#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jo0 n SER 2 N 0.00 -1.09 -4.65 7.83 7.64 -1.26 -5.03 113.62 117.06 2jo0 n SER 2 Ca 0.00 0.43 -0.29 0.00 1.01 0.00 0.00 58.87 60.02 2jo0 n SER 2 Cb 0.00 -1.30 0.18 0.00 -1.01 0.00 0.00 64.21 62.08 2jo0 n SER 2 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2jo0 s PRO 3 N -3.70 0.49 -1.48 1.43 0.04 -1.26 -4.94 135.00 125.58 2jo0 s PRO 3 Ca 0.62 0.80 -0.10 0.00 0.04 0.00 0.00 61.00 62.36 2jo0 s PRO 3 Cb -0.25 -1.72 0.02 0.00 0.04 0.00 0.00 34.50 32.59 2jo0 s PRO 3 CO 0.62 -2.76 2.50 0.25 0.04 0.00 0.00 177.00 177.64 2jo0 n THR 4 N -4.24 4.19 -1.63 1.26 -2.24 -1.26 -4.98 114.28 105.39 2jo0 n THR 4 Ca 0.06 -3.23 -0.50 0.00 -2.27 0.00 0.00 64.05 58.11 2jo0 n THR 4 Cb 0.55 -2.50 -0.05 0.00 -2.10 0.00 0.00 70.33 66.23 2jo0 n THR 4 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2jo0 n SER 5 N 4.13 2.29 -0.17 3.42 7.64 -1.26 -4.78 113.62 124.88 2jo0 n SER 5 Ca 0.62 1.10 0.21 0.00 1.01 0.00 0.00 58.87 61.82 2jo0 n SER 5 Cb 0.30 -1.28 0.60 0.00 -1.01 0.00 0.00 64.21 62.82 2jo0 n SER 5 CO 0.00 0.00 0.00 0.16 -3.01 0.00 0.00 175.04 172.19 2jo0 h ILE 6 N 3.59 0.67 0.00 0.44 -0.00 -1.91 -2.49 117.51 117.81 2jo0 h ILE 6 Ca -0.47 -0.08 0.00 0.00 -0.00 0.00 0.00 64.86 64.32 2jo0 h ILE 6 Cb 1.30 0.43 0.00 0.00 -0.00 0.00 0.00 36.82 38.55 2jo0 h ILE 6 CO 0.83 0.04 0.00 0.00 -0.00 0.00 0.00 178.15 179.02 2jo0 n LEU 7 N -4.42 0.00 0.09 0.16 -0.00 -1.26 -1.23 117.00 110.34 2jo0 n LEU 7 Ca 0.17 0.00 -0.04 0.00 -0.00 0.00 0.00 56.01 56.14 2jo0 n LEU 7 Cb 0.72 0.00 -0.04 0.00 -0.00 0.00 0.00 43.42 44.11 2jo0 n LEU 7 CO 0.34 0.00 0.27 -0.78 -0.00 0.00 0.00 177.39 177.22 2jo0 h ASP 8 N 0.00 0.00 -5.05 1.45 3.58 -1.81 -3.49 116.42 111.10 2jo0 h ASP 8 Ca 0.00 0.00 -0.35 0.00 0.42 0.00 0.00 57.03 57.10 2jo0 h ASP 8 Cb 0.00 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.03 2jo0 h ASP 8 CO 0.00 0.83 -0.15 2.30 -2.88 0.00 0.00 179.24 179.34 2jo0 n ILE 9 N -3.39 0.00 -1.68 2.25 -5.35 -0.37 -5.07 119.36 105.76 2jo0 n ILE 9 Ca 0.00 -1.32 -0.47 0.00 -0.27 0.00 0.00 62.75 60.68 2jo0 n ILE 9 Cb 0.84 -0.28 -0.04 0.00 -1.74 0.00 0.00 39.64 38.42 2jo0 n ILE 9 CO 0.00 0.00 0.00 -2.11 -1.76 0.00 0.00 176.55 172.68 2jo0 n ARG 10 N -1.37 2.17 -3.73 6.28 -4.01 -1.26 -5.01 116.66 109.72 2jo0 n ARG 10 Ca 0.00 0.79 -0.32 0.00 -1.04 0.00 0.00 57.85 57.28 2jo0 n ARG 10 Cb 0.38 -2.60 -0.05 0.00 -3.04 0.00 0.00 32.46 27.15 2jo0 n ARG 10 CO 0.00 0.00 0.00 1.14 -3.04 0.00 0.00 177.63 175.73 2jo0 s GLN 11 N 2.78 3.58 -0.45 2.89 -2.07 -1.26 -5.06 119.66 120.08 2jo0 s GLN 11 Ca 0.87 -0.15 0.05 0.00 -1.82 0.00 0.00 55.36 54.32 2jo0 s GLN 11 Cb -0.69 -2.92 0.29 0.00 -1.09 0.00 0.00 33.01 28.61 2jo0 s GLN 11 CO 0.46 0.52 1.08 0.41 -1.32 0.00 0.00 175.29 176.44 2jo0 n GLY 12 N 0.28 0.02 0.97 2.60 0.00 -1.26 -5.04 105.19 102.76 2jo0 n GLY 12 Ca -0.04 0.22 0.00 0.00 0.00 0.00 0.00 46.02 46.20 2jo0 n GLY 12 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2jo0 n PRO 13 N 0.88 0.45 0.00 1.61 -0.04 -1.26 -4.33 135.00 132.31 2jo0 n PRO 13 Ca 0.05 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.51 2jo0 n PRO 13 Cb 0.68 -1.27 0.00 0.00 -0.04 0.00 0.00 33.50 32.87 2jo0 n PRO 13 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2jo0 n LYS 14 N 0.75 0.00 -0.19 0.54 5.02 -1.26 -4.92 118.16 118.09 2jo0 n LYS 14 Ca 0.00 0.00 -0.01 0.00 -2.02 0.00 0.00 58.31 56.28 2jo0 n LYS 14 Cb 0.22 0.00 0.07 0.00 -0.02 0.00 0.00 35.03 35.30 2jo0 n LYS 14 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 2jo0 h GLU 15 N 0.00 0.04 -1.00 1.97 4.39 -1.97 -3.20 114.58 114.82 2jo0 h GLU 15 Ca 0.00 -0.00 -0.12 0.00 0.34 0.00 0.00 59.36 59.58 2jo0 h GLU 15 Cb 0.00 -0.01 -0.07 0.00 -0.10 0.00 0.00 28.75 28.57 2jo0 h GLU 15 CO 0.00 0.03 0.15 -0.35 -1.16 0.00 0.00 179.01 177.68 2jo0 n PRO 16 N -5.35 1.28 -0.32 2.33 -0.04 -1.26 -4.67 135.00 126.97 2jo0 n PRO 16 Ca 0.07 -0.68 -0.05 0.00 -0.04 0.00 0.00 63.50 62.81 2jo0 n PRO 16 Cb 0.32 -1.27 0.00 0.00 -0.04 0.00 0.00 33.50 32.51 2jo0 n PRO 16 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 2jo0 h PHE 17 N 0.23 -1.21 0.53 0.54 -1.00 -1.80 0.28 116.94 114.52 2jo0 h PHE 17 Ca 0.14 0.10 -0.03 0.00 2.81 0.00 0.00 57.97 61.00 2jo0 h PHE 17 Cb 1.42 0.65 0.01 0.00 3.61 0.00 0.00 35.95 41.64 2jo0 h PHE 17 CO 0.36 -0.40 -0.26 0.07 -1.61 0.00 0.00 178.31 176.47 2jo0 h ARG 18 N -0.08 -0.69 0.00 1.51 -0.00 -1.83 0.72 114.38 114.01 2jo0 h ARG 18 Ca 0.27 0.05 0.00 0.00 -0.00 0.00 0.00 59.98 60.30 2jo0 h ARG 18 Cb 0.56 0.16 0.00 0.00 -0.00 0.00 0.00 29.97 30.69 2jo0 h ARG 18 CO -0.87 -0.42 0.03 0.22 -0.00 0.00 0.00 179.97 178.93 2jo0 h ASP 19 N -0.81 0.00 0.00 0.08 3.58 -1.60 -2.95 116.42 114.72 2jo0 h ASP 19 Ca -0.07 0.00 -0.13 0.00 0.42 0.00 0.00 57.03 57.25 2jo0 h ASP 19 Cb 0.59 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.62 2jo0 h ASP 19 CO 0.12 0.00 -1.48 0.00 -2.88 0.00 0.00 179.24 175.00 2jo0 n TYR 20 N -2.69 0.00 -0.32 0.28 9.36 0.87 -4.59 117.16 120.06 2jo0 n TYR 20 Ca -0.02 0.00 0.03 0.00 3.32 0.00 0.00 57.90 61.23 2jo0 n TYR 20 Cb 0.08 -0.32 0.18 0.00 -0.63 0.00 0.00 39.34 38.65 2jo0 n TYR 20 CO 0.00 0.00 0.00 -0.24 0.22 0.00 0.00 176.86 176.84 2jo0 h VAL 21 N -0.00 0.96 -0.19 2.97 3.04 -0.72 0.64 116.25 122.96 2jo0 h VAL 21 Ca -0.19 -0.32 0.04 0.00 -1.01 0.00 0.00 66.70 65.23 2jo0 h VAL 21 Cb 1.29 -0.05 -0.04 0.00 -2.01 0.00 0.00 31.29 30.48 2jo0 h VAL 21 CO -0.03 0.17 -0.07 0.44 -1.01 0.00 0.00 177.57 177.07 2jo0 h ASP 22 N 0.93 -0.25 0.29 3.17 5.19 -1.76 0.34 116.42 124.32 2jo0 h ASP 22 Ca 0.42 0.07 -0.18 0.00 -0.62 0.00 0.00 57.03 56.72 2jo0 h ASP 22 Cb 0.33 0.15 -0.01 0.00 0.18 0.00 0.00 39.33 39.98 2jo0 h ASP 22 CO -0.23 -0.10 -0.73 0.03 -3.12 0.00 0.00 179.24 175.10 2jo0 h ARG 23 N -0.04 0.38 0.53 3.56 2.47 -1.67 -2.69 114.38 116.90 2jo0 h ARG 23 Ca 0.10 -0.31 -0.03 0.00 -1.26 0.00 0.00 59.98 58.48 2jo0 h ARG 23 Cb 0.19 0.06 0.01 0.00 -1.65 0.00 0.00 29.97 28.58 2jo0 h ARG 23 CO -0.22 0.95 -0.25 0.35 0.56 0.00 0.00 179.97 181.36 2jo0 h PHE 24 N 0.26 -0.66 0.00 3.04 3.04 -0.73 -3.32 116.94 118.57 2jo0 h PHE 24 Ca -0.03 -0.02 -0.02 0.00 3.98 0.00 0.00 57.97 61.89 2jo0 h PHE 24 Cb 1.30 0.22 -0.00 0.00 2.56 0.00 0.00 35.95 40.02 2jo0 h PHE 24 CO 0.04 -0.37 -0.09 1.88 -2.02 0.00 0.00 178.31 177.75 2jo0 h TYR 25 N -1.14 0.00 -0.14 0.41 0.05 -0.97 -0.55 116.97 114.63 2jo0 h TYR 25 Ca -0.07 0.00 0.04 0.00 0.05 0.00 0.00 58.73 58.75 2jo0 h TYR 25 Cb 0.58 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.32 2jo0 h TYR 25 CO 0.01 0.09 0.16 -0.22 -1.05 0.00 0.00 178.16 177.14 2jo0 h LYS 26 N 0.00 0.00 0.00 4.88 3.11 -1.57 -2.45 116.57 120.54 2jo0 h LYS 26 Ca -0.00 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.84 2jo0 h LYS 26 Cb 0.41 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.64 2jo0 h LYS 26 CO 0.01 0.00 -0.75 0.25 -2.81 0.00 0.00 179.45 176.15 2jo0 n THR 27 N -3.83 0.00 -0.32 1.00 -2.24 -0.87 -4.69 114.28 103.33 2jo0 n THR 27 Ca 0.01 0.00 0.06 0.00 -2.27 0.00 0.00 64.05 61.84 2jo0 n THR 27 Cb 0.27 -0.15 0.21 0.00 -2.10 0.00 0.00 70.33 68.56 2jo0 n THR 27 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 2jo0 h LEU 28 N 0.00 0.75 0.00 3.22 7.12 -1.19 -1.18 115.31 124.04 2jo0 h LEU 28 Ca 0.00 0.06 0.00 0.00 0.13 0.00 0.00 57.88 58.07 2jo0 h LEU 28 Cb 0.35 -0.09 0.00 0.00 -0.53 0.00 0.00 40.66 40.39 2jo0 h LEU 28 CO 0.00 0.40 0.00 -2.11 -0.13 0.00 0.00 178.44 176.60 2jo0 n ARG 29 N -4.72 0.00 0.07 1.25 -4.01 -0.92 -1.71 116.66 106.62 2jo0 n ARG 29 Ca 0.17 0.20 -0.02 0.00 -1.04 0.00 0.00 57.85 57.15 2jo0 n ARG 29 Cb 0.34 -1.50 0.25 0.00 -3.04 0.00 0.00 32.46 28.51 2jo0 n ARG 29 CO 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 177.63 174.59 2jo0 h ALA 30 N 1.98 1.18 0.00 2.89 0.00 -1.50 -3.19 119.26 120.63 2jo0 h ALA 30 Ca 0.00 -0.35 -0.13 0.00 0.00 0.00 0.00 54.91 54.43 2jo0 h ALA 30 Cb 0.00 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 2jo0 h ALA 30 CO 0.00 0.53 -1.33 0.39 0.00 0.00 0.00 179.25 178.84 2jo0 n GLU 31 N -4.11 0.20 0.20 0.00 -0.58 -0.69 -4.70 120.64 110.96 2jo0 n GLU 31 Ca -0.01 0.09 0.10 0.00 -0.42 0.00 0.00 57.16 56.91 2jo0 n GLU 31 Cb 0.41 -0.84 0.23 0.00 -0.57 0.00 0.00 31.44 30.67 2jo0 n GLU 31 CO 0.00 0.00 0.00 1.96 -0.48 0.00 0.00 177.13 178.61 2jo0 h GLN 32 N -0.34 0.00 -0.93 3.49 7.50 -1.63 -3.47 115.11 119.73 2jo0 h GLN 32 Ca -0.20 0.00 -0.02 0.00 0.50 0.00 0.00 58.65 58.93 2jo0 h GLN 32 Cb 1.06 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 28.58 2jo0 h GLN 32 CO -0.12 0.18 -0.02 0.00 -1.50 0.00 0.00 178.83 177.36 2jo0 n ALA 33 N -2.15 -0.02 -3.23 3.87 0.00 -1.20 -4.83 120.51 112.94 2jo0 n ALA 33 Ca 0.02 0.02 -0.02 0.00 0.00 0.00 0.00 53.44 53.46 2jo0 n ALA 33 Cb 0.55 -0.30 -0.01 0.00 0.00 0.00 0.00 19.45 19.69 2jo0 n ALA 33 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2jo0 n SER 34 N 1.67 0.19 -2.69 0.00 2.88 -1.26 -5.01 113.62 109.39 2jo0 n SER 34 Ca -0.01 -1.22 -0.07 0.00 -1.33 0.00 0.00 58.87 56.24 2jo0 n SER 34 Cb 0.06 0.15 0.06 0.00 -0.75 0.00 0.00 64.21 63.73 2jo0 n SER 34 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 2jo0 n GLN 35 N -0.07 1.25 -4.28 -1.46 -0.06 -1.26 -4.88 117.38 106.62 2jo0 n GLN 35 Ca 0.00 -2.86 -0.23 0.00 -2.00 0.00 0.00 57.00 51.91 2jo0 n GLN 35 Cb 0.06 -0.94 -0.07 0.00 -4.06 0.00 0.00 30.24 25.23 2jo0 n GLN 35 CO 0.00 0.00 0.00 -2.00 -0.20 0.00 0.00 177.06 174.86 2jo0 s GLU 36 N -2.31 2.31 0.63 3.69 2.12 -1.26 -5.01 118.70 118.86 2jo0 s GLU 36 Ca 0.25 -1.42 0.21 0.00 0.36 0.00 0.00 54.97 54.37 2jo0 s GLU 36 Cb 0.43 -2.17 0.93 0.00 0.26 0.00 0.00 34.13 33.58 2jo0 s GLU 36 CO -0.01 0.35 1.46 0.28 -0.54 0.00 0.00 175.26 176.80 2jo0 h VAL 37 N 1.85 0.08 -0.09 3.70 2.07 -2.00 -0.46 116.25 121.39 2jo0 h VAL 37 Ca -0.44 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.10 2jo0 h VAL 37 Cb 1.25 0.25 -0.00 0.00 -1.52 0.00 0.00 31.29 31.27 2jo0 h VAL 37 CO 0.61 0.00 0.62 0.11 0.02 0.00 0.00 177.57 178.93 2jo0 h LYS 38 N 0.00 0.00 -0.44 1.57 1.79 -2.01 -2.50 116.57 114.98 2jo0 h LYS 38 Ca 0.22 0.00 0.12 0.00 -2.18 0.00 0.00 60.65 58.81 2jo0 h LYS 38 Cb 1.92 0.00 -0.08 0.00 -1.58 0.00 0.00 32.23 32.49 2jo0 h LYS 38 CO -0.00 0.00 0.01 -1.71 -1.08 0.00 0.00 179.45 176.67 2jo0 n ASN 39 N -2.85 -0.05 -0.27 0.86 2.85 -0.18 -1.31 115.26 114.31 2jo0 n ASN 39 Ca 0.01 0.75 0.17 0.00 -0.11 0.00 0.00 54.58 55.40 2jo0 n ASN 39 Cb 0.68 -0.27 0.46 0.00 1.24 0.00 0.00 39.78 41.88 2jo0 n ASN 39 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2jo0 h ALA 40 N 0.89 2.07 -0.85 5.20 0.00 -1.73 -2.37 119.26 122.46 2jo0 h ALA 40 Ca 0.27 0.03 -0.49 0.00 0.00 0.00 0.00 54.91 54.72 2jo0 h ALA 40 Cb 0.55 -0.05 -0.27 0.00 0.00 0.00 0.00 17.79 18.03 2jo0 h ALA 40 CO -0.42 -0.37 0.47 0.00 0.00 0.00 0.00 179.25 178.94 2jo0 n MET 41 N -4.56 2.33 -4.21 0.00 0.00 -0.43 -4.95 117.12 105.30 2jo0 n MET 41 Ca 0.20 -3.17 -0.16 0.00 0.00 0.00 0.00 57.70 54.56 2jo0 n MET 41 Cb 0.65 -2.13 -0.08 0.00 0.00 0.00 0.00 33.22 31.66 2jo0 n MET 41 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 175.97 176.92 2jo0 s THR 42 N -3.70 0.00 -1.14 3.17 -4.23 -0.89 -5.03 115.64 103.82 2jo0 s THR 42 Ca 0.56 -1.90 0.00 0.00 -1.18 0.00 0.00 61.69 59.17 2jo0 s THR 42 Cb 0.47 -2.51 0.00 0.00 1.34 0.00 0.00 72.50 71.80 2jo0 s THR 42 CO 0.05 0.00 0.89 -1.84 -0.54 0.00 0.00 174.62 173.19 2jo0 n GLU 43 N -0.50 0.00 -0.26 3.99 0.00 -1.26 -4.62 120.64 118.00 2jo0 n GLU 43 Ca 0.04 0.39 -0.23 0.00 0.00 0.00 0.00 57.16 57.37 2jo0 n GLU 43 Cb 0.63 -1.52 -0.06 0.00 0.00 0.00 0.00 31.44 30.50 2jo0 n GLU 43 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.13 179.54 2jo0 n THR 44 N -1.39 0.00 0.00 3.84 -1.04 -1.26 -4.81 114.28 109.62 2jo0 n THR 44 Ca 0.00 -0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2jo0 n THR 44 Cb 0.02 -1.74 0.00 0.00 -1.82 0.00 0.00 70.33 66.79 2jo0 n THR 44 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 2jo0 n LEU 45 N 7.00 0.00 -3.55 -4.42 4.32 -1.26 -4.73 117.00 114.36 2jo0 n LEU 45 Ca 0.24 0.18 -0.09 0.00 -0.02 0.00 0.00 56.01 56.32 2jo0 n LEU 45 Cb 0.21 -0.18 -0.02 0.00 -1.62 0.00 0.00 43.42 41.81 2jo0 n LEU 45 CO 0.85 -0.18 0.53 -1.48 -1.22 0.00 0.00 177.39 175.89 2jo0 s LEU 46 N -2.27 -0.41 0.18 2.23 -0.00 -1.26 -4.81 118.68 112.33 2jo0 s LEU 46 Ca 0.00 -0.14 -0.11 0.00 -0.00 0.00 0.00 54.13 53.88 2jo0 s LEU 46 Cb 0.00 2.40 -0.00 0.00 -0.00 0.00 0.00 46.19 48.59 2jo0 s LEU 46 CO 0.00 -0.92 0.36 -0.69 -0.00 0.00 0.00 176.35 175.10 2jo0 s VAL 47 N -3.54 0.05 0.63 1.48 1.01 -1.26 -4.90 120.40 113.87 2jo0 s VAL 47 Ca 0.05 -1.28 0.15 0.00 0.00 0.00 0.00 61.98 60.91 2jo0 s VAL 47 Cb -0.02 -1.86 0.22 0.00 0.00 0.00 0.00 36.38 34.72 2jo0 s VAL 47 CO -0.07 -0.20 1.22 1.56 0.00 0.00 0.00 175.10 177.60 2jo0 h GLN 48 N 2.43 0.00 -1.84 2.72 4.20 -1.92 -1.71 115.11 118.98 2jo0 h GLN 48 Ca -0.30 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.41 2jo0 h GLN 48 Cb 1.24 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.02 2jo0 h GLN 48 CO 0.44 0.00 0.00 0.09 -0.67 0.00 0.00 178.83 178.69 2jo0 n ASN 49 N -2.93 0.78 -0.10 1.46 4.13 -1.26 -4.18 115.26 113.15 2jo0 n ASN 49 Ca 0.12 -0.65 0.00 0.00 1.68 0.00 0.00 54.58 55.73 2jo0 n ASN 49 Cb 1.23 -0.14 0.00 0.00 -1.54 0.00 0.00 39.78 39.33 2jo0 n ASN 49 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2jo0 n ALA 50 N 1.15 2.35 -0.53 5.41 0.00 -0.65 -4.72 120.51 123.52 2jo0 n ALA 50 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.16 2jo0 n ALA 50 Cb 0.11 -1.00 0.26 0.00 0.00 0.00 0.00 19.45 18.82 2jo0 n ALA 50 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2jo0 s ASN 51 N -0.93 0.81 0.14 0.00 4.22 -1.26 -4.59 114.94 113.33 2jo0 s ASN 51 Ca 0.00 1.48 -0.12 0.00 -2.14 0.00 0.00 52.86 52.08 2jo0 s ASN 51 Cb 0.00 -2.29 -0.02 0.00 1.28 0.00 0.00 41.25 40.22 2jo0 s ASN 51 CO 0.00 -4.30 1.53 1.55 -2.04 0.00 0.00 177.10 173.84 2jo0 h PRO 52 N -2.69 0.85 0.41 3.55 0.13 -1.94 -2.98 132.00 129.33 2jo0 h PRO 52 Ca -0.63 -0.35 -0.02 0.00 -0.87 0.00 0.00 66.00 64.13 2jo0 h PRO 52 Cb 1.34 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.44 2jo0 h PRO 52 CO 0.51 0.99 -0.20 -0.44 -0.23 0.00 0.00 178.00 178.63 2jo0 h ASP 53 N 0.68 -0.47 -0.50 1.44 5.19 -1.94 -0.06 116.42 120.75 2jo0 h ASP 53 Ca 0.10 -0.12 0.08 0.00 -0.62 0.00 0.00 57.03 56.48 2jo0 h ASP 53 Cb 0.71 0.12 -0.10 0.00 0.18 0.00 0.00 39.33 40.24 2jo0 h ASP 53 CO 0.05 -0.09 -0.40 0.00 -3.12 0.00 0.00 179.24 175.69 2jo0 h LYS 55 N -0.25 0.29 0.00 0.00 6.56 -1.36 0.30 116.57 122.11 2jo0 h LYS 55 Ca 0.18 -0.02 0.00 0.00 -1.06 0.00 0.00 60.65 59.75 2jo0 h LYS 55 Cb 0.56 -0.07 0.00 0.00 -0.57 0.00 0.00 32.23 32.16 2jo0 h LYS 55 CO -0.63 0.19 0.22 1.15 -2.06 0.00 0.00 179.45 178.32 2jo0 h THR 56 N 0.30 0.00 0.00 -0.16 2.02 -0.26 -1.28 112.91 113.53 2jo0 h THR 56 Ca 0.29 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.47 2jo0 h THR 56 Cb 0.39 0.72 0.00 0.00 -1.74 0.00 0.00 68.15 67.52 2jo0 h THR 56 CO -0.34 0.00 -0.59 -0.38 0.37 0.00 0.00 175.52 174.57 2jo0 n ILE 57 N -2.84 0.92 0.26 3.11 5.41 0.72 -4.49 119.36 122.45 2jo0 n ILE 57 Ca -0.02 0.28 0.16 0.00 1.00 0.00 0.00 62.75 64.17 2jo0 n ILE 57 Cb 0.27 -2.02 0.74 0.00 -0.71 0.00 0.00 39.64 37.91 2jo0 n ILE 57 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 2jo0 h LEU 58 N -0.61 0.00 -0.88 1.39 4.07 -0.65 -0.18 115.31 118.45 2jo0 h LEU 58 Ca 0.00 0.00 0.36 0.00 0.08 0.00 0.00 57.88 58.32 2jo0 h LEU 58 Cb 0.59 0.00 -0.16 0.00 1.08 0.00 0.00 40.66 42.17 2jo0 h LEU 58 CO 0.00 0.00 0.43 0.29 -1.08 0.00 0.00 178.44 178.08 2jo0 n LYS 59 N -3.09 -0.05 0.00 1.13 4.76 -0.49 -1.63 118.16 118.79 2jo0 n LYS 59 Ca 0.01 1.22 0.00 0.00 -2.87 0.00 0.00 58.31 56.67 2jo0 n LYS 59 Cb 0.51 -2.16 0.00 0.00 -1.84 0.00 0.00 35.03 31.54 2jo0 n LYS 59 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2jo0 n ALA 60 N -2.43 1.82 -2.16 7.82 0.00 -0.15 -4.83 120.51 120.58 2jo0 n ALA 60 Ca 0.32 -0.50 -0.20 0.00 0.00 0.00 0.00 53.44 53.06 2jo0 n ALA 60 Cb 1.09 0.00 0.02 0.00 0.00 0.00 0.00 19.45 20.57 2jo0 n ALA 60 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 2jo0 n LEU 61 N -0.10 4.37 -2.69 0.00 0.00 -0.65 -4.76 117.00 113.18 2jo0 n LEU 61 Ca 0.00 -4.48 -0.31 0.00 0.00 0.00 0.00 56.01 51.22 2jo0 n LEU 61 Cb 0.13 -0.21 0.01 0.00 0.00 0.00 0.00 43.42 43.35 2jo0 n LEU 61 CO 0.00 1.94 0.63 0.61 0.00 0.00 0.00 177.39 180.56 2jo0 n GLY 62 N -0.68 5.84 1.44 -3.96 0.00 -1.05 -4.07 105.19 102.70 2jo0 n GLY 62 Ca 0.38 -2.68 0.00 0.00 0.00 0.00 0.00 46.02 43.72 2jo0 n GLY 62 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2jo0 n PRO 63 N -0.46 0.82 -1.34 1.61 -0.04 -1.26 -4.78 135.00 129.55 2jo0 n PRO 63 Ca 0.43 0.00 -0.13 0.00 -0.04 0.00 0.00 63.50 63.76 2jo0 n PRO 63 Cb 0.50 -1.09 -0.06 0.00 -0.04 0.00 0.00 33.50 32.81 2jo0 n PRO 63 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2jo0 n ALA 64 N 1.34 -0.20 0.12 0.55 0.00 -1.26 -4.51 120.51 116.55 2jo0 n ALA 64 Ca 0.00 0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.65 2jo0 n ALA 64 Cb 0.41 -1.71 0.00 0.00 0.00 0.00 0.00 19.45 18.15 2jo0 n ALA 64 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jo0 n ALA 65 N 1.07 1.76 0.09 0.00 0.00 -1.26 -4.93 120.51 117.23 2jo0 n ALA 65 Ca -0.13 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.36 2jo0 n ALA 65 Cb 0.57 0.00 0.27 0.00 0.00 0.00 0.00 19.45 20.28 2jo0 n ALA 65 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2jo0 n THR 66 N -3.14 1.26 -0.33 0.00 -1.04 -1.26 -1.24 114.28 108.52 2jo0 n THR 66 Ca 0.00 0.63 0.05 0.00 -2.04 0.00 0.00 64.05 62.69 2jo0 n THR 66 Cb 0.00 -1.63 0.21 0.00 -1.82 0.00 0.00 70.33 67.09 2jo0 n THR 66 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 2jo0 h LEU 67 N 0.00 0.81 -0.89 -4.42 6.46 -1.92 -2.40 115.31 112.95 2jo0 h LEU 67 Ca 0.00 0.05 0.24 0.00 -0.12 0.00 0.00 57.88 58.05 2jo0 h LEU 67 Cb 0.20 -0.11 -0.13 0.00 -0.73 0.00 0.00 40.66 39.88 2jo0 h LEU 67 CO 0.00 0.44 0.33 -0.33 -0.62 0.00 0.00 178.44 178.26 2jo0 h GLU 68 N 0.90 0.29 -0.26 1.25 5.08 -1.55 0.35 114.58 120.64 2jo0 h GLU 68 Ca 0.46 -0.02 -0.18 0.00 -1.00 0.00 0.00 59.36 58.62 2jo0 h GLU 68 Cb 0.44 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.63 2jo0 h GLU 68 CO -0.26 0.19 -0.56 1.05 -1.00 0.00 0.00 179.01 178.43 2jo0 h GLU 69 N 0.30 0.83 0.00 2.33 4.11 -1.66 -3.33 114.58 117.15 2jo0 h GLU 69 Ca 0.57 -0.55 -0.07 0.00 0.07 0.00 0.00 59.36 59.38 2jo0 h GLU 69 Cb 1.15 0.07 -0.01 0.00 0.50 0.00 0.00 28.75 30.46 2jo0 h GLU 69 CO -0.60 1.18 -0.34 0.52 0.07 0.00 0.00 179.01 179.85 2jo0 h MET 70 N 0.60 0.00 -0.88 1.06 2.86 -0.02 0.34 114.93 118.88 2jo0 h MET 70 Ca 0.00 0.00 0.08 0.00 -2.06 0.00 0.00 59.70 57.72 2jo0 h MET 70 Cb 1.17 0.00 -0.07 0.00 0.06 0.00 0.00 31.60 32.76 2jo0 h MET 70 CO 0.12 0.34 0.54 1.98 1.06 0.00 0.00 176.91 180.95 2jo0 h MET 71 N 0.00 0.91 0.20 1.72 1.85 -0.70 -3.15 114.93 115.76 2jo0 h MET 71 Ca -0.00 -0.05 -0.35 0.00 -0.61 0.00 0.00 59.70 58.68 2jo0 h MET 71 Cb 0.67 -0.21 0.01 0.00 0.43 0.00 0.00 31.60 32.51 2jo0 h MET 71 CO 0.04 0.60 -1.71 1.15 -0.40 0.00 0.00 176.91 176.60 2jo0 h THR 72 N 0.94 0.99 -0.95 -0.77 2.02 -1.25 -3.43 112.91 110.46 2jo0 h THR 72 Ca 0.40 -2.54 0.20 0.00 0.77 0.00 0.00 66.41 65.24 2jo0 h THR 72 Cb 0.27 2.81 -0.08 0.00 -1.74 0.00 0.00 68.15 69.41 2jo0 h THR 72 CO -0.21 0.85 0.61 0.00 0.37 0.00 0.00 175.52 177.14 2jo0 h ALA 73 N 0.11 2.00 -0.72 6.16 0.00 -0.36 -2.16 119.26 124.30 2jo0 h ALA 73 Ca -0.33 0.04 -0.30 0.00 0.00 0.00 0.00 54.91 54.32 2jo0 h ALA 73 Cb 2.11 -0.05 -0.18 0.00 0.00 0.00 0.00 17.79 19.67 2jo0 h ALA 73 CO 0.20 -0.32 0.32 0.00 0.00 0.00 0.00 179.25 179.44 2jo0 s GLN 75 N -3.15 2.19 0.00 0.00 -2.07 -0.82 -3.49 119.66 112.33 2jo0 s GLN 75 Ca 0.53 -0.05 0.00 0.00 -1.82 0.00 0.00 55.36 54.02 2jo0 s GLN 75 Cb 0.44 -4.97 0.00 0.00 -1.09 0.00 0.00 33.01 27.39 2jo0 s GLN 75 CO 0.09 -3.81 0.00 0.41 -1.32 0.00 0.00 175.29 170.66 2jo0 n GLY 76 N 6.80 2.32 2.61 2.60 0.00 -1.26 -4.87 105.19 113.39 2jo0 n GLY 76 Ca 0.43 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.18 2jo0 n GLY 76 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2jo0 n VAL 77 N -0.16 2.66 0.00 1.61 0.31 -1.23 -4.36 118.33 117.16 2jo0 n VAL 77 Ca 0.00 -1.65 0.00 0.00 -0.01 0.00 0.00 64.34 62.68 2jo0 n VAL 77 Cb 0.00 -2.22 0.00 0.00 -0.91 0.00 0.00 33.84 30.71 2jo0 n VAL 77 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2jo0 n GLY 78 N 3.81 -1.17 0.00 2.92 0.00 -1.26 -4.68 105.19 104.80 2jo0 n GLY 78 Ca 0.50 0.85 0.00 0.00 0.00 0.00 0.00 46.02 47.36 2jo0 n GLY 78 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jo0 n GLY 79 N 0.00 1.90 1.83 -0.02 0.00 -1.26 -4.64 105.19 102.99 2jo0 n GLY 79 Ca 0.00 -2.16 -0.08 0.00 0.00 0.00 0.00 46.02 43.77 2jo0 n GLY 79 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2jo0 n PRO 80 N -1.16 1.63 -3.80 1.61 -0.04 -1.26 -4.75 135.00 127.23 2jo0 n PRO 80 Ca 0.00 -0.69 -0.24 0.00 -0.04 0.00 0.00 63.50 62.54 2jo0 n PRO 80 Cb 0.00 -1.61 0.01 0.00 -0.04 0.00 0.00 33.50 31.86 2jo0 n PRO 80 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2jo0 n GLY 81 N 1.99 -0.31 2.33 0.55 0.00 -1.26 -2.80 105.19 105.68 2jo0 n GLY 81 Ca 0.26 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.45 2jo0 n GLY 81 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 173.32 170.93 2jo0 n HIS 82 N -4.31 0.00 -0.93 1.61 1.44 -1.26 -4.84 115.22 106.93 2jo0 n HIS 82 Ca -0.29 0.00 -0.29 0.00 -2.01 0.00 0.00 57.72 55.13 2jo0 n HIS 82 Cb 0.68 -0.74 -0.03 0.00 0.12 0.00 0.00 29.99 30.02 2jo0 n HIS 82 CO 0.00 0.00 0.00 1.17 -2.81 0.00 0.00 176.34 174.70 2jo0 n LYS 83 N 0.32 2.11 -0.81 -1.40 4.81 -1.12 -4.84 118.16 117.22 2jo0 n LYS 83 Ca 0.00 -1.66 0.00 0.00 -0.87 0.00 0.00 58.31 55.78 2jo0 n LYS 83 Cb 0.04 -2.63 0.00 0.00 0.02 0.00 0.00 35.03 32.46 2jo0 n LYS 83 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2jo0 n ALA 84 N 5.04 0.00 -3.06 3.14 0.00 -1.26 -4.99 120.51 119.37 2jo0 n ALA 84 Ca 0.49 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.83 2jo0 n ALA 84 Cb 0.22 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.62 2jo0 n ALA 84 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2jo0 s ARG 85 N -0.22 1.28 0.00 0.00 6.06 -1.26 -5.05 118.95 119.75 2jo0 s ARG 85 Ca 0.00 -0.98 0.00 0.00 -2.50 0.00 0.00 55.73 52.25 2jo0 s ARG 85 Cb 0.00 0.46 0.00 0.00 0.06 0.00 0.00 34.95 35.47 2jo0 s ARG 85 CO 0.00 -0.51 0.00 1.55 -2.50 0.00 0.00 175.30 173.84 2jo0 n VAL 86 N -0.28 0.00 -1.16 7.11 3.14 -1.26 -5.27 118.33 120.61 2jo0 n VAL 86 Ca -0.09 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.29 2jo0 n VAL 86 Cb 0.63 -0.03 0.00 0.00 -1.06 0.00 0.00 33.84 33.37 2jo0 n VAL 86 CO 0.00 0.00 0.00 0.18 -6.46 0.00 0.00 176.83 170.55