#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 -6.87 0.00 7.83 7.64 -1.26 -5.01 113.62 115.95 2jo0 n SER 2 Ca 0.00 1.31 0.00 0.00 1.01 0.00 0.00 58.87 61.19 2jo0 n SER 2 Cb 0.00 -4.34 0.00 0.00 -1.01 0.00 0.00 64.21 58.86 2jo0 n SER 2 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 2jo0 n PRO 3 N -3.93 0.00 -2.84 1.43 -0.04 -1.26 -4.96 135.00 123.40 2jo0 n PRO 3 Ca -0.08 0.04 -0.17 0.00 -0.04 0.00 0.00 63.50 63.25 2jo0 n PRO 3 Cb 0.59 -0.28 -0.00 0.00 -0.04 0.00 0.00 33.50 33.77 2jo0 n PRO 3 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 2jo0 n THR 4 N -1.56 1.10 0.00 0.52 -1.04 -1.26 -4.96 114.28 107.09 2jo0 n THR 4 Ca 0.00 -4.17 0.00 0.00 -2.04 0.00 0.00 64.05 57.84 2jo0 n THR 4 Cb 0.00 -0.20 0.00 0.00 -1.82 0.00 0.00 70.33 68.31 2jo0 n THR 4 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 2jo0 n SER 5 N -0.04 0.00 0.10 8.00 7.64 -1.26 -3.64 113.62 124.42 2jo0 n SER 5 Ca 0.22 0.00 -0.12 0.00 1.01 0.00 0.00 58.87 59.97 2jo0 n SER 5 Cb 0.69 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.83 2jo0 n SER 5 CO 0.00 0.00 0.00 -0.29 -3.01 0.00 0.00 175.04 171.74 2jo0 h ILE 6 N 0.00 0.52 0.00 0.44 6.09 -1.96 -0.60 117.51 122.00 2jo0 h ILE 6 Ca 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.49 2jo0 h ILE 6 Cb 0.00 0.52 0.00 0.00 0.47 0.00 0.00 36.82 37.81 2jo0 h ILE 6 CO 0.00 0.00 0.00 0.00 -3.07 0.00 0.00 178.15 175.08 2jo0 n LEU 7 N -5.34 0.59 0.00 2.19 -0.00 -1.24 -1.57 117.00 111.63 2jo0 n LEU 7 Ca -0.06 -0.29 0.00 0.00 -0.00 0.00 0.00 56.01 55.65 2jo0 n LEU 7 Cb 0.25 -0.29 0.00 0.00 -0.00 0.00 0.00 43.42 43.38 2jo0 n LEU 7 CO 0.26 0.15 -0.32 -0.67 -0.00 0.00 0.00 177.39 176.81 2jo0 n ASP 8 N 0.13 1.55 -0.16 1.45 2.03 -1.06 -4.58 116.55 115.91 2jo0 n ASP 8 Ca 0.00 0.00 0.01 0.00 0.52 0.00 0.00 54.79 55.32 2jo0 n ASP 8 Cb 0.15 0.00 0.02 0.00 -0.72 0.00 0.00 41.12 40.56 2jo0 n ASP 8 CO 0.00 0.00 0.00 2.30 -1.92 0.00 0.00 177.20 177.58 2jo0 n ILE 9 N -2.42 0.06 0.14 5.18 -5.35 -0.26 -4.67 119.36 112.05 2jo0 n ILE 9 Ca 0.00 -0.05 0.03 0.00 -0.27 0.00 0.00 62.75 62.46 2jo0 n ILE 9 Cb 0.32 -0.07 0.16 0.00 -1.74 0.00 0.00 39.64 38.31 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 -0.31 0.05 0.00 6.28 -4.01 -0.61 -4.74 116.66 113.31 2jo0 n ARG 10 Ca 0.01 0.46 0.00 0.00 -1.04 0.00 0.00 57.85 57.29 2jo0 n ARG 10 Cb 0.08 -2.13 0.00 0.00 -3.04 0.00 0.00 32.46 27.37 2jo0 n ARG 10 CO 0.00 0.00 0.00 0.94 -3.04 0.00 0.00 177.63 175.53 2jo0 n GLN 11 N -1.79 0.00 0.00 2.89 7.27 -1.26 -4.20 117.38 120.29 2jo0 n GLN 11 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.07 2jo0 n GLN 11 Cb 0.49 0.00 0.00 0.00 2.41 0.00 0.00 30.24 33.14 2jo0 n GLN 11 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2jo0 n GLY 12 N 0.00 -1.64 0.60 1.69 0.00 -1.26 -5.07 105.19 99.50 2jo0 n GLY 12 Ca 0.00 0.62 0.00 0.00 0.00 0.00 0.00 46.02 46.64 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 0.00 0.36 -0.18 1.61 -0.04 -1.26 -4.14 135.00 131.36 2jo0 n PRO 13 Ca 0.00 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.43 2jo0 n PRO 13 Cb 0.00 -1.21 0.03 0.00 -0.04 0.00 0.00 33.50 32.29 2jo0 n PRO 13 CO 0.00 0.00 0.00 0.87 -0.04 0.00 0.00 175.50 176.33 2jo0 h LYS 14 N 0.76 -0.07 0.05 0.54 1.57 -1.96 -3.33 116.57 114.14 2jo0 h LYS 14 Ca 0.00 0.00 -0.14 0.00 -1.87 0.00 0.00 60.65 58.64 2jo0 h LYS 14 Cb 0.22 0.02 -0.00 0.00 0.08 0.00 0.00 32.23 32.54 2jo0 h LYS 14 CO 0.00 -0.05 -0.71 0.93 -0.57 0.00 0.00 179.45 179.05 2jo0 h GLU 15 N -0.07 0.11 -1.96 3.15 3.07 -1.94 -3.38 114.58 113.55 2jo0 h GLU 15 Ca 0.25 -0.19 -0.21 0.00 -0.50 0.00 0.00 59.36 58.72 2jo0 h GLU 15 Cb 0.47 0.07 -0.08 0.00 -0.84 0.00 0.00 28.75 28.38 2jo0 h GLU 15 CO -0.60 1.09 -0.11 -0.35 -1.40 0.00 0.00 179.01 177.64 2jo0 n PRO 16 N -4.33 1.82 -0.27 2.33 -0.04 -1.25 -4.84 135.00 128.41 2jo0 n PRO 16 Ca -0.18 -1.03 -0.08 0.00 -0.04 0.00 0.00 63.50 62.18 2jo0 n PRO 16 Cb 0.68 -1.76 -0.07 0.00 -0.04 0.00 0.00 33.50 32.31 2jo0 n PRO 16 CO 0.00 0.00 0.00 0.35 -0.04 0.00 0.00 175.50 175.81 2jo0 h PHE 17 N 2.41 -1.28 -0.15 0.54 3.57 -1.75 0.51 116.94 120.80 2jo0 h PHE 17 Ca 0.19 0.09 -0.16 0.00 3.53 0.00 0.00 57.97 61.61 2jo0 h PHE 17 Cb 1.22 0.64 0.01 0.00 2.79 0.00 0.00 35.95 40.61 2jo0 h PHE 17 CO 1.30 -0.26 -0.55 0.07 -2.23 0.00 0.00 178.31 176.64 2jo0 h ARG 18 N -0.02 0.64 0.00 1.11 -0.00 -1.90 -0.45 114.38 113.75 2jo0 h ARG 18 Ca 0.10 -0.49 0.00 0.00 -0.00 0.00 0.00 59.98 59.60 2jo0 h ARG 18 Cb 0.29 0.09 0.00 0.00 -0.00 0.00 0.00 29.97 30.35 2jo0 h ARG 18 CO -0.62 1.11 0.00 -0.44 -0.00 0.00 0.00 179.97 180.01 2jo0 h ASP 19 N 0.30 0.00 0.00 0.08 5.19 -1.70 -3.00 116.42 117.29 2jo0 h ASP 19 Ca -0.03 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.38 2jo0 h ASP 19 Cb 1.18 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.69 2jo0 h ASP 19 CO 0.12 0.00 -1.00 0.00 -3.12 0.00 0.00 179.24 175.24 2jo0 n TYR 20 N -2.55 0.00 -0.24 4.55 4.19 0.08 -4.69 117.16 118.50 2jo0 n TYR 20 Ca 0.00 0.00 0.01 0.00 3.31 0.00 0.00 57.90 61.22 2jo0 n TYR 20 Cb 0.17 0.00 0.13 0.00 0.49 0.00 0.00 39.34 40.13 2jo0 n TYR 20 CO 0.00 0.00 0.00 -0.24 0.91 0.00 0.00 176.86 177.53 2jo0 h VAL 21 N 0.00 0.84 -1.00 2.97 3.04 -1.02 0.08 116.25 121.16 2jo0 h VAL 21 Ca 0.00 -0.20 0.15 0.00 -1.01 0.00 0.00 66.70 65.64 2jo0 h VAL 21 Cb 1.00 0.21 -0.09 0.00 -2.01 0.00 0.00 31.29 30.40 2jo0 h VAL 21 CO 0.00 0.11 0.62 -0.78 -1.01 0.00 0.00 177.57 176.51 2jo0 h ASP 22 N 0.58 0.87 0.99 3.17 3.58 -1.78 0.20 116.42 124.02 2jo0 h ASP 22 Ca 0.34 0.06 -0.19 0.00 0.42 0.00 0.00 57.03 57.67 2jo0 h ASP 22 Cb 0.36 -0.10 -0.03 0.00 1.72 0.00 0.00 39.33 41.28 2jo0 h ASP 22 CO -0.27 0.41 -0.89 0.03 -2.88 0.00 0.00 179.24 175.64 2jo0 h ARG 23 N 0.90 0.00 0.00 0.28 2.47 -1.59 -2.38 114.38 114.06 2jo0 h ARG 23 Ca 0.53 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 59.23 2jo0 h ARG 23 Cb 0.65 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.97 2jo0 h ARG 23 CO -0.30 0.89 -0.12 0.35 0.56 0.00 0.00 179.97 181.34 2jo0 h PHE 24 N 0.00 0.00 -1.00 3.04 3.57 -0.15 -3.37 116.94 119.02 2jo0 h PHE 24 Ca -0.01 0.00 0.23 0.00 3.53 0.00 0.00 57.97 61.72 2jo0 h PHE 24 Cb 1.62 0.00 -0.10 0.00 2.79 0.00 0.00 35.95 40.26 2jo0 h PHE 24 CO 0.00 0.33 0.63 1.88 -2.23 0.00 0.00 178.31 178.92 2jo0 h TYR 25 N -1.00 0.79 -0.87 0.41 -1.99 -0.76 0.43 116.97 113.97 2jo0 h TYR 25 Ca -0.02 0.03 0.25 0.00 2.00 0.00 0.00 58.73 60.99 2jo0 h TYR 25 Cb 0.37 -0.23 -0.03 0.00 2.00 0.00 0.00 36.73 38.84 2jo0 h TYR 25 CO 0.05 0.12 0.92 -0.22 -0.00 0.00 0.00 178.16 179.03 2jo0 h LYS 26 N 0.52 0.00 0.00 4.88 3.11 -1.58 -2.84 116.57 120.66 2jo0 h LYS 26 Ca 0.58 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 58.42 2jo0 h LYS 26 Cb 1.26 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.49 2jo0 h LYS 26 CO -0.32 0.00 -0.95 0.25 -2.81 0.00 0.00 179.45 175.62 2jo0 n THR 27 N -3.52 0.00 -0.33 1.00 -2.24 -0.30 -4.80 114.28 104.10 2jo0 n THR 27 Ca 0.19 0.00 0.10 0.00 -2.27 0.00 0.00 64.05 62.07 2jo0 n THR 27 Cb 1.20 -1.34 0.21 0.00 -2.10 0.00 0.00 70.33 68.31 2jo0 n THR 27 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 2jo0 n LEU 28 N -2.92 -0.21 0.02 3.22 -0.00 -0.02 -1.11 117.00 115.99 2jo0 n LEU 28 Ca 0.00 1.59 0.03 0.00 -0.00 0.00 0.00 56.01 57.63 2jo0 n LEU 28 Cb 0.47 -0.54 0.13 0.00 -0.00 0.00 0.00 43.42 43.48 2jo0 n LEU 28 CO 0.00 -1.58 0.58 -2.11 -0.00 0.00 0.00 177.39 174.29 2jo0 n ARG 29 N -5.44 0.02 0.23 1.96 -4.01 -1.08 -1.66 116.66 106.68 2jo0 n ARG 29 Ca 0.19 0.46 0.12 0.00 -1.04 0.00 0.00 57.85 57.58 2jo0 n ARG 29 Cb 0.61 -1.55 0.27 0.00 -3.04 0.00 0.00 32.46 28.75 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 2.10 0.98 0.00 2.89 0.00 -1.41 -3.11 119.26 120.71 2jo0 h ALA 30 Ca 0.00 -0.04 -0.34 0.00 0.00 0.00 0.00 54.91 54.54 2jo0 h ALA 30 Cb 0.06 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.78 2jo0 h ALA 30 CO 0.00 0.05 -2.25 0.39 0.00 0.00 0.00 179.25 177.44 2jo0 n GLU 31 N -3.11 0.53 -3.24 0.00 1.02 -0.67 -4.88 120.64 110.29 2jo0 n GLU 31 Ca 0.03 0.14 -0.25 0.00 -0.02 0.00 0.00 57.16 57.06 2jo0 n GLU 31 Cb 0.50 -1.42 -0.08 0.00 -0.02 0.00 0.00 31.44 30.42 2jo0 n GLU 31 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2jo0 n GLN 32 N -3.28 0.58 0.00 3.49 10.64 -0.72 -5.01 117.38 123.08 2jo0 n GLN 32 Ca -0.40 -3.21 0.00 0.00 -1.83 0.00 0.00 57.00 51.56 2jo0 n GLN 32 Cb 0.90 -1.33 0.00 0.00 -0.86 0.00 0.00 30.24 28.94 2jo0 n GLN 32 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2jo0 n ALA 33 N 1.78 1.19 -0.44 2.61 0.00 -1.17 -4.23 120.51 120.25 2jo0 n ALA 33 Ca 0.23 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.63 2jo0 n ALA 33 Cb 0.52 -0.97 -0.06 0.00 0.00 0.00 0.00 19.45 18.93 2jo0 n ALA 33 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2jo0 n SER 34 N 0.06 2.64 0.31 0.00 7.64 -1.26 -4.67 113.62 118.33 2jo0 n SER 34 Ca 0.00 -1.92 0.17 0.00 1.01 0.00 0.00 58.87 58.14 2jo0 n SER 34 Cb 0.00 -0.67 0.90 0.00 -1.01 0.00 0.00 64.21 63.42 2jo0 n SER 34 CO 0.00 0.00 0.00 -0.61 -3.01 0.00 0.00 175.04 171.42 2jo0 h GLN 35 N 3.98 0.00 -7.47 1.43 4.15 -1.92 -2.99 115.11 112.28 2jo0 h GLN 35 Ca 0.07 0.00 -0.42 0.00 0.77 0.00 0.00 58.65 59.07 2jo0 h GLN 35 Cb 0.69 0.00 0.19 0.00 0.21 0.00 0.00 27.48 28.57 2jo0 h GLN 35 CO 0.27 0.00 0.18 -2.00 -1.93 0.00 0.00 178.83 175.35 2jo0 s GLU 36 N -4.19 -1.01 0.62 1.69 2.12 -1.26 -4.83 118.70 111.84 2jo0 s GLU 36 Ca -0.04 -0.16 0.27 0.00 0.36 0.00 0.00 54.97 55.40 2jo0 s GLU 36 Cb 0.11 -1.63 1.40 0.00 0.26 0.00 0.00 34.13 34.27 2jo0 s GLU 36 CO 0.34 -3.56 1.81 -0.24 -0.54 0.00 0.00 175.26 173.08 2jo0 h VAL 37 N -2.47 0.20 0.00 3.70 3.04 -2.00 -1.31 116.25 117.42 2jo0 h VAL 37 Ca -0.44 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.25 2jo0 h VAL 37 Cb 1.28 0.55 0.00 0.00 -2.01 0.00 0.00 31.29 31.11 2jo0 h VAL 37 CO 0.33 0.00 0.00 0.29 -1.01 0.00 0.00 177.57 177.18 2jo0 n LYS 38 N -3.34 0.00 -0.75 4.17 5.02 -1.26 -4.81 118.16 117.20 2jo0 n LYS 38 Ca 0.06 0.00 -0.33 0.00 -2.02 0.00 0.00 58.31 56.01 2jo0 n LYS 38 Cb 0.66 -1.44 0.14 0.00 -0.02 0.00 0.00 35.03 34.37 2jo0 n LYS 38 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2jo0 n ASN 39 N -0.87 -2.54 -1.35 4.39 5.15 -0.50 -4.86 115.26 114.68 2jo0 n ASN 39 Ca 0.00 -0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 2jo0 n ASN 39 Cb 0.00 -0.95 0.00 0.00 -0.53 0.00 0.00 39.78 38.30 2jo0 n ASN 39 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2jo0 n ALA 40 N -4.08 0.00 -0.70 5.20 0.00 -1.26 -5.07 120.51 114.61 2jo0 n ALA 40 Ca 0.01 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.53 2jo0 n ALA 40 Cb 0.62 0.00 0.37 0.00 0.00 0.00 0.00 19.45 20.44 2jo0 n ALA 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jo0 n MET 41 N 0.00 4.28 0.00 0.00 0.00 -1.26 -4.64 117.12 115.49 2jo0 n MET 41 Ca 0.00 -2.94 0.00 0.00 0.00 0.00 0.00 57.70 54.76 2jo0 n MET 41 Cb 0.00 -2.08 0.00 0.00 0.00 0.00 0.00 33.22 31.14 2jo0 n MET 41 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 175.97 178.38 2jo0 n THR 42 N 0.84 0.00 0.36 3.17 -1.04 -1.26 -4.88 114.28 111.47 2jo0 n THR 42 Ca 0.26 0.00 0.02 0.00 -2.04 0.00 0.00 64.05 62.29 2jo0 n THR 42 Cb 1.03 -1.11 0.14 0.00 -1.82 0.00 0.00 70.33 68.57 2jo0 n THR 42 CO 0.00 0.00 0.00 -1.84 -0.64 0.00 0.00 175.07 172.59 2jo0 n GLU 43 N -0.44 0.18 0.00 -2.82 0.00 -1.26 -4.24 120.64 112.06 2jo0 n GLU 43 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 2jo0 n GLU 43 Cb 0.00 -1.40 0.00 0.00 0.00 0.00 0.00 31.44 30.04 2jo0 n GLU 43 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.13 177.38 2jo0 n THR 44 N -0.90 0.00 0.00 3.84 -2.24 -1.26 -4.72 114.28 109.00 2jo0 n THR 44 Ca 0.03 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.81 2jo0 n THR 44 Cb 0.02 -0.59 0.00 0.00 -2.10 0.00 0.00 70.33 67.66 2jo0 n THR 44 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2jo0 n LEU 45 N -0.16 0.00 -3.84 3.22 -0.00 -1.26 -4.73 117.00 110.24 2jo0 n LEU 45 Ca 0.00 0.13 -0.09 0.00 -0.00 0.00 0.00 56.01 56.05 2jo0 n LEU 45 Cb 0.00 -0.13 -0.04 0.00 -0.00 0.00 0.00 43.42 43.26 2jo0 n LEU 45 CO 0.00 -0.13 0.31 -1.48 -0.00 0.00 0.00 177.39 176.10 2jo0 s LEU 46 N -2.20 0.02 -0.03 1.47 -0.00 -1.26 -4.78 118.68 111.89 2jo0 s LEU 46 Ca 0.00 -0.63 0.01 0.00 -0.00 0.00 0.00 54.13 53.51 2jo0 s LEU 46 Cb 0.00 2.24 0.02 0.00 -0.00 0.00 0.00 46.19 48.45 2jo0 s LEU 46 CO 0.00 -1.17 -0.02 -0.69 -0.00 0.00 0.00 176.35 174.47 2jo0 s VAL 47 N -3.92 0.33 0.41 1.48 1.01 -1.26 -4.97 120.40 113.48 2jo0 s VAL 47 Ca 0.13 -0.03 0.16 0.00 0.00 0.00 0.00 61.98 62.25 2jo0 s VAL 47 Cb -0.02 -0.38 0.37 0.00 0.00 0.00 0.00 36.38 36.34 2jo0 s VAL 47 CO 0.03 0.17 1.87 1.56 0.00 0.00 0.00 175.10 178.73 2jo0 h GLN 48 N 7.07 0.43 0.00 2.72 4.20 -1.89 -2.11 115.11 125.53 2jo0 h GLN 48 Ca -0.40 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.29 2jo0 h GLN 48 Cb 1.15 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.83 2jo0 h GLN 48 CO 0.48 0.28 0.00 -1.71 -0.67 0.00 0.00 178.83 177.21 2jo0 n ASN 49 N -4.51 0.00 -4.74 1.46 5.15 -1.26 -4.88 115.26 106.48 2jo0 n ASN 49 Ca 0.18 -0.30 -0.42 0.00 -0.60 0.00 0.00 54.58 53.44 2jo0 n ASN 49 Cb 0.63 0.00 -0.02 0.00 -0.53 0.00 0.00 39.78 39.85 2jo0 n ASN 49 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2jo0 s ALA 50 N -2.00 3.69 0.56 5.20 0.00 -0.79 -4.85 121.76 123.56 2jo0 s ALA 50 Ca 0.02 1.39 0.06 0.00 0.00 0.00 0.00 51.96 53.42 2jo0 s ALA 50 Cb 0.01 -3.59 0.10 0.00 0.00 0.00 0.00 23.12 19.63 2jo0 s ALA 50 CO 0.01 -0.80 0.74 0.27 0.00 0.00 0.00 175.76 175.99 2jo0 n ASN 51 N 2.77 1.64 -0.12 0.00 6.94 -1.26 -5.02 115.26 120.21 2jo0 n ASN 51 Ca 0.09 -2.23 -0.11 0.00 -0.02 0.00 0.00 54.58 52.31 2jo0 n ASN 51 Cb 0.39 -0.42 -0.03 0.00 -2.36 0.00 0.00 39.78 37.36 2jo0 n ASN 51 CO 0.00 0.00 0.00 1.55 -1.03 0.00 0.00 177.26 177.78 2jo0 h PRO 52 N 0.00 0.64 0.31 -0.53 0.13 -1.97 -3.35 132.00 127.22 2jo0 h PRO 52 Ca -0.25 -0.23 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2jo0 h PRO 52 Cb 1.07 -0.04 -0.03 0.00 0.13 0.00 0.00 31.00 32.13 2jo0 h PRO 52 CO 0.33 0.79 -0.40 0.22 -0.23 0.00 0.00 178.00 178.71 2jo0 h ASP 53 N 0.43 -1.12 -0.66 1.44 3.58 -1.96 -2.87 116.42 115.26 2jo0 h ASP 53 Ca 0.09 0.11 0.10 0.00 0.42 0.00 0.00 57.03 57.74 2jo0 h ASP 53 Cb 0.54 0.39 -0.12 0.00 1.72 0.00 0.00 39.33 41.87 2jo0 h ASP 53 CO 0.03 -0.53 -0.42 0.00 -2.88 0.00 0.00 179.24 175.44 2jo0 h LYS 55 N -0.17 0.80 -0.02 0.00 6.56 -1.65 0.14 116.57 122.23 2jo0 h LYS 55 Ca 0.21 -0.05 0.01 0.00 -1.06 0.00 0.00 60.65 59.76 2jo0 h LYS 55 Cb 0.56 -0.18 -0.00 0.00 -0.57 0.00 0.00 32.23 32.04 2jo0 h LYS 55 CO -0.74 0.53 0.11 1.15 -2.06 0.00 0.00 179.45 178.44 2jo0 h THR 56 N 0.83 0.09 0.00 -0.16 2.02 -1.11 -2.92 112.91 111.65 2jo0 h THR 56 Ca 0.24 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.41 2jo0 h THR 56 Cb -0.05 0.89 -0.00 0.00 -1.74 0.00 0.00 68.15 67.24 2jo0 h THR 56 CO -0.07 0.00 -0.93 -0.38 0.37 0.00 0.00 175.52 174.51 2jo0 n ILE 57 N -3.16 1.46 0.26 3.11 5.41 0.31 -4.48 119.36 122.28 2jo0 n ILE 57 Ca -0.02 0.16 0.18 0.00 1.00 0.00 0.00 62.75 64.06 2jo0 n ILE 57 Cb 0.18 -2.24 0.92 0.00 -0.71 0.00 0.00 39.64 37.80 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 -0.88 0.00 -1.98 1.39 4.07 -1.15 0.20 115.31 116.96 2jo0 h LEU 58 Ca -0.02 0.00 0.48 0.00 0.08 0.00 0.00 57.88 58.42 2jo0 h LEU 58 Cb 0.90 0.00 -0.07 0.00 1.08 0.00 0.00 40.66 42.57 2jo0 h LEU 58 CO -0.01 0.00 1.21 0.11 -1.08 0.00 0.00 178.44 178.66 2jo0 h LYS 59 N 0.00 0.00 0.00 1.13 1.79 -1.73 -0.59 116.57 117.17 2jo0 h LYS 59 Ca 0.04 0.00 -0.01 0.00 -2.18 0.00 0.00 60.65 58.50 2jo0 h LYS 59 Cb 0.32 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 30.97 2jo0 h LYS 59 CO -0.00 0.00 -1.21 0.00 -1.08 0.00 0.00 179.45 177.16 2jo0 n ALA 60 N -2.85 2.14 -0.84 3.86 0.00 -0.08 -4.77 120.51 117.97 2jo0 n ALA 60 Ca 0.37 -0.12 -0.19 0.00 0.00 0.00 0.00 53.44 53.49 2jo0 n ALA 60 Cb 1.72 -0.12 0.15 0.00 0.00 0.00 0.00 19.45 21.20 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 -1.71 6.08 -2.09 0.00 7.94 -0.38 -4.58 117.00 122.26 2jo0 n LEU 61 Ca -0.01 -3.23 -0.27 0.00 -1.11 0.00 0.00 56.01 51.38 2jo0 n LEU 61 Cb 0.17 -0.78 0.08 0.00 0.53 0.00 0.00 43.42 43.42 2jo0 n LEU 61 CO 0.09 0.95 0.93 0.61 -1.11 0.00 0.00 177.39 178.86 2jo0 n GLY 62 N -0.84 5.86 1.57 -3.96 0.00 -0.37 -3.83 105.19 103.63 2jo0 n GLY 62 Ca 0.49 -2.23 0.00 0.00 0.00 0.00 0.00 46.02 44.28 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 -0.89 0.81 -4.11 1.61 -0.04 -1.26 -4.80 135.00 126.33 2jo0 n PRO 63 Ca 0.53 0.00 -0.34 0.00 -0.04 0.00 0.00 63.50 63.65 2jo0 n PRO 63 Cb 0.87 -1.09 -0.01 0.00 -0.04 0.00 0.00 33.50 33.23 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 1.56 -1.31 -1.00 0.55 0.00 -1.26 -4.84 120.51 114.20 2jo0 n ALA 64 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.48 2jo0 n ALA 64 Cb 0.41 -3.70 0.00 0.00 0.00 0.00 0.00 19.45 16.15 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 -4.48 1.74 0.30 0.00 0.00 -1.26 -4.94 120.51 111.86 2jo0 n ALA 65 Ca 0.04 0.00 0.16 0.00 0.00 0.00 0.00 53.44 53.64 2jo0 n ALA 65 Cb 0.51 0.00 0.80 0.00 0.00 0.00 0.00 19.45 20.76 2jo0 n ALA 65 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2jo0 h THR 66 N 0.00 0.06 -0.93 0.00 2.02 -1.88 -1.32 112.91 110.86 2jo0 h THR 66 Ca 0.00 0.00 0.27 0.00 0.77 0.00 0.00 66.41 67.45 2jo0 h THR 66 Cb 0.00 0.66 -0.16 0.00 -1.74 0.00 0.00 68.15 66.91 2jo0 h THR 66 CO 0.00 0.00 0.26 0.25 0.37 0.00 0.00 175.52 176.40 2jo0 h LEU 67 N 0.00 -0.02 -1.13 2.58 6.46 -1.93 -2.20 115.31 119.07 2jo0 h LEU 67 Ca 0.03 0.22 0.36 0.00 -0.12 0.00 0.00 57.88 58.37 2jo0 h LEU 67 Cb 0.75 0.30 -0.14 0.00 -0.73 0.00 0.00 40.66 40.83 2jo0 h LEU 67 CO -0.00 -0.23 0.64 -0.33 -0.62 0.00 0.00 178.44 177.90 2jo0 h GLU 68 N 0.15 0.22 0.08 1.25 5.08 -1.62 0.46 114.58 120.20 2jo0 h GLU 68 Ca 0.61 -0.01 -0.14 0.00 -1.00 0.00 0.00 59.36 58.82 2jo0 h GLU 68 Cb 1.32 -0.05 0.01 0.00 0.50 0.00 0.00 28.75 30.53 2jo0 h GLU 68 CO -0.72 0.15 -0.59 1.05 -1.00 0.00 0.00 179.01 177.90 2jo0 h GLU 69 N 0.23 0.27 0.00 2.33 -0.00 -1.65 -3.39 114.58 112.37 2jo0 h GLU 69 Ca 0.76 -0.39 -0.02 0.00 -0.00 0.00 0.00 59.36 59.71 2jo0 h GLU 69 Cb 1.96 0.13 -0.00 0.00 -0.00 0.00 0.00 28.75 30.84 2jo0 h GLU 69 CO -0.56 1.14 -0.08 0.52 -0.00 0.00 0.00 179.01 180.03 2jo0 h MET 70 N -0.42 0.00 -0.85 1.06 0.00 -0.11 0.88 114.93 115.49 2jo0 h MET 70 Ca -0.10 0.00 0.23 0.00 0.00 0.00 0.00 59.70 59.84 2jo0 h MET 70 Cb 1.41 0.00 -0.16 0.00 0.00 0.00 0.00 31.60 32.85 2jo0 h MET 70 CO 0.11 0.08 0.01 -0.12 0.00 0.00 0.00 176.91 177.00 2jo0 n MET 71 N -3.34 -0.07 0.00 1.72 0.00 0.74 -3.63 117.12 112.54 2jo0 n MET 71 Ca -0.01 1.28 0.00 0.00 -0.00 0.00 0.00 57.70 58.97 2jo0 n MET 71 Cb 0.26 -2.03 0.00 0.00 0.00 0.00 0.00 33.22 31.46 2jo0 n MET 71 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 175.97 178.38 2jo0 n THR 72 N -5.23 0.00 0.11 1.12 -1.04 -0.97 -4.15 114.28 104.12 2jo0 n THR 72 Ca 0.20 -0.05 0.16 0.00 -2.04 0.00 0.00 64.05 62.31 2jo0 n THR 72 Cb 0.65 0.54 0.69 0.00 -1.82 0.00 0.00 70.33 70.39 2jo0 n THR 72 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2jo0 h ALA 73 N 0.00 2.25 -0.05 2.41 0.00 -0.90 -0.09 119.26 122.88 2jo0 h ALA 73 Ca 0.00 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.91 2jo0 h ALA 73 Cb 0.00 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.81 2jo0 h ALA 73 CO 0.00 -0.40 0.22 0.00 0.00 0.00 0.00 179.25 179.07 2jo0 h GLN 75 N 0.00 0.00 -0.44 0.00 -0.00 -1.33 -2.59 115.11 110.74 2jo0 h GLN 75 Ca 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.67 2jo0 h GLN 75 Cb 0.46 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.94 2jo0 h GLN 75 CO -0.00 0.02 0.00 0.41 -0.00 0.00 0.00 178.83 179.26 2jo0 n GLY 76 N -1.19 2.29 0.12 0.06 0.00 -0.79 -4.53 105.19 101.15 2jo0 n GLY 76 Ca -0.03 -0.54 0.04 0.00 0.00 0.00 0.00 46.02 45.49 2jo0 n GLY 76 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2jo0 h VAL 77 N 3.03 0.45 -1.52 1.61 2.07 -1.59 -3.49 116.25 116.80 2jo0 h VAL 77 Ca 0.00 -1.77 0.31 0.00 0.82 0.00 0.00 66.70 66.06 2jo0 h VAL 77 Cb 0.82 2.01 -0.12 0.00 -1.52 0.00 0.00 31.29 32.48 2jo0 h VAL 77 CO 0.00 0.26 0.80 -0.83 0.02 0.00 0.00 177.57 177.81 2jo0 s GLY 78 N -4.58 -0.40 -0.68 2.17 0.00 -1.26 -5.13 107.32 97.45 2jo0 s GLY 78 Ca 0.00 0.68 0.05 0.00 0.00 0.00 0.00 44.72 45.46 2jo0 s GLY 78 CO 0.78 0.13 0.64 0.61 0.00 0.00 0.00 173.10 175.26 2jo0 n GLY 79 N -0.47 4.46 2.41 0.20 0.00 -1.26 -4.95 105.19 105.57 2jo0 n GLY 79 Ca -0.08 -2.69 -0.19 0.00 0.00 0.00 0.00 46.02 43.06 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 1.38 2.02 0.00 1.61 -0.04 -1.26 -4.80 135.00 133.90 2jo0 n PRO 80 Ca 0.25 -1.26 0.00 0.00 -0.04 0.00 0.00 63.50 62.45 2jo0 n PRO 80 Cb 0.38 -2.27 0.00 0.00 -0.04 0.00 0.00 33.50 31.58 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 3.33 -0.97 1.65 0.55 0.00 -1.26 -4.49 105.19 104.00 2jo0 n GLY 81 Ca 0.43 -1.65 0.00 0.00 0.00 0.00 0.00 46.02 44.80 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 -1.16 0.00 0.28 1.61 1.44 -1.26 -4.57 115.22 111.56 2jo0 n HIS 82 Ca 0.00 -0.45 0.16 0.00 -2.01 0.00 0.00 57.72 55.42 2jo0 n HIS 82 Cb 0.00 -0.34 0.77 0.00 0.12 0.00 0.00 29.99 30.53 2jo0 n HIS 82 CO 0.00 0.00 0.00 -0.22 -2.81 0.00 0.00 176.34 173.31 2jo0 h LYS 83 N 2.34 0.00 -0.15 -1.40 3.64 -1.96 -0.24 116.57 118.80 2jo0 h LYS 83 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2jo0 h LYS 83 Cb 0.48 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.30 2jo0 h LYS 83 CO 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 179.45 177.18 2jo0 n ALA 84 N -1.92 2.50 -2.66 5.00 0.00 -1.26 -4.03 120.51 118.15 2jo0 n ALA 84 Ca -0.01 -0.06 0.01 0.00 0.00 0.00 0.00 53.44 53.38 2jo0 n ALA 84 Cb 0.13 -1.00 0.04 0.00 0.00 0.00 0.00 19.45 18.62 2jo0 n ALA 84 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2jo0 n ARG 85 N -0.35 0.97 -2.23 0.00 0.63 -0.10 -5.10 116.66 110.48 2jo0 n ARG 85 Ca 0.01 -2.65 -0.02 0.00 -0.92 0.00 0.00 57.85 54.26 2jo0 n ARG 85 Cb 0.06 -0.76 -0.01 0.00 0.45 0.00 0.00 32.46 32.21 2jo0 n ARG 85 CO 0.00 0.00 0.00 1.33 -2.51 0.00 0.00 177.63 176.45 2jo0 n VAL 86 N -0.23 0.00 -0.67 5.15 0.24 -1.26 -5.07 118.33 116.50 2jo0 n VAL 86 Ca 0.03 -0.23 0.00 0.00 -2.04 0.00 0.00 64.34 62.10 2jo0 n VAL 86 Cb 0.93 0.08 0.00 0.00 -1.47 0.00 0.00 33.84 33.38 2jo0 n VAL 86 CO 0.00 0.00 0.00 -0.11 -2.14 0.00 0.00 176.83 174.58