#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jo0 h SER 2 N 0.00 -0.26 -3.99 7.83 4.64 -2.08 -3.39 113.55 116.29 2jo0 h SER 2 Ca 0.00 0.04 -0.50 0.00 -0.47 0.00 0.00 61.79 60.87 2jo0 h SER 2 Cb 0.00 0.12 0.05 0.00 -0.31 0.00 0.00 62.40 62.25 2jo0 h SER 2 CO 0.00 -0.13 0.45 -2.16 -0.87 0.00 0.00 176.83 174.13 2jo0 s PRO 3 N -6.17 3.91 -0.36 4.77 0.04 -1.26 -5.00 135.00 130.94 2jo0 s PRO 3 Ca -0.14 1.67 0.14 0.00 0.04 0.00 0.00 61.00 62.71 2jo0 s PRO 3 Cb 0.08 -2.45 0.42 0.00 0.04 0.00 0.00 34.50 32.60 2jo0 s PRO 3 CO 0.67 -0.40 0.92 0.25 0.04 0.00 0.00 177.00 178.48 2jo0 n THR 4 N -0.35 0.99 -1.33 1.26 -2.24 -1.26 -5.12 114.28 106.22 2jo0 n THR 4 Ca 0.06 -3.76 -0.39 0.00 -2.27 0.00 0.00 64.05 57.70 2jo0 n THR 4 Cb 0.49 0.12 0.02 0.00 -2.10 0.00 0.00 70.33 68.86 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 -0.04 -2.63 0.12 3.42 7.64 -1.26 -4.77 113.62 116.09 2jo0 n SER 5 Ca 0.17 0.69 -0.02 0.00 1.01 0.00 0.00 58.87 60.72 2jo0 n SER 5 Cb 0.74 -0.98 0.08 0.00 -1.01 0.00 0.00 64.21 63.05 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 0.09 1.47 0.00 0.44 -0.00 -1.91 -3.37 117.51 114.23 2jo0 h ILE 6 Ca -0.43 -2.50 0.00 0.00 -0.00 0.00 0.00 64.86 61.93 2jo0 h ILE 6 Cb 1.43 2.37 0.00 0.00 -0.00 0.00 0.00 36.82 40.62 2jo0 h ILE 6 CO 0.44 0.70 0.24 0.00 -0.00 0.00 0.00 178.15 179.54 2jo0 n LEU 7 N -3.61 0.13 0.04 0.16 -0.00 -1.26 -0.54 117.00 111.91 2jo0 n LEU 7 Ca -0.01 0.40 -0.13 0.00 -0.00 0.00 0.00 56.01 56.27 2jo0 n LEU 7 Cb 0.72 -0.37 -0.09 0.00 -0.00 0.00 0.00 43.42 43.67 2jo0 n LEU 7 CO 0.43 -0.44 0.60 -0.78 -0.00 0.00 0.00 177.39 177.20 2jo0 h ASP 8 N 0.00 -0.10 0.00 1.45 3.58 -1.97 -3.38 116.42 115.99 2jo0 h ASP 8 Ca 0.00 -0.37 0.00 0.00 0.42 0.00 0.00 57.03 57.08 2jo0 h ASP 8 Cb 0.49 0.03 0.00 0.00 1.72 0.00 0.00 39.33 41.57 2jo0 h ASP 8 CO 0.00 0.33 0.00 2.30 -2.88 0.00 0.00 179.24 178.99 2jo0 n ILE 9 N -4.94 1.32 -1.72 2.25 -5.35 0.29 -4.93 119.36 106.28 2jo0 n ILE 9 Ca -0.09 -0.18 -0.60 0.00 -0.27 0.00 0.00 62.75 61.62 2jo0 n ILE 9 Cb 0.24 -1.17 -0.08 0.00 -1.74 0.00 0.00 39.64 36.89 2jo0 n ILE 9 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33 2jo0 n ARG 10 N 0.89 0.93 -0.02 6.28 5.12 -1.26 -4.88 116.66 123.72 2jo0 n ARG 10 Ca 0.00 0.34 -0.02 0.00 -1.93 0.00 0.00 57.85 56.24 2jo0 n ARG 10 Cb 0.48 -1.99 -0.03 0.00 -1.16 0.00 0.00 32.46 29.76 2jo0 n ARG 10 CO 0.00 0.00 0.00 0.94 -1.93 0.00 0.00 177.63 176.64 2jo0 n GLN 11 N 5.15 2.52 0.00 5.56 7.27 -1.26 -5.09 117.38 131.54 2jo0 n GLN 11 Ca 0.27 0.01 0.00 0.00 0.07 0.00 0.00 57.00 57.35 2jo0 n GLN 11 Cb 0.09 -1.10 0.00 0.00 2.41 0.00 0.00 30.24 31.64 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 2.88 1.39 1.22 1.69 0.00 -1.26 -5.02 105.19 106.08 2jo0 n GLY 12 Ca -0.07 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.09 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 0.50 0.00 1.61 -0.04 -1.26 -2.60 135.00 133.22 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 -1.25 0.00 0.00 -0.04 0.00 0.00 33.50 32.21 2jo0 n PRO 13 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 2jo0 n LYS 14 N 1.04 0.01 -0.10 0.54 -0.00 -1.26 -5.00 118.16 113.39 2jo0 n LYS 14 Ca 0.00 0.00 -0.17 0.00 -0.00 0.00 0.00 58.31 58.14 2jo0 n LYS 14 Cb 0.25 -0.00 -0.06 0.00 -0.00 0.00 0.00 35.03 35.22 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 0.00 0.49 -2.97 -1.58 -0.58 -1.07 -4.59 120.64 110.34 2jo0 n GLU 15 Ca 0.00 0.21 -0.21 0.00 -0.42 0.00 0.00 57.16 56.73 2jo0 n GLU 15 Cb 0.00 -1.34 0.02 0.00 -0.57 0.00 0.00 31.44 29.55 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 -2.62 2.91 0.00 3.49 0.04 -1.26 -4.67 135.00 132.89 2jo0 s PRO 16 Ca -0.30 -0.71 0.00 0.00 0.04 0.00 0.00 61.00 60.03 2jo0 s PRO 16 Cb 0.08 -2.60 0.00 0.00 0.04 0.00 0.00 34.50 32.03 2jo0 s PRO 16 CO 0.40 -0.34 0.00 1.19 0.04 0.00 0.00 177.00 178.29 2jo0 n PHE 17 N -2.06 0.00 0.20 0.56 3.01 -1.26 -4.88 117.46 113.02 2jo0 n PHE 17 Ca 0.03 0.00 0.04 0.00 1.01 0.00 0.00 57.45 58.53 2jo0 n PHE 17 Cb 0.58 0.00 0.44 0.00 -0.01 0.00 0.00 39.48 40.50 2jo0 n PHE 17 CO 0.00 0.00 0.00 0.07 1.01 0.00 0.00 176.76 177.84 2jo0 h ARG 18 N 0.00 0.04 0.00 -1.08 -0.00 -1.98 0.16 114.38 111.52 2jo0 h ARG 18 Ca 0.00 -0.01 -0.00 0.00 -0.00 0.00 0.00 59.98 59.97 2jo0 h ARG 18 Cb 0.00 -0.01 -0.00 0.00 -0.00 0.00 0.00 29.97 29.96 2jo0 h ARG 18 CO 0.00 0.27 -0.02 -0.44 -0.00 0.00 0.00 179.97 179.78 2jo0 h ASP 19 N 0.04 0.00 0.00 0.08 5.19 -2.00 -2.64 116.42 117.09 2jo0 h ASP 19 Ca 0.01 0.00 -0.10 0.00 -0.62 0.00 0.00 57.03 56.31 2jo0 h ASP 19 Cb 0.42 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.91 2jo0 h ASP 19 CO 0.03 0.02 -1.39 0.00 -3.12 0.00 0.00 179.24 174.77 2jo0 n TYR 20 N -3.34 0.00 -0.33 4.55 9.36 -0.83 -4.68 117.16 121.89 2jo0 n TYR 20 Ca -0.02 0.00 0.12 0.00 3.32 0.00 0.00 57.90 61.31 2jo0 n TYR 20 Cb 0.13 -0.28 0.32 0.00 -0.63 0.00 0.00 39.34 38.88 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 0.80 0.12 2.97 3.04 -0.36 0.15 116.25 122.96 2jo0 h VAL 21 Ca -0.16 -0.27 0.01 0.00 -1.01 0.00 0.00 66.70 65.27 2jo0 h VAL 21 Cb 1.32 -0.07 -0.02 0.00 -2.01 0.00 0.00 31.29 30.51 2jo0 h VAL 21 CO -0.00 0.15 -0.16 0.44 -1.01 0.00 0.00 177.57 176.99 2jo0 h ASP 22 N 0.80 -0.42 1.23 3.17 3.32 -1.77 0.62 116.42 123.36 2jo0 h ASP 22 Ca 0.52 0.05 -0.05 0.00 0.02 0.00 0.00 57.03 57.57 2jo0 h ASP 22 Cb 0.76 0.16 -0.01 0.00 0.22 0.00 0.00 39.33 40.46 2jo0 h ASP 22 CO -0.29 -0.23 -0.24 0.03 -1.72 0.00 0.00 179.24 176.79 2jo0 h ARG 23 N -0.32 0.00 0.00 3.56 2.47 -1.43 -2.34 114.38 116.32 2jo0 h ARG 23 Ca 0.01 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.73 2jo0 h ARG 23 Cb 0.32 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.64 2jo0 h ARG 23 CO -0.07 0.24 -0.10 0.35 0.56 0.00 0.00 179.97 180.95 2jo0 h PHE 24 N 0.00 0.00 0.00 3.04 3.04 -0.69 -3.39 116.94 118.94 2jo0 h PHE 24 Ca -0.00 0.00 -0.01 0.00 3.98 0.00 0.00 57.97 61.94 2jo0 h PHE 24 Cb 0.91 0.00 -0.00 0.00 2.56 0.00 0.00 35.95 39.42 2jo0 h PHE 24 CO 0.00 0.00 -0.03 1.88 -2.02 0.00 0.00 178.31 178.14 2jo0 h TYR 25 N -0.50 0.00 -1.48 0.41 -1.99 -0.98 -2.21 116.97 110.23 2jo0 h TYR 25 Ca 0.00 0.00 0.43 0.00 2.00 0.00 0.00 58.73 61.16 2jo0 h TYR 25 Cb 0.10 0.00 -0.06 0.00 2.00 0.00 0.00 36.73 38.77 2jo0 h TYR 25 CO -0.04 0.03 1.08 -0.22 -0.00 0.00 0.00 178.16 179.01 2jo0 h LYS 26 N 0.00 0.00 0.00 4.88 3.11 -1.61 -3.03 116.57 119.92 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 0.11 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.34 2jo0 h LYS 26 CO 0.00 0.00 -0.58 0.25 -2.81 0.00 0.00 179.45 176.31 2jo0 n THR 27 N -4.06 0.00 -0.35 1.00 -2.24 -0.87 -4.77 114.28 102.99 2jo0 n THR 27 Ca 0.33 0.00 0.25 0.00 -2.27 0.00 0.00 64.05 62.35 2jo0 n THR 27 Cb 1.54 -0.55 0.49 0.00 -2.10 0.00 0.00 70.33 69.71 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 0.49 0.00 3.22 5.85 -1.49 -1.58 115.31 121.81 2jo0 h LEU 28 Ca 0.00 0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.89 2jo0 h LEU 28 Cb 0.58 0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.73 2jo0 h LEU 28 CO 0.00 -0.10 0.00 -2.11 -0.34 0.00 0.00 178.44 175.89 2jo0 n ARG 29 N -4.95 0.20 0.21 1.25 -4.01 -1.15 -1.06 116.66 107.16 2jo0 n ARG 29 Ca 0.31 0.00 0.09 0.00 -1.04 0.00 0.00 57.85 57.22 2jo0 n ARG 29 Cb 1.01 -1.34 0.40 0.00 -3.04 0.00 0.00 32.46 29.49 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 2.09 0.98 0.00 2.89 0.00 -1.61 -3.10 119.26 120.51 2jo0 h ALA 30 Ca 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.69 2jo0 h ALA 30 Cb 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.75 2jo0 h ALA 30 CO 0.00 0.30 0.00 -0.85 0.00 0.00 0.00 179.25 178.70 2jo0 n GLU 31 N -3.36 0.41 -2.63 0.00 0.00 -0.75 -4.75 120.64 109.56 2jo0 n GLU 31 Ca 0.00 -0.22 -0.23 0.00 0.00 0.00 0.00 57.16 56.71 2jo0 n GLU 31 Cb 0.46 -0.68 -0.00 0.00 0.00 0.00 0.00 31.44 31.22 2jo0 n GLU 31 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 2jo0 n GLN 32 N -0.12 2.85 0.12 3.44 1.13 -0.22 -4.99 117.38 119.60 2jo0 n GLN 32 Ca 0.00 -4.29 0.05 0.00 -1.94 0.00 0.00 57.00 50.83 2jo0 n GLN 32 Cb 0.08 -2.04 0.27 0.00 0.11 0.00 0.00 30.24 28.67 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 -0.32 0.62 -2.53 -1.58 0.00 -1.17 -4.18 120.51 111.35 2jo0 n ALA 33 Ca 0.31 0.09 -0.08 0.00 0.00 0.00 0.00 53.44 53.76 2jo0 n ALA 33 Cb 0.64 -0.74 -0.10 0.00 0.00 0.00 0.00 19.45 19.25 2jo0 n ALA 33 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2jo0 s SER 34 N -3.22 0.29 0.42 0.00 1.04 -1.26 -5.01 113.70 105.96 2jo0 s SER 34 Ca -0.01 -0.70 -0.26 0.00 0.48 0.00 0.00 55.95 55.46 2jo0 s SER 34 Cb 0.03 0.21 -0.10 0.00 0.10 0.00 0.00 66.02 66.26 2jo0 s SER 34 CO 0.09 -0.53 1.37 0.00 0.98 0.00 0.00 173.24 175.15 2jo0 n GLN 35 N 0.60 2.17 -3.61 4.02 -0.00 -1.26 -5.04 117.38 114.26 2jo0 n GLN 35 Ca -0.18 0.77 -0.12 0.00 -0.00 0.00 0.00 57.00 57.47 2jo0 n GLN 35 Cb 0.59 -2.52 -0.06 0.00 -0.00 0.00 0.00 30.24 28.25 2jo0 n GLN 35 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.06 175.06 2jo0 s GLU 36 N -2.27 0.67 0.55 2.61 2.12 -1.26 -5.05 118.70 116.06 2jo0 s GLU 36 Ca 0.60 0.53 0.24 0.00 0.36 0.00 0.00 54.97 56.70 2jo0 s GLU 36 Cb -0.48 0.32 1.45 0.00 0.26 0.00 0.00 34.13 35.68 2jo0 s GLU 36 CO 0.59 -0.13 2.06 0.28 -0.54 0.00 0.00 175.26 177.51 2jo0 h VAL 37 N 3.36 0.70 0.00 3.70 2.07 -2.01 -2.88 116.25 121.20 2jo0 h VAL 37 Ca -0.26 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.26 2jo0 h VAL 37 Cb 1.16 0.82 0.00 0.00 -1.52 0.00 0.00 31.29 31.75 2jo0 h VAL 37 CO 0.18 0.00 0.00 0.29 0.02 0.00 0.00 177.57 178.06 2jo0 n LYS 38 N -4.23 0.63 -0.39 1.57 4.76 -1.26 -4.60 118.16 114.64 2jo0 n LYS 38 Ca 0.05 0.00 0.33 0.00 -2.87 0.00 0.00 58.31 55.81 2jo0 n LYS 38 Cb 0.41 -1.03 0.64 0.00 -1.84 0.00 0.00 35.03 33.21 2jo0 n LYS 38 CO 0.00 0.00 0.00 -2.95 -1.37 0.00 0.00 177.40 173.08 2jo0 h ASN 39 N 0.04 0.23 0.00 4.39 -1.07 -1.92 0.33 115.58 117.58 2jo0 h ASN 39 Ca 0.00 0.07 0.00 0.00 0.07 0.00 0.00 56.30 56.44 2jo0 h ASN 39 Cb 0.03 0.04 0.00 0.00 -2.07 0.00 0.00 38.32 36.32 2jo0 h ASN 39 CO 0.00 -0.02 0.13 0.00 0.07 0.00 0.00 177.43 177.60 2jo0 n ALA 40 N -2.61 0.78 0.44 4.14 0.00 -1.26 -1.86 120.51 120.15 2jo0 n ALA 40 Ca 0.30 0.03 0.05 0.00 0.00 0.00 0.00 53.44 53.82 2jo0 n ALA 40 Cb 1.24 -0.82 0.24 0.00 0.00 0.00 0.00 19.45 20.10 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 -1.54 0.13 -3.78 0.00 2.81 0.10 -4.75 117.12 110.11 2jo0 n MET 41 Ca -0.00 0.20 -0.18 0.00 -1.81 0.00 0.00 57.70 55.90 2jo0 n MET 41 Cb 0.13 -1.50 -0.06 0.00 -0.71 0.00 0.00 33.22 31.09 2jo0 n MET 41 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 2jo0 n THR 42 N -1.28 0.00 0.00 2.03 -2.24 -0.78 -5.04 114.28 106.97 2jo0 n THR 42 Ca 0.04 -1.81 0.00 0.00 -2.27 0.00 0.00 64.05 60.02 2jo0 n THR 42 Cb 0.07 0.72 0.00 0.00 -2.10 0.00 0.00 70.33 69.03 2jo0 n THR 42 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 2jo0 n GLU 43 N -0.63 0.00 -1.47 -0.78 0.00 -1.26 -4.88 120.64 111.62 2jo0 n GLU 43 Ca -0.02 0.00 -0.38 0.00 0.00 0.00 0.00 57.16 56.77 2jo0 n GLU 43 Cb 0.46 -1.48 0.04 0.00 0.00 0.00 0.00 31.44 30.46 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 -0.94 2.39 -0.90 3.84 -2.24 -1.26 -4.99 114.28 110.17 2jo0 n THR 44 Ca 0.00 -0.49 0.00 0.00 -2.27 0.00 0.00 64.05 61.29 2jo0 n THR 44 Cb 0.00 -0.73 0.00 0.00 -2.10 0.00 0.00 70.33 67.50 2jo0 n THR 44 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2jo0 n LEU 45 N 0.30 0.00 -3.85 3.22 4.77 -1.26 -4.85 117.00 115.34 2jo0 n LEU 45 Ca 0.12 0.00 -0.00 0.00 -0.03 0.00 0.00 56.01 56.09 2jo0 n LEU 45 Cb 0.48 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.57 2jo0 n LEU 45 CO 0.51 0.04 0.95 -1.48 -1.33 0.00 0.00 177.39 176.08 2jo0 s LEU 46 N 0.00 -0.03 -0.03 2.23 -0.00 -1.26 -4.95 118.68 114.65 2jo0 s LEU 46 Ca 0.00 -0.38 -0.03 0.00 -0.00 0.00 0.00 54.13 53.72 2jo0 s LEU 46 Cb 0.00 1.70 0.01 0.00 -0.00 0.00 0.00 46.19 47.89 2jo0 s LEU 46 CO 0.00 -0.61 0.07 -0.69 -0.00 0.00 0.00 176.35 175.13 2jo0 s VAL 47 N -2.30 0.01 -0.16 1.48 1.01 -1.26 -5.04 120.40 114.13 2jo0 s VAL 47 Ca 0.22 -0.06 -0.36 0.00 0.00 0.00 0.00 61.98 61.78 2jo0 s VAL 47 Cb -0.00 -0.13 -0.13 0.00 0.00 0.00 0.00 36.38 36.12 2jo0 s VAL 47 CO 0.01 -0.03 1.85 0.00 0.00 0.00 0.00 175.10 176.93 2jo0 n GLN 48 N 2.93 1.82 -1.73 2.72 6.02 -1.26 -2.75 117.38 125.12 2jo0 n GLN 48 Ca -0.13 0.66 -0.02 0.00 -0.01 0.00 0.00 57.00 57.50 2jo0 n GLN 48 Cb 0.59 -2.47 -0.01 0.00 1.02 0.00 0.00 30.24 29.38 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 6.36 -1.06 -0.33 1.08 5.15 -1.26 -4.83 115.26 120.37 2jo0 n ASN 49 Ca 0.24 0.24 0.32 0.00 -0.60 0.00 0.00 54.58 54.78 2jo0 n ASN 49 Cb 0.24 -1.21 0.57 0.00 -0.53 0.00 0.00 39.78 38.85 2jo0 n ASN 49 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2jo0 n ALA 50 N -1.53 1.03 0.00 5.20 0.00 -1.11 -4.75 120.51 119.34 2jo0 n ALA 50 Ca -0.03 0.92 0.00 0.00 0.00 0.00 0.00 53.44 54.33 2jo0 n ALA 50 Cb 0.29 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 18.78 2jo0 n ALA 50 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2jo0 n ASN 51 N -4.98 0.00 -0.18 0.00 3.02 -1.26 -4.44 115.26 107.42 2jo0 n ASN 51 Ca 0.36 0.00 -0.10 0.00 -0.03 0.00 0.00 54.58 54.81 2jo0 n ASN 51 Cb 1.26 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 40.44 2jo0 n ASN 51 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 2jo0 h PRO 52 N 0.00 0.98 0.60 3.52 0.13 -1.99 -3.39 132.00 131.85 2jo0 h PRO 52 Ca 0.00 -0.36 -0.03 0.00 -0.87 0.00 0.00 66.00 64.74 2jo0 h PRO 52 Cb 0.00 -0.06 0.01 0.00 0.13 0.00 0.00 31.00 31.07 2jo0 h PRO 52 CO 0.00 1.03 -0.29 -0.44 -0.23 0.00 0.00 178.00 178.07 2jo0 h ASP 53 N 0.85 -0.68 -0.48 1.44 3.32 -1.98 -3.04 116.42 115.84 2jo0 h ASP 53 Ca 0.14 -0.03 0.05 0.00 0.02 0.00 0.00 57.03 57.21 2jo0 h ASP 53 Cb 0.65 0.18 -0.08 0.00 0.22 0.00 0.00 39.33 40.29 2jo0 h ASP 53 CO 0.04 -0.37 -0.53 0.00 -1.72 0.00 0.00 179.24 176.67 2jo0 h LYS 55 N -0.31 -0.04 0.00 0.00 1.57 -1.75 0.19 116.57 116.23 2jo0 h LYS 55 Ca 0.08 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 2jo0 h LYS 55 Cb 0.53 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.85 2jo0 h LYS 55 CO -0.62 -0.03 0.00 -2.37 -0.57 0.00 0.00 179.45 175.87 2jo0 n THR 56 N -5.46 0.30 -0.05 -0.16 5.66 -0.62 -2.54 114.28 111.43 2jo0 n THR 56 Ca 0.08 0.08 -0.06 0.00 -3.05 0.00 0.00 64.05 61.10 2jo0 n THR 56 Cb 0.38 -0.73 -0.02 0.00 -1.55 0.00 0.00 70.33 68.41 2jo0 n THR 56 CO 0.00 0.00 0.00 -0.38 -3.05 0.00 0.00 175.07 171.64 2jo0 n ILE 57 N -1.24 1.25 0.16 1.09 5.41 0.46 -4.59 119.36 121.89 2jo0 n ILE 57 Ca 0.11 0.23 0.18 0.00 1.00 0.00 0.00 62.75 64.27 2jo0 n ILE 57 Cb 0.15 -2.05 0.79 0.00 -0.71 0.00 0.00 39.64 37.82 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 -0.64 0.00 -1.89 1.39 4.07 -1.09 -0.44 115.31 116.72 2jo0 h LEU 58 Ca 0.00 0.00 0.39 0.00 0.08 0.00 0.00 57.88 58.35 2jo0 h LEU 58 Cb 0.64 0.00 -0.07 0.00 1.08 0.00 0.00 40.66 42.31 2jo0 h LEU 58 CO 0.00 0.00 0.96 0.11 -1.08 0.00 0.00 178.44 178.43 2jo0 h LYS 59 N 0.00 0.05 0.00 1.13 1.79 -1.68 0.19 116.57 118.05 2jo0 h LYS 59 Ca 0.13 -0.00 -0.31 0.00 -2.18 0.00 0.00 60.65 58.29 2jo0 h LYS 59 Cb 0.66 -0.01 -0.06 0.00 -1.58 0.00 0.00 32.23 31.25 2jo0 h LYS 59 CO -0.00 0.03 -2.15 0.00 -1.08 0.00 0.00 179.45 176.25 2jo0 n ALA 60 N -2.75 1.58 -2.11 3.86 0.00 -0.28 -4.81 120.51 116.00 2jo0 n ALA 60 Ca 0.30 -1.09 -0.38 0.00 0.00 0.00 0.00 53.44 52.27 2jo0 n ALA 60 Cb 1.39 -0.10 0.01 0.00 0.00 0.00 0.00 19.45 20.75 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 -2.65 7.40 -3.06 0.00 7.94 0.03 -4.72 117.00 121.95 2jo0 n LEU 61 Ca -0.28 -4.91 -0.35 0.00 -1.11 0.00 0.00 56.01 49.37 2jo0 n LEU 61 Cb 1.04 -1.19 0.01 0.00 0.53 0.00 0.00 43.42 43.80 2jo0 n LEU 61 CO 0.35 1.92 0.93 0.61 -1.11 0.00 0.00 177.39 180.09 2jo0 n GLY 62 N 0.33 5.83 1.63 -3.96 0.00 -1.09 -4.39 105.19 103.55 2jo0 n GLY 62 Ca 0.52 -2.64 -0.02 0.00 0.00 0.00 0.00 46.02 43.89 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 -0.32 1.01 -0.39 1.61 -0.04 -1.26 -4.83 135.00 130.78 2jo0 n PRO 63 Ca 0.44 -0.13 0.00 0.00 -0.04 0.00 0.00 63.50 63.77 2jo0 n PRO 63 Cb 0.36 -1.19 0.00 0.00 -0.04 0.00 0.00 33.50 32.63 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 1.70 0.00 0.00 0.55 0.00 -1.26 -4.34 120.51 117.16 2jo0 n ALA 64 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.49 2jo0 n ALA 64 Cb 0.49 -0.82 0.00 0.00 0.00 0.00 0.00 19.45 19.13 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 0.99 2.49 0.29 0.00 0.00 -1.26 -4.88 120.51 118.13 2jo0 n ALA 65 Ca 0.00 0.00 0.16 0.00 0.00 0.00 0.00 53.44 53.60 2jo0 n ALA 65 Cb 0.00 0.01 0.88 0.00 0.00 0.00 0.00 19.45 20.33 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 -0.69 0.00 2.02 -1.90 -2.10 112.91 110.24 2jo0 h THR 66 Ca 0.00 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.30 2jo0 h THR 66 Cb 0.02 0.71 -0.09 0.00 -1.74 0.00 0.00 68.15 67.05 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 0.24 -1.03 2.58 6.46 -1.90 -2.10 115.31 119.55 2jo0 h LEU 67 Ca 0.00 0.10 0.22 0.00 -0.12 0.00 0.00 57.88 58.08 2jo0 h LEU 67 Cb 0.29 0.08 -0.11 0.00 -0.73 0.00 0.00 40.66 40.19 2jo0 h LEU 67 CO 0.00 0.11 0.61 -0.33 -0.62 0.00 0.00 178.44 178.21 2jo0 h GLU 68 N 0.42 0.63 -0.07 1.25 5.08 -1.77 0.23 114.58 120.35 2jo0 h GLU 68 Ca 0.37 -0.04 -0.22 0.00 -1.00 0.00 0.00 59.36 58.47 2jo0 h GLU 68 Cb 0.52 -0.14 0.01 0.00 0.50 0.00 0.00 28.75 29.65 2jo0 h GLU 68 CO -0.37 0.42 -0.80 1.05 -1.00 0.00 0.00 179.01 178.30 2jo0 h GLU 69 N 0.65 0.67 0.00 2.33 4.11 -1.67 -3.36 114.58 117.31 2jo0 h GLU 69 Ca 0.61 -0.63 -0.08 0.00 0.07 0.00 0.00 59.36 59.34 2jo0 h GLU 69 Cb 1.10 0.15 -0.01 0.00 0.50 0.00 0.00 28.75 30.50 2jo0 h GLU 69 CO -0.42 1.23 -0.36 0.52 0.07 0.00 0.00 179.01 180.04 2jo0 h MET 70 N 0.34 0.00 0.02 1.06 2.86 0.02 0.28 114.93 119.51 2jo0 h MET 70 Ca -0.08 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.56 2jo0 h MET 70 Cb 1.45 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.11 2jo0 h MET 70 CO 0.16 0.36 -0.01 1.98 1.06 0.00 0.00 176.91 180.47 2jo0 h MET 71 N 0.00 -0.02 0.02 1.72 1.85 -1.16 -3.19 114.93 114.16 2jo0 h MET 71 Ca -0.00 0.00 -0.21 0.00 -0.61 0.00 0.00 59.70 58.87 2jo0 h MET 71 Cb 0.66 0.00 -0.01 0.00 0.43 0.00 0.00 31.60 32.68 2jo0 h MET 71 CO 0.05 -0.00 -0.96 1.15 -0.40 0.00 0.00 176.91 176.75 2jo0 h THR 72 N -0.03 1.52 -0.71 -0.77 2.02 -1.58 -3.37 112.91 109.98 2jo0 h THR 72 Ca -0.00 -2.78 0.08 0.00 0.77 0.00 0.00 66.41 64.48 2jo0 h THR 72 Cb 0.03 2.59 -0.05 0.00 -1.74 0.00 0.00 68.15 68.98 2jo0 h THR 72 CO 0.00 0.81 0.47 0.00 0.37 0.00 0.00 175.52 177.17 2jo0 h ALA 73 N 0.89 1.79 0.00 6.16 0.00 -0.43 -0.14 119.26 127.53 2jo0 h ALA 73 Ca -0.06 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.74 2jo0 h ALA 73 Cb 1.62 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 19.24 2jo0 h ALA 73 CO 0.15 0.08 -0.45 0.00 0.00 0.00 0.00 179.25 179.02 2jo0 n GLN 75 N -3.51 0.07 -0.29 0.00 10.64 -0.09 -3.32 117.38 120.89 2jo0 n GLN 75 Ca 0.00 0.03 0.12 0.00 -1.83 0.00 0.00 57.00 55.32 2jo0 n GLN 75 Cb 0.57 -1.56 0.28 0.00 -0.86 0.00 0.00 30.24 28.67 2jo0 n GLN 75 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2jo0 n GLY 76 N 1.46 2.04 0.32 2.61 0.00 -1.08 -4.71 105.19 105.83 2jo0 n GLY 76 Ca 0.06 -0.75 0.16 0.00 0.00 0.00 0.00 46.02 45.49 2jo0 n GLY 76 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 2jo0 h VAL 77 N 4.22 0.51 0.00 1.61 3.04 -1.54 -3.48 116.25 120.60 2jo0 h VAL 77 Ca 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.69 2jo0 h VAL 77 Cb 0.95 0.92 0.00 0.00 -2.01 0.00 0.00 31.29 31.15 2jo0 h VAL 77 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.57 177.17 2jo0 n GLY 78 N -1.37 -1.03 0.00 3.17 0.00 -1.26 -5.14 105.19 99.55 2jo0 n GLY 78 Ca -0.01 -2.14 0.00 0.00 0.00 0.00 0.00 46.02 43.87 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 0.25 0.23 -0.02 0.00 -1.26 -5.01 105.19 99.39 2jo0 n GLY 79 Ca 0.00 -1.11 0.14 0.00 0.00 0.00 0.00 46.02 45.05 2jo0 n GLY 79 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2jo0 h PRO 80 N 0.00 0.00 0.00 1.61 0.13 -2.02 -3.47 132.00 128.25 2jo0 h PRO 80 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2jo0 h PRO 80 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 2jo0 h PRO 80 CO 0.00 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.18 2jo0 n GLY 81 N 0.57 4.09 0.14 1.56 0.00 -1.26 -5.00 105.19 105.29 2jo0 n GLY 81 Ca 0.02 -0.39 0.06 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.93 0.41 1.30 1.61 1.44 -1.26 -1.51 115.22 116.27 2jo0 n HIS 82 Ca 0.00 0.21 0.12 0.00 -2.01 0.00 0.00 57.72 56.05 2jo0 n HIS 82 Cb 0.00 -0.66 0.42 0.00 0.12 0.00 0.00 29.99 29.87 2jo0 n HIS 82 CO 0.00 0.00 0.00 0.36 -2.81 0.00 0.00 176.34 173.89 2jo0 n LYS 83 N -1.96 1.77 -2.47 -1.40 2.85 -1.26 -4.86 118.16 110.83 2jo0 n LYS 83 Ca -0.01 -1.14 -0.43 0.00 -1.05 0.00 0.00 58.31 55.68 2jo0 n LYS 83 Cb 0.27 -1.45 -0.02 0.00 -0.65 0.00 0.00 35.03 33.18 2jo0 n LYS 83 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2jo0 s ALA 84 N -1.89 3.66 0.28 0.58 0.00 -0.57 -5.03 121.76 118.78 2jo0 s ALA 84 Ca 0.35 0.41 -0.30 0.00 0.00 0.00 0.00 51.96 52.43 2jo0 s ALA 84 Cb 0.20 -3.60 -0.10 0.00 0.00 0.00 0.00 23.12 19.61 2jo0 s ALA 84 CO 0.30 -1.12 1.43 -0.98 0.00 0.00 0.00 175.76 175.39 2jo0 s ARG 85 N 3.36 4.26 0.97 0.00 1.04 -1.26 -5.05 118.95 122.26 2jo0 s ARG 85 Ca 0.53 2.33 -0.16 0.00 -1.04 0.00 0.00 55.73 57.39 2jo0 s ARG 85 Cb -0.20 -3.08 0.20 0.00 -2.04 0.00 0.00 34.95 29.82 2jo0 s ARG 85 CO 0.13 -0.40 1.30 0.14 -0.04 0.00 0.00 175.30 176.43 2jo0 s VAL 86 N -0.33 1.97 0.00 4.99 -7.23 -1.26 -5.23 120.40 113.31 2jo0 s VAL 86 Ca 0.57 0.00 0.00 0.00 -1.81 0.00 0.00 61.98 60.74 2jo0 s VAL 86 Cb -0.42 -2.96 0.00 0.00 0.56 0.00 0.00 36.38 33.55 2jo0 s VAL 86 CO 0.47 0.00 0.00 0.00 -0.31 0.00 0.00 175.10 175.26