#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 -3.22 -4.90 6.12 2.88 -1.26 -5.16 113.62 108.08 2jo0 n SER 2 Ca 0.00 0.72 -0.29 0.00 -1.33 0.00 0.00 58.87 57.97 2jo0 n SER 2 Cb 0.00 3.09 0.05 0.00 -0.75 0.00 0.00 64.21 66.60 2jo0 n SER 2 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 2jo0 s PRO 3 N -1.78 2.70 0.00 -1.46 0.04 -1.26 -5.02 135.00 128.23 2jo0 s PRO 3 Ca 0.00 0.28 0.00 0.00 0.04 0.00 0.00 61.00 61.32 2jo0 s PRO 3 Cb 0.00 -2.07 0.00 0.00 0.04 0.00 0.00 34.50 32.47 2jo0 s PRO 3 CO 0.00 -1.06 0.00 0.25 0.04 0.00 0.00 177.00 176.23 2jo0 n THR 4 N -2.96 0.00 -1.36 1.26 -2.24 -1.26 -5.13 114.28 102.58 2jo0 n THR 4 Ca 0.07 0.00 -0.34 0.00 -2.27 0.00 0.00 64.05 61.51 2jo0 n THR 4 Cb 0.58 -0.10 0.10 0.00 -2.10 0.00 0.00 70.33 68.81 2jo0 n THR 4 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2jo0 s SER 5 N -1.09 4.08 0.47 3.42 0.01 -1.26 -4.44 113.70 114.89 2jo0 s SER 5 Ca 0.00 2.33 0.18 0.00 1.31 0.00 0.00 55.95 59.77 2jo0 s SER 5 Cb 0.00 -2.59 1.18 0.00 0.21 0.00 0.00 66.02 64.82 2jo0 s SER 5 CO 0.00 -2.34 2.00 0.16 0.41 0.00 0.00 173.24 173.48 2jo0 h ILE 6 N -0.46 0.85 0.00 1.44 -0.00 -1.88 -3.01 117.51 114.45 2jo0 h ILE 6 Ca -0.47 -0.08 0.00 0.00 -0.00 0.00 0.00 64.86 64.31 2jo0 h ILE 6 Cb 1.29 0.60 0.00 0.00 -0.00 0.00 0.00 36.82 38.72 2jo0 h ILE 6 CO 0.49 0.04 0.00 0.18 -0.00 0.00 0.00 178.15 178.86 2jo0 n LEU 7 N -4.45 0.00 0.24 0.16 4.77 -1.26 -3.24 117.00 113.21 2jo0 n LEU 7 Ca 0.08 0.00 0.12 0.00 -0.03 0.00 0.00 56.01 56.18 2jo0 n LEU 7 Cb 0.42 0.00 0.48 0.00 -2.33 0.00 0.00 43.42 41.99 2jo0 n LEU 7 CO 0.35 0.00 0.85 -2.24 -1.33 0.00 0.00 177.39 175.02 2jo0 h ASP 8 N 0.00 0.00 -4.26 -1.43 2.03 -1.92 -3.44 116.42 107.41 2jo0 h ASP 8 Ca 0.00 0.00 -0.36 0.00 -0.73 0.00 0.00 57.03 55.94 2jo0 h ASP 8 Cb 0.00 0.00 -0.26 0.00 -0.83 0.00 0.00 39.33 38.24 2jo0 h ASP 8 CO 0.00 0.15 -0.77 0.27 -1.03 0.00 0.00 179.24 177.86 2jo0 s ILE 9 N -3.59 0.70 -0.35 4.15 -4.36 -1.20 -5.10 121.20 111.44 2jo0 s ILE 9 Ca 0.01 -0.67 -0.33 0.00 -0.26 0.00 0.00 60.65 59.40 2jo0 s ILE 9 Cb 0.09 -0.64 -0.10 0.00 1.25 0.00 0.00 42.46 43.06 2jo0 s ILE 9 CO 0.62 -0.01 2.23 -1.14 0.24 0.00 0.00 174.94 176.87 2jo0 n ARG 10 N 2.29 1.21 -2.27 0.37 0.00 -1.26 -4.94 116.66 112.06 2jo0 n ARG 10 Ca -0.17 0.31 -0.42 0.00 -0.00 0.00 0.00 57.85 57.57 2jo0 n ARG 10 Cb 0.56 -2.64 -0.03 0.00 0.00 0.00 0.00 32.46 30.35 2jo0 n ARG 10 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.63 178.77 2jo0 s GLN 11 N 6.47 4.26 0.00 -0.14 -2.07 -1.26 -4.78 119.66 122.14 2jo0 s GLN 11 Ca 1.08 1.88 0.00 0.00 -1.82 0.00 0.00 55.36 56.50 2jo0 s GLN 11 Cb -0.73 -3.69 0.00 0.00 -1.09 0.00 0.00 33.01 27.51 2jo0 s GLN 11 CO 0.45 -0.63 0.00 0.41 -1.32 0.00 0.00 175.29 174.20 2jo0 n GLY 12 N 3.67 -0.61 1.55 2.60 0.00 -1.26 -5.08 105.19 106.05 2jo0 n GLY 12 Ca 0.14 0.24 -0.00 0.00 0.00 0.00 0.00 46.02 46.39 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 0.92 0.00 1.61 -0.04 -1.26 -4.72 135.00 131.50 2jo0 n PRO 13 Ca 0.00 -0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2jo0 n PRO 13 Cb 0.00 -1.05 0.00 0.00 -0.04 0.00 0.00 33.50 32.41 2jo0 n PRO 13 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 2jo0 n LYS 14 N 1.55 0.00 0.12 0.54 0.00 -1.26 -3.39 118.16 115.72 2jo0 n LYS 14 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.31 2jo0 n LYS 14 Cb 0.46 -1.20 0.00 0.00 0.00 0.00 0.00 35.03 34.28 2jo0 n LYS 14 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 2jo0 n GLU 15 N -0.61 0.00 -2.35 1.64 -0.58 -1.26 -4.85 120.64 112.63 2jo0 n GLU 15 Ca 0.00 0.00 -0.35 0.00 -0.42 0.00 0.00 57.16 56.39 2jo0 n GLU 15 Cb 0.00 0.00 -0.03 0.00 -0.57 0.00 0.00 31.44 30.84 2jo0 n GLU 15 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 2jo0 s PRO 16 N -2.00 3.22 0.02 3.49 0.04 -1.22 -4.86 135.00 133.69 2jo0 s PRO 16 Ca 0.00 -1.10 -0.16 0.00 0.04 0.00 0.00 61.00 59.78 2jo0 s PRO 16 Cb 0.00 -5.30 -0.09 0.00 0.04 0.00 0.00 34.50 29.15 2jo0 s PRO 16 CO 0.00 -2.83 1.17 0.74 0.04 0.00 0.00 177.00 176.11 2jo0 h PHE 17 N 9.70 -0.53 -0.28 0.56 -1.00 -1.94 -2.76 116.94 120.67 2jo0 h PHE 17 Ca 0.23 -0.01 -0.19 0.00 2.81 0.00 0.00 57.97 60.81 2jo0 h PHE 17 Cb 0.97 0.18 0.00 0.00 3.61 0.00 0.00 35.95 40.70 2jo0 h PHE 17 CO 1.28 -0.33 -0.56 0.07 -1.61 0.00 0.00 178.31 177.16 2jo0 h ARG 18 N -0.61 0.88 0.00 1.51 -0.00 -1.92 0.14 114.38 114.37 2jo0 h ARG 18 Ca -0.06 -0.57 0.00 0.00 -0.00 0.00 0.00 59.98 59.35 2jo0 h ARG 18 Cb 0.44 0.07 0.00 0.00 -0.00 0.00 0.00 29.97 30.48 2jo0 h ARG 18 CO 0.10 1.20 0.00 -0.25 -0.00 0.00 0.00 179.97 181.02 2jo0 n ASP 19 N -4.01 0.00 0.00 0.08 8.00 -1.25 -0.94 116.55 118.43 2jo0 n ASP 19 Ca -0.05 -0.29 0.00 0.00 0.71 0.00 0.00 54.79 55.17 2jo0 n ASP 19 Cb 0.64 -0.05 0.00 0.00 -0.02 0.00 0.00 41.12 41.69 2jo0 n ASP 19 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2jo0 n TYR 20 N -1.05 0.00 -0.16 1.24 9.36 -1.04 -4.70 117.16 120.81 2jo0 n TYR 20 Ca 0.08 0.00 -0.02 0.00 3.32 0.00 0.00 57.90 61.28 2jo0 n TYR 20 Cb 0.05 0.00 0.06 0.00 -0.63 0.00 0.00 39.34 38.82 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 0.61 -0.20 2.97 3.04 0.11 0.31 116.25 123.10 2jo0 h VAL 21 Ca 0.00 -0.05 0.05 0.00 -1.01 0.00 0.00 66.70 65.70 2jo0 h VAL 21 Cb 0.93 0.47 -0.06 0.00 -2.01 0.00 0.00 31.29 30.62 2jo0 h VAL 21 CO 0.00 0.02 -0.18 0.44 -1.01 0.00 0.00 177.57 176.84 2jo0 h ASP 22 N 0.13 -0.59 1.53 3.17 5.19 -1.53 0.03 116.42 124.36 2jo0 h ASP 22 Ca 0.26 0.11 0.00 0.00 -0.62 0.00 0.00 57.03 56.78 2jo0 h ASP 22 Cb 0.39 0.28 0.00 0.00 0.18 0.00 0.00 39.33 40.18 2jo0 h ASP 22 CO -0.41 -0.23 -0.07 0.03 -3.12 0.00 0.00 179.24 175.44 2jo0 h ARG 23 N -0.20 0.00 0.00 3.56 2.47 -1.61 -2.83 114.38 115.77 2jo0 h ARG 23 Ca 0.12 0.00 -0.25 0.00 -1.26 0.00 0.00 59.98 58.59 2jo0 h ARG 23 Cb 0.38 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 28.66 2jo0 h ARG 23 CO -0.32 0.00 -1.44 0.34 0.56 0.00 0.00 179.97 179.12 2jo0 n PHE 24 N -2.44 0.78 0.26 3.04 -0.00 0.10 -4.45 117.46 114.75 2jo0 n PHE 24 Ca 0.05 0.34 0.09 0.00 -0.00 0.00 0.00 57.45 57.92 2jo0 n PHE 24 Cb 0.45 -1.03 0.65 0.00 -0.00 0.00 0.00 39.48 39.56 2jo0 n PHE 24 CO 0.00 0.00 0.00 1.88 -0.00 0.00 0.00 176.76 178.64 2jo0 h TYR 25 N -1.00 0.00 -0.10 -5.13 -1.99 -1.06 -1.37 116.97 106.33 2jo0 h TYR 25 Ca -0.38 0.00 0.03 0.00 2.00 0.00 0.00 58.73 60.38 2jo0 h TYR 25 Cb 1.28 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 40.00 2jo0 h TYR 25 CO 0.01 0.04 0.23 1.57 -0.00 0.00 0.00 178.16 180.02 2jo0 h LYS 26 N 0.00 0.00 0.00 4.88 -0.00 -1.71 -2.65 116.57 117.08 2jo0 h LYS 26 Ca -0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 60.65 60.60 2jo0 h LYS 26 Cb 0.08 0.00 -0.01 0.00 -0.00 0.00 0.00 32.23 32.30 2jo0 h LYS 26 CO 0.01 0.00 -1.20 0.25 -0.00 0.00 0.00 179.45 178.50 2jo0 n THR 27 N -3.29 0.20 -0.28 0.07 -2.24 -0.84 -4.65 114.28 103.26 2jo0 n THR 27 Ca -0.00 -0.12 0.07 0.00 -2.27 0.00 0.00 64.05 61.72 2jo0 n THR 27 Cb 0.32 -0.91 0.21 0.00 -2.10 0.00 0.00 70.33 67.85 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 0.36 -0.20 3.22 5.85 -1.20 0.14 115.31 123.48 2jo0 h LEU 28 Ca -0.08 0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.75 2jo0 h LEU 28 Cb 1.18 0.07 0.00 0.00 0.37 0.00 0.00 40.66 42.28 2jo0 h LEU 28 CO 0.00 0.13 0.00 -2.11 -0.34 0.00 0.00 178.44 176.12 2jo0 n ARG 29 N -4.97 0.20 0.00 1.25 -4.01 -1.01 -0.83 116.66 107.30 2jo0 n ARG 29 Ca 0.16 0.00 0.00 0.00 -1.04 0.00 0.00 57.85 56.97 2jo0 n ARG 29 Cb 0.45 -1.02 0.00 0.00 -3.04 0.00 0.00 32.46 28.85 2jo0 n ARG 29 CO 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 177.63 174.59 2jo0 n ALA 30 N -0.32 1.10 -0.62 2.89 0.00 0.03 -4.78 120.51 118.81 2jo0 n ALA 30 Ca 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.05 2jo0 n ALA 30 Cb 0.01 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.46 2jo0 n ALA 30 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2jo0 n GLU 31 N -0.08 0.00 0.00 0.00 2.13 -0.62 -4.85 120.64 117.22 2jo0 n GLU 31 Ca 0.00 0.00 0.13 0.00 0.66 0.00 0.00 57.16 57.95 2jo0 n GLU 31 Cb 0.26 0.00 0.45 0.00 0.27 0.00 0.00 31.44 32.42 2jo0 n GLU 31 CO 0.00 0.00 0.00 1.04 -0.41 0.00 0.00 177.13 177.76 2jo0 n GLN 32 N -1.56 0.00 -0.71 5.31 1.13 -0.89 -4.94 117.38 115.72 2jo0 n GLN 32 Ca 0.00 0.00 -0.02 0.00 -1.94 0.00 0.00 57.00 55.05 2jo0 n GLN 32 Cb 0.00 -1.50 -0.01 0.00 0.11 0.00 0.00 30.24 28.84 2jo0 n GLN 32 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2jo0 n ALA 33 N -1.50 -0.02 -0.50 -1.58 0.00 -0.01 -4.82 120.51 112.07 2jo0 n ALA 33 Ca 0.06 0.02 -0.03 0.00 0.00 0.00 0.00 53.44 53.50 2jo0 n ALA 33 Cb 0.34 -0.35 -0.04 0.00 0.00 0.00 0.00 19.45 19.39 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 1.41 4.06 -3.04 0.00 7.64 -1.26 -4.75 113.62 117.67 2jo0 n SER 34 Ca -0.02 -2.13 -0.17 0.00 1.01 0.00 0.00 58.87 57.56 2jo0 n SER 34 Cb 0.07 -0.93 -0.02 0.00 -1.01 0.00 0.00 64.21 62.32 2jo0 n SER 34 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 2jo0 n GLN 35 N 1.93 1.69 -3.79 1.43 7.27 -1.26 -3.99 117.38 120.67 2jo0 n GLN 35 Ca 0.10 -1.22 -0.07 0.00 0.07 0.00 0.00 57.00 55.88 2jo0 n GLN 35 Cb 0.48 -2.31 -0.02 0.00 2.41 0.00 0.00 30.24 30.81 2jo0 n GLN 35 CO 0.00 0.00 0.00 -2.00 0.07 0.00 0.00 177.06 175.13 2jo0 s GLU 36 N 3.44 1.67 0.58 3.69 2.12 -1.26 -5.02 118.70 123.91 2jo0 s GLU 36 Ca 0.34 -0.89 0.29 0.00 0.36 0.00 0.00 54.97 55.07 2jo0 s GLU 36 Cb 0.10 0.59 1.47 0.00 0.26 0.00 0.00 34.13 36.55 2jo0 s GLU 36 CO -0.03 -0.76 1.90 0.28 -0.54 0.00 0.00 175.26 176.11 2jo0 h VAL 37 N 2.00 0.42 0.00 3.70 2.07 -2.02 0.18 116.25 122.60 2jo0 h VAL 37 Ca -0.21 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.31 2jo0 h VAL 37 Cb 1.26 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 31.64 2jo0 h VAL 37 CO 0.25 0.00 0.03 0.29 0.02 0.00 0.00 177.57 178.16 2jo0 n LYS 38 N -3.84 0.00 0.33 1.57 5.02 -1.26 -3.12 118.16 116.87 2jo0 n LYS 38 Ca 0.10 0.26 0.18 0.00 -2.02 0.00 0.00 58.31 56.83 2jo0 n LYS 38 Cb 0.72 -1.53 0.94 0.00 -0.02 0.00 0.00 35.03 35.14 2jo0 n LYS 38 CO 0.00 0.00 0.00 -2.95 -0.52 0.00 0.00 177.40 173.93 2jo0 h ASN 39 N 0.00 0.00 0.00 4.39 -1.07 -1.08 -2.81 115.58 115.01 2jo0 h ASN 39 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.37 2jo0 h ASN 39 Cb 0.06 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.31 2jo0 h ASN 39 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.43 177.50 2jo0 n ALA 40 N -1.94 2.10 -1.36 4.14 0.00 -1.18 -3.32 120.51 118.95 2jo0 n ALA 40 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 2jo0 n ALA 40 Cb 0.28 -1.10 0.00 0.00 0.00 0.00 0.00 19.45 18.63 2jo0 n ALA 40 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 2jo0 n MET 41 N 0.95 0.00 -4.47 0.00 2.81 -1.06 -5.08 117.12 110.27 2jo0 n MET 41 Ca 0.00 -0.24 -0.24 0.00 -1.81 0.00 0.00 57.70 55.41 2jo0 n MET 41 Cb 0.24 -0.32 -0.08 0.00 -0.71 0.00 0.00 33.22 32.34 2jo0 n MET 41 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 2jo0 s THR 42 N 0.00 0.55 0.27 2.03 -4.23 -1.21 -5.02 115.64 108.03 2jo0 s THR 42 Ca 0.00 -2.00 0.26 0.00 -1.18 0.00 0.00 61.69 58.77 2jo0 s THR 42 Cb 0.00 -2.40 0.26 0.00 1.34 0.00 0.00 72.50 71.70 2jo0 s THR 42 CO 0.00 0.00 1.78 1.05 -0.54 0.00 0.00 174.62 176.91 2jo0 h GLU 43 N 1.88 0.00 -5.39 3.99 9.09 -2.01 -3.45 114.58 118.69 2jo0 h GLU 43 Ca -0.35 0.00 -0.61 0.00 0.05 0.00 0.00 59.36 58.45 2jo0 h GLU 43 Cb 1.27 0.00 0.09 0.00 -1.65 0.00 0.00 28.75 28.46 2jo0 h GLU 43 CO 0.55 0.00 -0.43 2.41 0.05 0.00 0.00 179.01 181.60 2jo0 n THR 44 N -2.54 1.63 -0.34 -1.06 -1.04 -1.26 -4.96 114.28 104.70 2jo0 n THR 44 Ca -0.02 -0.41 0.00 0.00 -2.04 0.00 0.00 64.05 61.59 2jo0 n THR 44 Cb 0.21 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.72 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 1.75 0.71 -3.83 -4.42 4.77 -1.26 -4.99 117.00 109.73 2jo0 n LEU 45 Ca 0.16 -0.71 0.02 0.00 -0.03 0.00 0.00 56.01 55.46 2jo0 n LEU 45 Cb 0.21 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.31 2jo0 n LEU 45 CO 0.51 0.18 1.09 -1.48 -1.33 0.00 0.00 177.39 176.36 2jo0 s LEU 46 N -0.05 -0.02 -0.00 2.23 -0.00 -1.26 -4.97 118.68 114.62 2jo0 s LEU 46 Ca 0.00 -0.17 0.01 0.00 -0.00 0.00 0.00 54.13 53.97 2jo0 s LEU 46 Cb 0.00 1.32 -0.00 0.00 -0.00 0.00 0.00 46.19 47.51 2jo0 s LEU 46 CO 0.00 -0.28 -0.04 -0.69 -0.00 0.00 0.00 176.35 175.34 2jo0 s VAL 47 N -2.16 0.33 0.34 1.48 1.01 -1.26 -4.99 120.40 115.16 2jo0 s VAL 47 Ca 0.23 -0.24 -0.26 0.00 0.00 0.00 0.00 61.98 61.71 2jo0 s VAL 47 Cb 0.02 -0.30 -0.13 0.00 0.00 0.00 0.00 36.38 35.97 2jo0 s VAL 47 CO -0.02 0.06 0.88 0.00 0.00 0.00 0.00 175.10 176.02 2jo0 n GLN 48 N 2.87 1.10 -2.21 2.72 6.02 -1.26 -2.58 117.38 124.04 2jo0 n GLN 48 Ca -0.13 0.39 -0.11 0.00 -0.01 0.00 0.00 57.00 57.14 2jo0 n GLN 48 Cb 0.58 -1.76 -0.01 0.00 1.02 0.00 0.00 30.24 30.07 2jo0 n GLN 48 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.06 174.34 2jo0 n ASN 49 N 1.12 -3.49 -4.50 1.08 5.15 -1.26 -4.92 115.26 108.44 2jo0 n ASN 49 Ca 0.10 0.23 -0.41 0.00 -0.60 0.00 0.00 54.58 53.91 2jo0 n ASN 49 Cb 0.35 -3.05 0.02 0.00 -0.53 0.00 0.00 39.78 36.57 2jo0 n ASN 49 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2jo0 n ALA 50 N -1.71 -0.96 -1.00 5.20 0.00 -1.06 -5.01 120.51 115.97 2jo0 n ALA 50 Ca -0.13 0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.45 2jo0 n ALA 50 Cb 0.55 -1.87 0.00 0.00 0.00 0.00 0.00 19.45 18.13 2jo0 n ALA 50 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2jo0 n ASN 51 N 0.86 -0.28 -0.09 0.00 6.94 -1.15 -4.98 115.26 116.56 2jo0 n ASN 51 Ca 0.11 -0.67 -0.18 0.00 -0.02 0.00 0.00 54.58 53.83 2jo0 n ASN 51 Cb 0.41 0.00 -0.12 0.00 -2.36 0.00 0.00 39.78 37.71 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 0.00 -0.00 -0.53 0.13 -1.91 -3.39 132.00 126.30 2jo0 h PRO 52 Ca 0.00 -0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.12 2jo0 h PRO 52 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2jo0 h PRO 52 CO 0.00 1.00 -0.02 0.38 -0.23 0.00 0.00 178.00 179.13 2jo0 h ASP 53 N -1.00 0.02 -0.54 1.44 2.03 -1.97 -2.86 116.42 113.54 2jo0 h ASP 53 Ca -0.16 -0.64 -0.01 0.00 -0.73 0.00 0.00 57.03 55.49 2jo0 h ASP 53 Cb 1.14 -0.01 -0.03 0.00 -0.83 0.00 0.00 39.33 39.61 2jo0 h ASP 53 CO -0.09 0.66 0.28 0.00 -1.03 0.00 0.00 179.24 179.06 2jo0 h LYS 55 N 0.72 -0.02 0.00 0.00 1.57 -1.76 0.21 116.57 117.30 2jo0 h LYS 55 Ca 0.19 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 2jo0 h LYS 55 Cb 0.07 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.39 2jo0 h LYS 55 CO -0.03 -0.01 0.00 1.15 -0.57 0.00 0.00 179.45 179.99 2jo0 h THR 56 N -0.02 0.00 0.00 -0.16 2.02 -0.87 -2.84 112.91 111.04 2jo0 h THR 56 Ca 0.24 -0.08 -0.07 0.00 0.77 0.00 0.00 66.41 67.27 2jo0 h THR 56 Cb 0.39 0.93 -0.01 0.00 -1.74 0.00 0.00 68.15 67.72 2jo0 h THR 56 CO -0.53 0.00 -1.09 -0.38 0.37 0.00 0.00 175.52 173.89 2jo0 n ILE 57 N -2.81 1.49 0.19 3.11 5.41 0.31 -4.37 119.36 122.69 2jo0 n ILE 57 Ca -0.02 0.09 0.18 0.00 1.00 0.00 0.00 62.75 64.00 2jo0 n ILE 57 Cb 0.10 -2.29 0.82 0.00 -0.71 0.00 0.00 39.64 37.56 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 -1.00 0.00 -0.87 1.39 4.07 -0.81 0.08 115.31 118.17 2jo0 h LEU 58 Ca -0.10 0.00 0.29 0.00 0.08 0.00 0.00 57.88 58.15 2jo0 h LEU 58 Cb 0.98 0.00 -0.16 0.00 1.08 0.00 0.00 40.66 42.56 2jo0 h LEU 58 CO -0.06 0.00 0.19 0.29 -1.08 0.00 0.00 178.44 177.78 2jo0 n LYS 59 N -3.63 -0.06 -0.09 1.13 4.76 -1.07 -0.77 118.16 118.41 2jo0 n LYS 59 Ca 0.03 1.27 -0.12 0.00 -2.87 0.00 0.00 58.31 56.62 2jo0 n LYS 59 Cb 0.41 -2.11 -0.15 0.00 -1.84 0.00 0.00 35.03 31.34 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 -2.90 1.47 -1.21 7.82 0.00 -0.17 -4.69 120.51 120.83 2jo0 n ALA 60 Ca 0.25 -1.21 -0.27 0.00 0.00 0.00 0.00 53.44 52.21 2jo0 n ALA 60 Cb 0.84 -0.25 0.05 0.00 0.00 0.00 0.00 19.45 20.09 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 -2.91 7.11 -2.60 0.00 0.00 0.05 -4.46 117.00 114.19 2jo0 n LEU 61 Ca -0.34 -3.91 -0.32 0.00 0.00 0.00 0.00 56.01 51.44 2jo0 n LEU 61 Cb 1.11 -1.04 0.02 0.00 0.00 0.00 0.00 43.42 43.51 2jo0 n LEU 61 CO 0.40 1.41 0.74 0.61 0.00 0.00 0.00 177.39 180.55 2jo0 n GLY 62 N -0.24 5.86 1.09 -3.96 0.00 -0.25 -3.80 105.19 103.89 2jo0 n GLY 62 Ca 0.48 -2.64 0.00 0.00 0.00 0.00 0.00 46.02 43.86 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 -0.54 0.93 -2.71 1.61 -0.04 -1.26 -4.78 135.00 128.21 2jo0 n PRO 63 Ca 0.46 0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.75 2jo0 n PRO 63 Cb 0.53 -1.04 -0.00 0.00 -0.04 0.00 0.00 33.50 32.95 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 0.70 -0.85 -1.00 0.55 0.00 -1.26 -4.79 120.51 113.87 2jo0 n ALA 64 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.56 2jo0 n ALA 64 Cb 0.46 -2.08 0.00 0.00 0.00 0.00 0.00 19.45 17.83 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 -2.64 1.41 0.25 0.00 0.00 -1.26 -4.97 120.51 113.31 2jo0 n ALA 65 Ca -0.12 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.46 2jo0 n ALA 65 Cb 0.60 0.00 0.73 0.00 0.00 0.00 0.00 19.45 20.78 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 0.00 -0.78 0.00 2.02 -1.86 -1.48 112.91 110.81 2jo0 h THR 66 Ca 0.00 0.00 0.18 0.00 0.77 0.00 0.00 66.41 67.36 2jo0 h THR 66 Cb 0.00 0.59 -0.12 0.00 -1.74 0.00 0.00 68.15 66.88 2jo0 h THR 66 CO 0.00 0.00 0.16 0.25 0.37 0.00 0.00 175.52 176.30 2jo0 h LEU 67 N 0.00 -0.06 -1.00 2.58 6.46 -1.94 -2.64 115.31 118.71 2jo0 h LEU 67 Ca 0.00 0.17 0.39 0.00 -0.12 0.00 0.00 57.88 58.32 2jo0 h LEU 67 Cb 0.36 0.24 -0.18 0.00 -0.73 0.00 0.00 40.66 40.35 2jo0 h LEU 67 CO 0.00 -0.10 0.43 -0.33 -0.62 0.00 0.00 178.44 177.82 2jo0 h GLU 68 N 0.22 0.00 0.21 1.25 5.08 -1.64 0.34 114.58 120.05 2jo0 h GLU 68 Ca 0.45 -0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 58.51 2jo0 h GLU 68 Cb 0.82 -0.00 0.03 0.00 0.50 0.00 0.00 28.75 30.10 2jo0 h GLU 68 CO -0.58 0.00 -1.39 1.05 -1.00 0.00 0.00 179.01 177.09 2jo0 h GLU 69 N 0.00 0.45 -0.14 2.33 4.11 -1.73 -3.38 114.58 116.22 2jo0 h GLU 69 Ca 0.80 -0.77 -0.03 0.00 0.07 0.00 0.00 59.36 59.43 2jo0 h GLU 69 Cb 2.03 0.29 -0.01 0.00 0.50 0.00 0.00 28.75 31.56 2jo0 h GLU 69 CO -0.81 1.37 -0.04 0.52 0.07 0.00 0.00 179.01 180.12 2jo0 h MET 70 N 0.00 0.21 -0.52 1.06 2.86 -0.28 -1.15 114.93 117.11 2jo0 h MET 70 Ca -0.25 -0.03 0.10 0.00 -2.06 0.00 0.00 59.70 57.45 2jo0 h MET 70 Cb 2.03 -0.04 -0.11 0.00 0.06 0.00 0.00 31.60 33.54 2jo0 h MET 70 CO 0.22 0.27 -0.27 1.98 1.06 0.00 0.00 176.91 180.17 2jo0 h MET 71 N 0.21 -0.14 0.00 1.72 -1.53 -0.78 -2.79 114.93 111.63 2jo0 h MET 71 Ca 0.05 0.01 -0.21 0.00 -3.44 0.00 0.00 59.70 56.11 2jo0 h MET 71 Cb 0.22 0.03 -0.04 0.00 -0.55 0.00 0.00 31.60 31.26 2jo0 h MET 71 CO 0.01 -0.09 -1.75 0.25 0.14 0.00 0.00 176.91 175.47 2jo0 n THR 72 N -5.42 1.15 -0.04 -0.77 -2.24 -1.01 -4.16 114.28 101.78 2jo0 n THR 72 Ca 0.04 -0.72 0.22 0.00 -2.27 0.00 0.00 64.05 61.31 2jo0 n THR 72 Cb 0.34 -0.63 0.69 0.00 -2.10 0.00 0.00 70.33 68.63 2jo0 n THR 72 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2jo0 h ALA 73 N 1.34 2.55 0.00 6.98 0.00 -1.02 -1.42 119.26 127.69 2jo0 h ALA 73 Ca -0.25 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.64 2jo0 h ALA 73 Cb 1.73 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.56 2jo0 h ALA 73 CO 0.04 -0.73 0.00 0.00 0.00 0.00 0.00 179.25 178.57 2jo0 n GLN 75 N -0.80 0.83 -0.91 0.00 -0.00 -0.53 -2.91 117.38 113.05 2jo0 n GLN 75 Ca 0.05 -0.08 0.05 0.00 -0.00 0.00 0.00 57.00 57.02 2jo0 n GLN 75 Cb 0.02 -1.28 0.39 0.00 -0.00 0.00 0.00 30.24 29.38 2jo0 n GLN 75 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2jo0 n GLY 76 N 1.96 3.11 2.94 2.61 0.00 -0.84 -4.84 105.19 110.13 2jo0 n GLY 76 Ca -0.06 -0.94 -0.14 0.00 0.00 0.00 0.00 46.02 44.88 2jo0 n GLY 76 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2jo0 s VAL 77 N -2.81 -0.41 0.05 1.61 1.01 -1.24 -5.11 120.40 113.49 2jo0 s VAL 77 Ca 0.55 0.15 -0.00 0.00 0.00 0.00 0.00 61.98 62.67 2jo0 s VAL 77 Cb 0.42 -0.54 0.00 0.00 0.00 0.00 0.00 36.38 36.27 2jo0 s VAL 77 CO 0.16 0.02 0.07 0.61 0.00 0.00 0.00 175.10 175.96 2jo0 n GLY 78 N 5.35 2.85 0.00 4.51 0.00 -1.26 -4.81 105.19 111.83 2jo0 n GLY 78 Ca -0.06 -1.37 0.00 0.00 0.00 0.00 0.00 46.02 44.60 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 -0.08 -0.87 3.74 -0.02 0.00 -1.26 -5.13 105.19 101.57 2jo0 n GLY 79 Ca -0.00 0.40 -0.29 0.00 0.00 0.00 0.00 46.02 46.13 2jo0 n GLY 79 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2jo0 s PRO 80 N 0.00 0.80 0.17 1.61 0.04 -1.26 -5.10 135.00 131.25 2jo0 s PRO 80 Ca 0.00 0.39 0.05 0.00 0.04 0.00 0.00 61.00 61.47 2jo0 s PRO 80 Cb 0.00 -1.79 -0.05 0.00 0.04 0.00 0.00 34.50 32.70 2jo0 s PRO 80 CO 0.00 -2.45 -0.09 0.20 0.04 0.00 0.00 177.00 174.70 2jo0 s GLY 81 N -3.77 1.18 0.00 0.56 0.00 -1.26 -5.04 107.32 98.99 2jo0 s GLY 81 Ca 0.64 -1.55 0.00 0.00 0.00 0.00 0.00 44.72 43.82 2jo0 s GLY 81 CO 0.55 -1.62 0.00 -2.39 0.00 0.00 0.00 173.10 169.64 2jo0 n HIS 82 N -0.25 0.00 -3.48 1.90 -0.00 -1.26 -4.82 115.22 107.31 2jo0 n HIS 82 Ca -0.09 0.00 -0.21 0.00 -0.00 0.00 0.00 57.72 57.42 2jo0 n HIS 82 Cb 0.61 0.00 -0.04 0.00 -0.00 0.00 0.00 29.99 30.56 2jo0 n HIS 82 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.34 177.51 2jo0 n LYS 83 N 0.00 -1.96 0.00 -1.40 3.00 -1.26 -4.92 118.16 111.62 2jo0 n LYS 83 Ca 0.00 0.09 0.00 0.00 -0.00 0.00 0.00 58.31 58.40 2jo0 n LYS 83 Cb 0.00 -4.63 0.00 0.00 0.00 0.00 0.00 35.03 30.40 2jo0 n LYS 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2jo0 n ALA 84 N -3.26 0.00 -2.98 3.14 0.00 -1.26 -5.14 120.51 111.02 2jo0 n ALA 84 Ca 0.05 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.38 2jo0 n ALA 84 Cb 0.48 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.88 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 0.00 1.66 0.00 0.00 6.06 -1.26 -5.18 118.95 120.22 2jo0 s ARG 85 Ca 0.00 -1.49 0.00 0.00 -2.50 0.00 0.00 55.73 51.74 2jo0 s ARG 85 Cb 0.00 0.44 0.00 0.00 0.06 0.00 0.00 34.95 35.45 2jo0 s ARG 85 CO 0.00 -0.68 0.00 1.33 -2.50 0.00 0.00 175.30 173.45 2jo0 n VAL 86 N -0.44 0.00 1.31 7.11 0.24 -1.26 -5.29 118.33 120.01 2jo0 n VAL 86 Ca -0.00 0.00 0.13 0.00 -2.04 0.00 0.00 64.34 62.43 2jo0 n VAL 86 Cb 0.62 0.00 0.37 0.00 -1.47 0.00 0.00 33.84 33.36 2jo0 n VAL 86 CO 0.00 0.00 0.00 -0.11 -2.14 0.00 0.00 176.83 174.58