.00 -0.45 0.00 0.00 34.95 32.97 2ju4 s ARG 33 CO -0.15 -1.20 0.90 -1.14 -0.68 0.00 0.00 175.30 173.03 2ju4 s GLN 34 N 0.90 0.75 0.66 3.54 2.00 -1.26 -5.18 119.66 121.07 2ju4 s GLN 34 Ca 0.18 0.02 0.05 0.00 -2.00 0.00 0.00 55.36 53.61 2ju4 s GLN 34 Cb -0.23 0.35 0.12 0.00 0.80 0.00 0.00 33.01 34.05 2ju4 s GLN 34 CO 0.00 -0.27 0.90 0.95 -0.50 0.00 0.00 175.29 176.38 2ju4 s THR 35 N -1.79 2.05 -1.07 -0.34 -4.23 -1.26 -4.37 115.64 104.64 2ju4 s THR 35 Ca -0.01 -0.83 -0.09 0.00 -1.18 0.00 0.00 61.69 59.58 2ju4 s THR 35 Cb -0.01 -2.22 0.08 0.00 1.34 0.00 0.00 72.50 71.69 2ju4 s THR 35 CO -0.01 0.00 0.35 0.54 -0.54 0.00 0.00 174.62 174.97 2ju4 n ARG 36 N -2.54 -2.68 -1.78 3.99 1.74 -1.26 -5.16 116.66 108.97 2ju4 n ARG 36 Ca 0.16 0.31 -0.41 0.00 -0.77 0.00 0.00 57.85 57.14 2ju4 n ARG 36 Cb 0.61 -4.93 -0.01 0.00 -1.02 0.00 0.00 32.46 27.12 2ju4 n ARG 36 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2ju4 n GLN 37 N -3.42 3.42 -3.78 5.56 10.64 -1.26 -5.10 117.38 123.43 2ju4 n GLN 37 Ca 0.00 -2.79 0.00 0.00 -1.83 0.00 0.00 57.00 52.39 2ju4 n GLN 37 Cb 0.52 -3.02 0.00 0.00 -0.86 0.00 0.00 30.24 26.88 2ju4 n GLN 37 CO 0.00 0.00 0.00 1.17 -1.83 0.00 0.00 177.06 176.40 2ju4 n LYS 39 N 4.52 -0.46 0.00 2.61 4.81 -1.26 -5.19 118.16 123.20 2ju4 n LYS 39 Ca 0.57 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 58.01 2ju4 n LYS 39 Cb 0.33 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.38 2ju4 n LYS 39 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 2ju4 n SER 40 N 0.60 0.00 -4.61 3.14 2.88 -1.26 -4.95 113.62 109.43 2ju4 n SER 40 Ca 0.00 0.00 -0.48 0.00 -1.33 0.00 0.00 58.87 57.06 2ju4 n SER 40 Cb 0.00 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.42 2ju4 n SER 40 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 2ju4 n LYS 41 N 0.00 1.44 -2.43 -1.46 0.00 -1.26 -4.92 118.16 109.53 2ju4 n LYS 41 Ca 0.00 0.52 -0.33 0.00 -0.00 0.00 0.00 58.31 58.49 2ju4 n LYS 41 Cb 0.00 -2.11 -0.03 0.00 -0.00 0.00 0.00 35.03 32.89 2ju4 n LYS 41 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 2ju4 s PRO 42 N -0.04 3.76 0.39 -1.58 0.04 -1.26 -5.05 135.00 131.26 2ju4 s PRO 42 Ca 0.75 1.22 -0.14 0.00 0.04 0.00 0.00 61.00 62.88 2ju4 s PRO 42 Cb -0.82 -2.10 -0.08 0.00 0.04 0.00 0.00 34.50 31.55 2ju4 s PRO 42 CO 0.49 -0.45 0.81 -1.25 0.04 0.00 0.00 177.00 176.64 2ju4 s PRO 43 N -3.57 3.93 -1.31 0.56 0.04 -1.26 -3.93 135.00 129.45 2ju4 s PRO 43 Ca 0.64 0.68 -0.00 0.00 0.04 0.00 0.00 61.00 62.36 2ju4 s PRO 43 Cb -0.14 -2.35 -0.00 0.00 0.04 0.00 0.00 34.50 32.05 2ju4 s PRO 43 CO 0.25 -0.00 0.67 1.17 0.04 0.00 0.00 177.00 179.13 2ju4 n LYS 44 N -0.94 -4.70 0.00 4.56 3.00 -1.26 -4.70 118.16 114.11 2ju4 n LYS 44 Ca 0.04 0.60 0.00 0.00 -0.00 0.00 0.00 58.31 58.95 2ju4 n LYS 44 Cb 0.54 -5.11 0.00 0.00 0.00 0.00 0.00 35.03 30.46 2ju4 n LYS 44 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.40 178.57 2ju4 n LYS 45 N -4.27 0.00 0.00 1.64 3.00 -1.26 -5.12 118.16 112.14 2ju4 n LYS 45 Ca -0.30 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.01 2ju4 n LYS 45 Cb 0.68 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.71 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 0.00 0.81 2.87 3.14 0.00 -1.25 -4.97 105.19 105.78 2ju4 n GLY 46 Ca 0.00 -0.31 -0.01 0.00 0.00 0.00 0.00 46.02 45.70 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 0.00 -8.09 -0.15 1.61 0.31 -1.26 -4.93 118.33 105.81 2ju4 n VAL 47 Ca 0.00 1.46 0.00 0.00 -0.01 0.00 0.00 64.34 65.79 2ju4 n VAL 47 Cb 0.00 -5.20 0.00 0.00 -0.91 0.00 0.00 33.84 27.73 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 1.36 0.00 0.00 5.55 10.64 -1.26 -5.20 117.38 128.47 2ju4 n GLN 48 Ca -0.10 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.07 2ju4 n GLN 48 Cb 0.28 0.00 0.00 0.00 -0.86 0.00 0.00 30.24 29.66 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 0.00 1.54 2.75 2.61 0.00 -1.26 -5.28 105.19 105.55 2ju4 n GLY 49 Ca 0.00 -0.66 -0.02 0.00 0.00 0.00 0.00 46.02 45.34 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 -0.33 1.86 7.00 -0.02 0.00 -1.26 -5.23 105.19 107.20 2ju4 n GLY 51 Ca 0.00 -0.66 0.00 0.00 0.00 0.00 0.00 46.02 45.36 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 -0.96 0.00 -3.32 1.61 -0.08 -1.26 -4.86 116.55 107.67 2ju4 n ASP 52 Ca -0.04 0.00 -0.21 0.00 -1.51 0.00 0.00 54.79 53.03 2ju4 n ASP 52 Cb 0.84 0.00 0.07 0.00 2.34 0.00 0.00 41.12 44.37 2ju4 n ASP 52 CO 0.00 0.00 0.00 0.47 0.12 0.00 0.00 177.20 177.79 2ju4 n ASP 53 N 3.63 -5.54 -3.72 1.67 9.92 -1.26 -4.96 116.55 116.29 2ju4 n ASP 53 Ca 0.00 -0.50 -0.28 0.00 -0.53 0.00 0.00 54.79 53.48 2ju4 n ASP 53 Cb 0.00 -4.66 -0.11 0.00 -0.64 0.00 0.00 41.12 35.71 2ju4 n ASP 53 CO 0.00 0.00 0.00 -0.38 0.13 0.00 0.00 177.20 176.95 2ju4 n ILE 54 N -4.69 0.95 1.75 0.53 5.41 -1.26 -4.90 119.36 117.15 2ju4 n ILE 54 Ca -0.02 -4.53 0.15 0.00 1.00 0.00 0.00 62.75 59.35 2ju4 n ILE 54 Cb 0.57 -2.05 0.76 0.00 -0.71 0.00 0.00 39.64 38.21 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 2.07 1.19 0.00 0.38 -0.04 -1.26 -4.55 135.00 132.78 2ju4 n PRO 55 Ca 0.23 -0.36 0.00 0.00 -0.04 0.00 0.00 63.50 63.33 2ju4 n PRO 55 Cb 0.39 -1.49 0.00 0.00 -0.04 0.00 0.00 33.50 32.36 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 1.10 -1.40 3.03 0.55 0.00 -1.26 -4.57 105.19 102.63 2ju4 n GLY 56 Ca 0.21 0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.33 2ju4 n GLY 56 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 2ju4 n MET 57 N -0.16 -0.62 0.00 1.61 0.00 -1.26 -4.79 117.12 111.89 2ju4 n MET 57 Ca 0.00 0.09 0.00 0.00 0.00 0.00 0.00 57.70 57.79 2ju4 n MET 57 Cb 0.00 -3.40 0.00 0.00 0.00 0.00 0.00 33.22 29.82 2ju4 n MET 57 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 175.97 176.36 2ju4 n GLU 58 N -0.38 0.00 0.00 3.17 1.02 -1.26 -4.83 120.64 118.36 2ju4 n GLU 58 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 2ju4 n GLU 58 Cb 0.09 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.51 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 5.00 -0.09 1.16 0.62 0.00 -1.26 -4.82 105.19 105.79 2ju4 n GLY 59 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -1.01 1.92 0.37 -0.02 0.00 -1.26 -4.70 105.19 100.49 2ju4 n GLY 61 Ca 0.00 -0.48 0.09 0.00 0.00 0.00 0.00 46.02 45.63 2ju4 n GLY 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ju4 h THR 62 N 0.00 0.90 0.00 2.61 1.03 -1.88 -0.79 112.91 114.78 2ju4 h THR 62 Ca 0.00 -0.29 0.00 0.00 -0.01 0.00 0.00 66.41 66.11 2ju4 h THR 62 Cb 0.00 -0.01 0.00 0.00 -1.07 0.00 0.00 68.15 67.07 2ju4 h THR 62 CO 0.00 0.15 0.00 0.47 -0.01 0.00 0.00 175.52 176.13 2ju4 n ASP 63 N -4.57 2.20 0.00 0.00 8.00 -1.26 -2.59 116.55 118.33 2ju4 n ASP 63 Ca 0.17 -1.41 0.00 0.00 0.71 0.00 0.00 54.79 54.26 2ju4 n ASP 63 Cb 0.39 -0.43 0.00 0.00 -0.02 0.00 0.00 41.12 41.05 2ju4 n ASP 63 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 2ju4 n ILE 64 N 1.30 0.00 0.02 0.53 5.41 -0.30 -4.26 119.36 122.06 2ju4 n ILE 64 Ca 0.00 0.00 -0.22 0.00 1.00 0.00 0.00 62.75 63.53 2ju4 n ILE 64 Cb 0.26 0.00 -0.14 0.00 -0.71 0.00 0.00 39.64 39.04 2ju4 n ILE 64 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 176.55 177.29 2ju4 h THR 65 N 0.00 0.74 0.05 1.39 2.02 -1.54 -3.40 112.91 112.16 2ju4 h THR 65 Ca 0.00 -2.39 -0.35 0.00 0.77 0.00 0.00 66.41 64.44 2ju4 h THR 65 Cb 0.00 2.59 -0.04 0.00 -1.74 0.00 0.00 68.15 68.96 2ju4 h THR 65 CO 0.00 0.87 -1.99 1.33 0.37 0.00 0.00 175.52 176.11 2ju4 n VAL 66 N -3.56 1.62 -4.34 3.16 0.24 -1.13 -5.16 118.33 109.17 2ju4 n VAL 66 Ca -0.30 -0.43 -0.17 0.00 -2.04 0.00 0.00 64.34 61.40 2ju4 n VAL 66 Cb 1.04 -1.78 -0.10 0.00 -1.47 0.00 0.00 33.84 31.53 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 -2.49 0.63 -0.08 1.34 1.01 -1.24 -5.09 121.20 115.27 2ju4 s ILE 67 Ca -0.29 -2.00 0.16 0.00 0.00 0.00 0.00 60.65 58.52 2ju4 s ILE 67 Cb 0.08 -2.65 -0.24 0.00 0.01 0.00 0.00 42.46 39.67 2ju4 s ILE 67 CO 0.65 0.00 0.37 -2.65 0.00 0.00 0.00 174.94 173.31 2ju4 n PRO 69 N -0.51 0.61 0.00 2.79 -0.02 -1.26 -3.24 135.00 133.37 2ju4 n PRO 69 Ca -0.00 -0.13 0.00 0.00 -2.02 0.00 0.00 63.50 61.35 2ju4 n PRO 69 Cb 0.66 -1.36 0.02 0.00 -0.02 0.00 0.00 33.50 32.80 2ju4 n PRO 69 CO 0.00 0.00 0.00 1.87 1.98 0.00 0.00 175.50 179.35 2ju4 n TRP 70 N -1.98 0.00 -0.05 6.00 -0.00 -1.26 -2.45 117.44 117.70 2ju4 n TRP 70 Ca -0.02 0.00 -0.11 0.00 -0.00 0.00 0.00 57.50 57.37 2ju4 n TRP 70 Cb 0.39 -0.14 -0.04 0.00 -0.00 0.00 0.00 31.31 31.52 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 -1.14 0.28 -0.14 5.87 1.02 -1.26 -3.34 120.64 121.94 2ju4 n GLU 71 Ca 0.00 0.12 0.00 0.00 -0.02 0.00 0.00 57.16 57.26 2ju4 n GLU 71 Cb 0.00 -0.98 0.00 0.00 -0.02 0.00 0.00 31.44 30.44 2ju4 n GLU 71 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2ju4 n ALA 72 N -3.75 2.25 -1.00 0.62 0.00 -1.02 -4.63 120.51 112.96 2ju4 n ALA 72 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.24 2ju4 n ALA 72 Cb 0.54 -1.54 0.00 0.00 0.00 0.00 0.00 19.45 18.45 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 1.64 -0.11 0.00 0.00 5.03 -1.26 -5.11 115.26 115.45 2ju4 n ASN 74 Ca 0.00 -0.08 0.00 0.00 0.87 0.00 0.00 54.58 55.37 2ju4 n ASN 74 Cb 0.17 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 38.93 2ju4 n ASN 74 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2ju4 n HIS 75 N -0.68 0.00 0.00 3.10 1.44 -1.21 -4.38 115.22 113.49 2ju4 n HIS 75 Ca 0.00 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.71 2ju4 n HIS 75 Cb 0.00 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.11 2ju4 n HIS 75 CO 0.00 0.00 0.00 -1.91 -2.81 0.00 0.00 176.34 171.62 2ju4 n GLU 77 N -0.58 0.00 -0.06 -1.40 2.13 -1.26 -5.07 120.64 114.41 2ju4 n GLU 77 Ca 0.00 0.00 -0.01 0.00 0.66 0.00 0.00 57.16 57.81 2ju4 n GLU 77 Cb 0.00 0.00 0.25 0.00 0.27 0.00 0.00 31.44 31.96 2ju4 n GLU 77 CO 0.00 0.00 0.00 -0.07 -0.41 0.00 0.00 177.13 176.65 2ju4 h LEU 78 N 0.00 0.62 0.00 4.31 3.38 -2.06 -3.43 115.31 118.13 2ju4 h LEU 78 Ca 0.00 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.85 2ju4 h LEU 78 Cb 0.00 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.59 2ju4 h LEU 78 CO 0.00 0.66 0.00 1.41 0.09 0.00 0.00 178.44 180.60 2ju4 n HIS 79 N -4.27 0.00 0.00 1.13 8.25 -1.26 -5.03 115.22 114.03 2ju4 n HIS 79 Ca 0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.48 2ju4 n HIS 79 Cb 0.24 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.35 2ju4 n HIS 79 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 2ju4 n GLU 80 N -1.45 0.00 -1.04 -0.41 4.71 -1.26 0.49 120.64 121.68 2ju4 n GLU 80 Ca 0.00 0.00 -0.08 0.00 -0.01 0.00 0.00 57.16 57.07 2ju4 n GLU 80 Cb 0.00 0.00 0.28 0.00 -1.01 0.00 0.00 31.44 30.71 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 0.00 6.14 -4.35 -4.62 7.99 -1.26 -4.86 117.00 116.04 2ju4 n LEU 81 Ca 0.00 -3.21 -0.25 0.00 -0.01 0.00 0.00 56.01 52.55 2ju4 n LEU 81 Cb 0.00 -0.76 -0.10 0.00 -0.11 0.00 0.00 43.42 42.45 2ju4 n LEU 81 CO 0.00 0.83 1.33 0.00 -1.51 0.00 0.00 177.39 178.04 2ju4 n ALA 82 N -0.25 0.99 -0.03 -1.18 0.00 0.18 -4.68 120.51 115.53 2ju4 n ALA 82 Ca 0.43 -2.61 -0.10 0.00 0.00 0.00 0.00 53.44 51.16 2ju4 n ALA 82 Cb 1.41 -3.47 -0.04 0.00 0.00 0.00 0.00 19.45 17.36 2ju4 n ALA 82 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 2ju4 h GLN 83 N 10.58 0.23 0.00 0.00 4.15 -1.89 -3.46 115.11 124.72 2ju4 h GLN 83 Ca 0.13 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.54 2ju4 h GLN 83 Cb 0.91 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.55 2ju4 h GLN 83 CO 1.29 0.16 0.00 0.66 -1.93 0.00 0.00 178.83 179.01 2ju4 n TYR 84 N -4.96 -3.05 -0.79 3.99 4.01 -1.26 -4.94 117.16 110.14 2ju4 n TYR 84 Ca -0.04 0.65 -0.12 0.00 -0.16 0.00 0.00 57.90 58.23 2ju4 n TYR 84 Cb 0.03 1.84 -0.12 0.00 -0.31 0.00 0.00 39.34 40.79 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 -1.27 2.66 0.00 2.72 0.00 -1.26 -5.27 105.19 102.77 2ju4 n GLY 85 Ca 0.00 -0.95 0.00 0.00 0.00 0.00 0.00 46.02 45.07 2ju4 n GLY 85 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83