#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jsa s SER 2 N 0.00 -0.21 0.00 2.89 0.01 -1.26 -4.16 113.70 110.96 2jsa s SER 2 Ca 0.00 -2.17 0.00 0.00 1.31 0.00 0.00 55.95 55.09 2jsa s SER 2 Cb 0.00 0.95 0.00 0.00 0.21 0.00 0.00 66.02 67.18 2jsa s SER 2 CO 0.00 -0.12 0.00 0.00 0.41 0.00 0.00 173.24 173.53 2jsa n ALA 3 N 3.07 0.00 0.31 1.44 0.00 -1.26 -4.83 120.51 119.23 2jsa n ALA 3 Ca 0.21 0.00 0.16 0.00 0.00 0.00 0.00 53.44 53.82 2jsa n ALA 3 Cb 0.52 0.00 0.88 0.00 0.00 0.00 0.00 19.45 20.85 2jsa n ALA 3 CO 0.00 0.00 0.00 1.37 0.00 0.00 0.00 177.50 178.87 2jsa h LEU 4 N 0.00 0.00 -0.54 0.00 -0.00 -1.99 -1.61 115.31 111.16 2jsa h LEU 4 Ca 0.00 0.00 0.11 0.00 -0.00 0.00 0.00 57.88 57.99 2jsa h LEU 4 Cb 0.00 0.00 -0.10 0.00 -0.00 0.00 0.00 40.66 40.56 2jsa h LEU 4 CO 0.00 0.00 -0.15 0.28 -0.00 0.00 0.00 178.44 178.57 2jsa h SER 5 N 0.00 -0.56 -0.50 0.17 0.02 -1.92 0.13 113.55 110.89 2jsa h SER 5 Ca 0.00 0.17 0.10 0.00 -0.84 0.00 0.00 61.79 61.22 2jsa h SER 5 Cb 0.42 0.36 -0.10 0.00 0.14 0.00 0.00 62.40 63.21 2jsa h SER 5 CO 0.00 -0.19 -0.23 0.00 -1.14 0.00 0.00 176.83 175.27 2jsa h GLN 7 N -0.11 -0.21 -1.01 0.00 5.75 -0.96 0.71 115.11 119.28 2jsa h GLN 7 Ca 0.23 0.01 0.24 0.00 -0.15 0.00 0.00 58.65 58.98 2jsa h GLN 7 Cb 0.48 0.05 -0.11 0.00 1.07 0.00 0.00 27.48 28.96 2jsa h GLN 7 CO -0.57 -0.14 0.61 0.52 -2.65 0.00 0.00 178.83 176.60 2jsa h MET 8 N -0.21 0.57 -0.19 1.69 2.86 0.23 1.25 114.93 121.12 2jsa h MET 8 Ca 0.16 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.77 2jsa h MET 8 Cb 0.46 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 31.99 2jsa h MET 8 CO -0.44 0.37 0.12 0.00 1.06 0.00 0.00 176.91 178.03 2jsa n GLU 10 N -4.50 0.33 -0.04 0.00 1.02 0.42 -2.16 120.64 115.71 2jsa n GLU 10 Ca -0.00 -0.01 -0.18 0.00 -0.02 0.00 0.00 57.16 56.95 2jsa n GLU 10 Cb 0.08 -1.50 -0.14 0.00 -0.02 0.00 0.00 31.44 29.86 2jsa n GLU 10 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 2jsa n LEU 11 N -1.33 2.29 0.07 -4.62 7.94 0.17 -2.88 117.00 118.64 2jsa n LEU 11 Ca 0.13 0.14 -0.08 0.00 -1.11 0.00 0.00 56.01 55.09 2jsa n LEU 11 Cb 0.27 -0.77 0.04 0.00 0.53 0.00 0.00 43.42 43.49 2jsa n LEU 11 CO 0.24 0.78 0.36 -0.37 -1.11 0.00 0.00 177.39 177.30 2jsa h VAL 12 N 0.04 1.41 0.40 1.96 -1.51 -1.17 -2.41 116.25 114.98 2jsa h VAL 12 Ca -0.45 -2.22 -0.02 0.00 -1.23 0.00 0.00 66.70 62.78 2jsa h VAL 12 Cb 2.01 2.17 0.00 0.00 -2.13 0.00 0.00 31.29 33.35 2jsa h VAL 12 CO 0.04 0.66 -0.19 -0.37 -1.23 0.00 0.00 177.57 176.47 2jsa h VAL 13 N 0.21 0.22 -1.08 7.19 -1.51 -1.60 0.33 116.25 120.01 2jsa h VAL 13 Ca -0.03 -0.64 0.30 0.00 -1.23 0.00 0.00 66.70 65.10 2jsa h VAL 13 Cb 1.30 0.35 -0.07 0.00 -2.13 0.00 0.00 31.29 30.74 2jsa h VAL 13 CO 0.12 0.05 0.74 0.07 -1.23 0.00 0.00 177.57 177.31 2jsa h LYS 14 N -1.07 0.20 0.13 5.19 5.09 -1.60 2.08 116.57 126.58 2jsa h LYS 14 Ca -0.06 -0.01 -0.29 0.00 0.09 0.00 0.00 60.65 60.38 2jsa h LYS 14 Cb 0.50 -0.04 0.03 0.00 0.10 0.00 0.00 32.23 32.81 2jsa h LYS 14 CO 0.09 0.13 -1.22 0.87 -2.09 0.00 0.00 179.45 177.23 2jsa h LYS 15 N 0.20 0.60 0.00 0.07 1.79 -1.34 -3.05 116.57 114.84 2jsa h LYS 15 Ca 0.57 -0.81 0.00 0.00 -2.18 0.00 0.00 60.65 58.22 2jsa h LYS 15 Cb 1.82 0.27 0.00 0.00 -1.58 0.00 0.00 32.23 32.74 2jsa h LYS 15 CO -0.16 1.37 0.00 0.98 -1.08 0.00 0.00 179.45 180.56 2jsa n TYR 16 N -3.83 0.00 -0.28 -1.35 9.36 0.24 -1.97 117.16 119.33 2jsa n TYR 16 Ca -0.14 0.00 0.25 0.00 3.32 0.00 0.00 57.90 61.33 2jsa n TYR 16 Cb 0.98 -0.43 0.47 0.00 -0.63 0.00 0.00 39.34 39.73 2jsa n TYR 16 CO 0.00 0.00 0.00 0.39 0.22 0.00 0.00 176.86 177.47 2jsa n GLU 17 N -1.79 -0.05 -2.57 2.98 -0.58 0.64 0.96 120.64 120.24 2jsa n GLU 17 Ca 0.00 1.21 -0.30 0.00 -0.42 0.00 0.00 57.16 57.65 2jsa n GLU 17 Cb 0.00 -2.14 -0.01 0.00 -0.57 0.00 0.00 31.44 28.73 2jsa n GLU 17 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2jsa n GLY 18 N -1.26 5.84 0.11 0.62 0.00 -1.15 -4.73 105.19 104.61 2jsa n GLY 18 Ca 0.31 -2.72 -0.23 0.00 0.00 0.00 0.00 46.02 43.38 2jsa n GLY 18 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2jsa n SER 19 N -0.38 1.87 0.00 1.61 3.41 0.27 -4.72 113.62 115.69 2jsa n SER 19 Ca 0.39 0.41 0.00 0.00 -0.26 0.00 0.00 58.87 59.41 2jsa n SER 19 Cb 0.49 -0.95 0.00 0.00 -0.26 0.00 0.00 64.21 63.49 2jsa n SER 19 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2jsa n ALA 20 N -3.51 0.00 0.17 7.33 0.00 -1.26 -4.69 120.51 118.55 2jsa n ALA 20 Ca -0.35 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.11 2jsa n ALA 20 Cb 0.71 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 20.13 2jsa n ALA 20 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2jsa n ASP 21 N 0.00 0.96 -3.80 0.00 2.03 -1.26 -5.03 116.55 109.45 2jsa n ASP 21 Ca 0.00 -0.49 -0.32 0.00 0.52 0.00 0.00 54.79 54.50 2jsa n ASP 21 Cb 0.00 1.04 0.02 0.00 -0.72 0.00 0.00 41.12 41.46 2jsa n ASP 21 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2jsa n LYS 22 N -1.22 -0.98 -3.64 -0.67 4.76 -1.26 -4.96 118.16 110.19 2jsa n LYS 22 Ca 0.01 0.49 -0.26 0.00 -2.87 0.00 0.00 58.31 55.67 2jsa n LYS 22 Cb 0.08 -3.20 -0.17 0.00 -1.84 0.00 0.00 35.03 29.90 2jsa n LYS 22 CO 0.00 0.00 0.00 0.34 -1.37 0.00 0.00 177.40 176.37 2jsa s ASP 23 N -3.32 2.46 0.28 4.39 -1.08 -1.26 -4.98 116.67 113.17 2jsa s ASP 23 Ca 0.32 -0.66 0.19 0.00 -0.52 0.00 0.00 52.55 51.88 2jsa s ASP 23 Cb -0.15 -0.32 1.01 0.00 -1.46 0.00 0.00 42.92 42.00 2jsa s ASP 23 CO 0.90 -0.34 1.57 0.00 0.52 0.00 0.00 175.17 177.82 2jsa n ALA 24 N 5.23 1.03 -0.04 3.66 0.00 -1.26 -0.20 120.51 128.93 2jsa n ALA 24 Ca -0.07 0.17 -0.01 0.00 0.00 0.00 0.00 53.44 53.53 2jsa n ALA 24 Cb 0.49 -1.27 -0.01 0.00 0.00 0.00 0.00 19.45 18.66 2jsa n ALA 24 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2jsa h ASN 25 N 0.00 -0.02 0.35 0.00 2.35 -1.99 -0.56 115.58 115.72 2jsa h ASN 25 Ca 0.00 -0.07 0.00 0.00 -0.55 0.00 0.00 56.30 55.68 2jsa h ASN 25 Cb 0.01 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.38 2jsa h ASN 25 CO 0.00 0.51 0.00 0.52 -1.65 0.00 0.00 177.43 176.81 2jsa n VAL 26 N -4.78 0.74 -0.07 2.81 0.31 -0.83 -1.92 118.33 114.59 2jsa n VAL 26 Ca -0.01 0.19 -0.06 0.00 -0.01 0.00 0.00 64.34 64.45 2jsa n VAL 26 Cb 0.04 -0.94 -0.02 0.00 -0.91 0.00 0.00 33.84 32.01 2jsa n VAL 26 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 2jsa n ILE 27 N -1.36 1.43 -0.35 2.52 5.41 0.73 -2.58 119.36 125.15 2jsa n ILE 27 Ca 0.06 0.20 0.13 0.00 1.00 0.00 0.00 62.75 64.14 2jsa n ILE 27 Cb 0.14 -2.38 0.32 0.00 -0.71 0.00 0.00 39.64 37.00 2jsa n ILE 27 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 176.55 176.62 2jsa h LYS 28 N -1.00 0.70 -0.01 0.38 2.10 -1.01 0.43 116.57 118.17 2jsa h LYS 28 Ca -0.01 -0.04 -0.00 0.00 -2.00 0.00 0.00 60.65 58.59 2jsa h LYS 28 Cb 0.58 -0.16 -0.00 0.00 -0.90 0.00 0.00 32.23 31.76 2jsa h LYS 28 CO -0.01 0.46 -0.00 0.87 -2.00 0.00 0.00 179.45 178.77 2jsa h LYS 29 N 0.72 0.02 -0.74 0.07 1.57 -1.57 -3.11 116.57 113.53 2jsa h LYS 29 Ca 0.57 -0.01 0.15 0.00 -1.87 0.00 0.00 60.65 59.50 2jsa h LYS 29 Cb 0.91 -0.00 -0.14 0.00 0.08 0.00 0.00 32.23 33.08 2jsa h LYS 29 CO -0.39 0.44 -0.17 -0.44 -0.57 0.00 0.00 179.45 178.31 2jsa h ASP 30 N -0.41 -0.67 -0.21 0.86 5.19 -0.73 -0.91 116.42 119.55 2jsa h ASP 30 Ca 0.00 0.22 0.03 0.00 -0.62 0.00 0.00 57.03 56.66 2jsa h ASP 30 Cb 0.43 0.45 -0.05 0.00 0.18 0.00 0.00 39.33 40.35 2jsa h ASP 30 CO 0.00 -0.24 -0.37 0.15 -3.12 0.00 0.00 179.24 175.66 2jsa h PHE 31 N 0.00 -1.13 -0.99 4.55 3.04 -1.01 0.19 116.94 121.59 2jsa h PHE 31 Ca 0.36 0.05 0.32 0.00 3.98 0.00 0.00 57.97 62.67 2jsa h PHE 31 Cb 0.55 0.52 -0.15 0.00 2.56 0.00 0.00 35.95 39.43 2jsa h PHE 31 CO -0.58 -0.34 0.54 0.22 -2.02 0.00 0.00 178.31 176.13 2jsa h ASP 32 N -0.31 0.47 -0.07 0.41 3.58 -1.16 0.33 116.42 119.67 2jsa h ASP 32 Ca 0.04 0.19 0.02 0.00 0.42 0.00 0.00 57.03 57.70 2jsa h ASP 32 Cb 0.42 0.15 -0.04 0.00 1.72 0.00 0.00 39.33 41.58 2jsa h ASP 32 CO -0.36 -0.14 -0.39 0.00 -2.88 0.00 0.00 179.24 175.47 2jsa h ALA 33 N 1.85 -0.78 -0.07 -0.78 0.00 0.28 0.45 119.26 120.21 2jsa h ALA 33 Ca 0.72 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.58 2jsa h ALA 33 Cb 1.63 0.87 0.00 0.00 0.00 0.00 0.00 17.79 20.29 2jsa h ALA 33 CO -0.61 -0.91 0.00 -1.91 0.00 0.00 0.00 179.25 175.82 2jsa n GLU 34 N -4.60 1.28 -0.06 0.00 4.07 0.30 -2.93 120.64 118.71 2jsa n GLU 34 Ca -0.05 -0.30 -0.06 0.00 -0.06 0.00 0.00 57.16 56.70 2jsa n GLU 34 Cb 0.27 -1.30 -0.02 0.00 -0.06 0.00 0.00 31.44 30.33 2jsa n GLU 34 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2jsa h LYS 36 N -0.64 0.00 0.00 0.00 1.57 -0.48 1.59 116.57 118.61 2jsa h LYS 36 Ca 0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2jsa h LYS 36 Cb 0.64 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.95 2jsa h LYS 36 CO 0.00 0.00 -0.00 0.87 -0.57 0.00 0.00 179.45 179.75 2jsa h LYS 37 N 0.00 -0.01 0.74 3.15 1.57 -1.71 -1.46 116.57 118.85 2jsa h LYS 37 Ca 0.01 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.75 2jsa h LYS 37 Cb 0.02 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.34 2jsa h LYS 37 CO -0.00 0.54 -0.35 1.25 -0.57 0.00 0.00 179.45 180.31 2jsa h LEU 38 N -1.00 -0.84 -2.84 2.94 6.46 -1.31 -2.45 115.31 116.27 2jsa h LEU 38 Ca -0.00 0.02 -0.21 0.00 -0.12 0.00 0.00 57.88 57.57 2jsa h LEU 38 Cb 0.54 0.22 -0.13 0.00 -0.73 0.00 0.00 40.66 40.57 2jsa h LEU 38 CO 0.00 -0.59 0.27 0.49 -0.62 0.00 0.00 178.44 178.00 2jsa n PHE 39 N -5.51 1.26 0.29 1.25 3.72 0.54 -4.33 117.46 114.68 2jsa n PHE 39 Ca -0.14 -1.08 0.18 0.00 -0.05 0.00 0.00 57.45 56.35 2jsa n PHE 39 Cb 0.40 -0.55 0.94 0.00 -0.94 0.00 0.00 39.48 39.33 2jsa n PHE 39 CO 0.00 0.00 0.00 1.12 -0.05 0.00 0.00 176.76 177.83 2jsa h HIS 40 N 0.45 0.00 -2.28 1.38 2.07 -0.75 -2.91 115.15 113.11 2jsa h HIS 40 Ca 0.26 0.00 -0.59 0.00 -2.85 0.00 0.00 60.37 57.19 2jsa h HIS 40 Cb 1.73 0.00 -0.41 0.00 2.57 0.00 0.00 27.41 31.30 2jsa h HIS 40 CO 0.65 0.00 -0.78 0.25 -3.07 0.00 0.00 177.93 174.99 2jsa n THR 41 N -2.80 1.03 -3.76 6.12 -2.24 -1.26 -5.02 114.28 106.35 2jsa n THR 41 Ca -0.02 -4.65 -0.13 0.00 -2.27 0.00 0.00 64.05 56.98 2jsa n THR 41 Cb 0.16 -2.03 -0.10 0.00 -2.10 0.00 0.00 70.33 66.26 2jsa n THR 41 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 2jsa s ILE 42 N -1.72 0.01 -0.50 2.28 1.01 -1.10 -5.07 121.20 116.12 2jsa s ILE 42 Ca 0.36 -0.11 -0.28 0.00 0.00 0.00 0.00 60.65 60.62 2jsa s ILE 42 Cb 0.12 -0.51 0.01 0.00 0.01 0.00 0.00 42.46 42.09 2jsa s ILE 42 CO -0.08 -0.06 1.45 -2.16 0.00 0.00 0.00 174.94 174.09 2jsa s PRO 43 N -0.15 3.37 0.00 2.79 0.04 -1.26 -2.84 135.00 136.95 2jsa s PRO 43 Ca -0.03 0.69 0.00 0.00 0.04 0.00 0.00 61.00 61.70 2jsa s PRO 43 Cb -0.03 -4.10 0.00 0.00 0.04 0.00 0.00 34.50 30.41 2jsa s PRO 43 CO 0.01 -1.83 0.00 1.19 0.04 0.00 0.00 177.00 176.41 2jsa n PHE 44 N 9.48 0.00 0.05 0.56 3.72 -1.26 -4.89 117.46 125.13 2jsa n PHE 44 Ca 0.15 0.00 -0.16 0.00 -0.05 0.00 0.00 57.45 57.39 2jsa n PHE 44 Cb 0.49 -0.19 -0.10 0.00 -0.94 0.00 0.00 39.48 38.74 2jsa n PHE 44 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 2jsa h GLY 45 N 0.00 -1.11 1.49 1.37 0.00 -1.83 0.60 103.07 103.58 2jsa h GLY 45 Ca 0.00 0.66 0.01 0.00 0.00 0.00 0.00 47.33 48.00 2jsa h GLY 45 CO 0.00 -0.23 0.32 -0.91 0.00 0.00 0.00 176.54 175.72 2jsa h THR 46 N -0.67 1.10 -0.38 4.70 1.35 -1.77 0.79 112.91 118.04 2jsa h THR 46 Ca 0.01 -0.21 -0.02 0.00 -0.55 0.00 0.00 66.41 65.64 2jsa h THR 46 Cb 0.72 0.43 -0.02 0.00 -1.73 0.00 0.00 68.15 67.56 2jsa h THR 46 CO -0.36 0.11 0.14 0.03 -0.25 0.00 0.00 175.52 175.20 2jsa h ARG 47 N 0.61 0.57 -0.11 4.72 2.47 -1.46 -2.59 114.38 118.59 2jsa h ARG 47 Ca 0.18 -0.11 -0.11 0.00 -1.26 0.00 0.00 59.98 58.68 2jsa h ARG 47 Cb -0.01 -0.09 -0.01 0.00 -1.65 0.00 0.00 29.97 28.21 2jsa h ARG 47 CO -0.04 0.55 -0.44 1.49 0.56 0.00 0.00 179.97 182.09 2jsa h GLU 48 N 0.46 0.26 -0.04 0.04 4.57 0.95 -2.72 114.58 118.10 2jsa h GLU 48 Ca 0.12 -0.13 0.01 0.00 -1.18 0.00 0.00 59.36 58.18 2jsa h GLU 48 Cb 0.20 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 28.77 2jsa h GLU 48 CO -0.01 0.66 -0.23 0.00 -1.18 0.00 0.00 179.01 178.25 2jsa h ASP 50 N -0.26 0.00 -0.19 0.00 1.82 -1.54 1.30 116.42 117.55 2jsa h ASP 50 Ca 0.01 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.65 2jsa h ASP 50 Cb 0.29 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.30 2jsa h ASP 50 CO -0.18 0.00 0.00 1.57 -1.61 0.00 0.00 179.24 179.02 2jsa n HIS 51 N -4.35 0.26 -0.03 0.28 -0.00 0.92 -3.62 115.22 108.67 2jsa n HIS 51 Ca 0.07 -0.13 -0.05 0.00 0.46 0.00 0.00 57.72 58.07 2jsa n HIS 51 Cb 0.49 0.00 -0.03 0.00 -0.12 0.00 0.00 29.99 30.33 2jsa n HIS 51 CO 0.00 0.00 0.00 0.98 0.46 0.00 0.00 176.34 177.78 2jsa n TYR 52 N 0.06 0.00 -1.25 1.57 9.36 0.44 -4.69 117.16 122.65 2jsa n TYR 52 Ca 0.07 0.00 -0.22 0.00 3.32 0.00 0.00 57.90 61.07 2jsa n TYR 52 Cb 0.16 -0.26 -0.11 0.00 -0.63 0.00 0.00 39.34 38.51 2jsa n TYR 52 CO 0.00 0.00 0.00 1.33 0.22 0.00 0.00 176.86 178.41 2jsa n VAL 53 N -2.72 3.46 0.00 2.97 0.24 -0.48 -1.57 118.33 120.23 2jsa n VAL 53 Ca -0.12 -2.26 0.00 0.00 -2.04 0.00 0.00 64.34 59.92 2jsa n VAL 53 Cb 0.62 -2.00 0.00 0.00 -1.47 0.00 0.00 33.84 31.00 2jsa n VAL 53 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 2jsa n ASN 54 N 2.20 0.00 0.00 -1.34 5.15 -1.26 -4.91 115.26 115.10 2jsa n ASN 54 Ca 0.52 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.50 2jsa n ASN 54 Cb 0.67 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.92 2jsa n ASN 54 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 2jsa n SER 55 N 0.00 0.00 -0.11 1.20 7.64 -1.21 -4.93 113.62 116.22 2jsa n SER 55 Ca 0.00 0.00 0.02 0.00 1.01 0.00 0.00 58.87 59.90 2jsa n SER 55 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 2jsa n SER 55 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2jsa n LYS 56 N 0.00 2.03 0.01 1.43 4.76 -0.61 -4.40 118.16 121.38 2jsa n LYS 56 Ca 0.00 -0.46 0.10 0.00 -2.87 0.00 0.00 58.31 55.08 2jsa n LYS 56 Cb 0.00 -0.93 -0.14 0.00 -1.84 0.00 0.00 35.03 32.13 2jsa n LYS 56 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 2jsa n VAL 57 N -0.28 0.16 0.02 -0.18 0.31 -0.81 -2.89 118.33 114.65 2jsa n VAL 57 Ca 0.02 -0.52 -0.18 0.00 -0.01 0.00 0.00 64.34 63.65 2jsa n VAL 57 Cb 0.09 -0.08 -0.13 0.00 -0.91 0.00 0.00 33.84 32.81 2jsa n VAL 57 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 2jsa h ASP 58 N 0.00 0.42 0.02 4.52 3.32 -1.86 -2.94 116.42 119.90 2jsa h ASP 58 Ca -0.02 -0.87 -0.00 0.00 0.02 0.00 0.00 57.03 56.16 2jsa h ASP 58 Cb 1.04 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 40.46 2jsa h ASP 58 CO 0.00 1.25 -0.01 1.55 -1.72 0.00 0.00 179.24 180.31 2jsa h PRO 59 N -0.35 -0.02 -0.65 3.56 0.13 -1.77 -2.44 132.00 130.45 2jsa h PRO 59 Ca -0.09 0.00 0.14 0.00 -0.87 0.00 0.00 66.00 65.17 2jsa h PRO 59 Cb 1.40 0.01 -0.12 0.00 0.13 0.00 0.00 31.00 32.42 2jsa h PRO 59 CO 0.12 0.68 -0.10 0.82 -0.23 0.00 0.00 178.00 179.28 2jsa h ILE 60 N -0.77 0.38 0.00 -3.56 2.04 -1.69 1.48 117.51 115.39 2jsa h ILE 60 Ca -0.00 -0.01 -0.04 0.00 1.00 0.00 0.00 64.86 65.81 2jsa h ILE 60 Cb 0.71 0.34 -0.01 0.00 -0.74 0.00 0.00 36.82 37.13 2jsa h ILE 60 CO 0.00 0.01 -0.17 0.40 0.00 0.00 0.00 178.15 178.39 2jsa h ILE 61 N 0.04 0.70 0.00 -0.67 2.04 -1.59 -0.21 117.51 117.82 2jsa h ILE 61 Ca 0.33 -0.72 0.00 0.00 1.00 0.00 0.00 64.86 65.47 2jsa h ILE 61 Cb 0.52 1.44 0.00 0.00 -0.74 0.00 0.00 36.82 38.05 2jsa h ILE 61 CO -0.63 0.17 0.00 1.12 0.00 0.00 0.00 178.15 178.81 2jsa h HIS 62 N 0.00 0.00 0.00 1.37 2.07 0.25 0.68 115.15 119.51 2jsa h HIS 62 Ca -0.00 0.00 -0.01 0.00 -2.85 0.00 0.00 60.37 57.50 2jsa h HIS 62 Cb 0.43 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 30.41 2jsa h HIS 62 CO 0.00 0.00 -0.14 1.49 -3.07 0.00 0.00 177.93 176.21 2jsa h GLU 63 N 0.00 0.00 -0.18 5.12 4.57 0.94 -2.53 114.58 122.51 2jsa h GLU 63 Ca 0.00 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.17 2jsa h GLU 63 Cb 0.60 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.19 2jsa h GLU 63 CO 0.00 0.30 0.06 -0.07 -1.18 0.00 0.00 179.01 178.13 2jsa h LEU 64 N -1.00 0.25 -2.13 1.64 3.38 -1.52 0.59 115.31 116.53 2jsa h LEU 64 Ca -0.02 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.76 2jsa h LEU 64 Cb 0.39 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.07 2jsa h LEU 64 CO -0.01 0.37 -0.03 1.05 0.09 0.00 0.00 178.44 179.91 2jsa h GLU 65 N 0.12 0.00 0.03 1.13 -0.00 -1.03 -2.03 114.58 112.79 2jsa h GLU 65 Ca 0.06 0.00 -0.22 0.00 -0.00 0.00 0.00 59.36 59.20 2jsa h GLU 65 Cb 0.20 0.00 0.02 0.00 -0.00 0.00 0.00 28.75 28.97 2jsa h GLU 65 CO -0.00 0.03 -0.86 0.78 -0.00 0.00 0.00 179.01 178.96 2jsa h GLY 66 N 0.12 0.60 0.00 1.06 0.00 -0.92 -3.48 103.07 100.46 2jsa h GLY 66 Ca -0.00 -1.10 0.00 0.00 0.00 0.00 0.00 47.33 46.23 2jsa h GLY 66 CO 0.00 0.97 0.00 0.61 0.00 0.00 0.00 176.54 178.13 2jsa n GLY 67 N 1.16 0.28 3.53 4.60 0.00 0.05 -5.07 105.19 109.73 2jsa n GLY 67 Ca -0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.61 2jsa n GLY 67 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2jsa n THR 68 N 0.00 0.00 -3.31 2.61 -1.04 0.19 -4.90 114.28 107.82 2jsa n THR 68 Ca 0.00 -0.28 -0.20 0.00 -2.04 0.00 0.00 64.05 61.53 2jsa n THR 68 Cb 0.00 -0.97 0.00 0.00 -1.82 0.00 0.00 70.33 67.54 2jsa n THR 68 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2jsa s ALA 69 N -2.48 4.13 -2.00 2.41 0.00 -1.26 -3.95 121.76 118.62 2jsa s ALA 69 Ca 0.67 -1.37 0.18 0.00 0.00 0.00 0.00 51.96 51.44 2jsa s ALA 69 Cb -0.24 -1.79 1.07 0.00 0.00 0.00 0.00 23.12 22.16 2jsa s ALA 69 CO 0.63 -0.15 1.53 -0.35 0.00 0.00 0.00 175.76 177.43 2jsa n PRO 70 N -1.77 0.75 0.00 0.00 -0.04 -1.26 -1.82 135.00 130.86 2jsa n PRO 70 Ca 0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.47 2jsa n PRO 70 Cb 0.58 -1.37 0.00 0.00 -0.04 0.00 0.00 33.50 32.67 2jsa n PRO 70 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 2jsa n LYS 71 N -0.87 1.27 -0.00 0.54 -0.00 -1.26 -4.56 118.16 113.27 2jsa n LYS 71 Ca 0.13 -1.02 0.03 0.00 -0.00 0.00 0.00 58.31 57.45 2jsa n LYS 71 Cb 0.06 -0.94 -0.04 0.00 -0.00 0.00 0.00 35.03 34.11 2jsa n LYS 71 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 2jsa n ASP 72 N -0.27 2.08 -0.03 -5.58 9.92 -0.76 -4.61 116.55 117.29 2jsa n ASP 72 Ca 0.00 -0.30 -0.13 0.00 -0.53 0.00 0.00 54.79 53.83 2jsa n ASP 72 Cb 0.18 1.14 -0.08 0.00 -0.64 0.00 0.00 41.12 41.71 2jsa n ASP 72 CO 0.00 0.00 0.00 0.58 0.13 0.00 0.00 177.20 177.91 2jsa h VAL 73 N 0.00 1.36 -0.54 2.53 2.07 -1.71 -1.30 116.25 118.67 2jsa h VAL 73 Ca 0.00 -1.19 -0.39 0.00 0.82 0.00 0.00 66.70 65.94 2jsa h VAL 73 Cb 0.20 2.00 -0.11 0.00 -1.52 0.00 0.00 31.29 31.85 2jsa h VAL 73 CO 0.00 0.33 0.36 0.00 0.02 0.00 0.00 177.57 178.28 2jsa n THR 75 N 1.80 0.00 0.16 0.00 -1.04 -1.18 -3.92 114.28 110.10 2jsa n THR 75 Ca 0.49 0.00 0.01 0.00 -2.04 0.00 0.00 64.05 62.51 2jsa n THR 75 Cb 0.68 -0.00 0.33 0.00 -1.82 0.00 0.00 70.33 69.52 2jsa n THR 75 CO 0.00 0.00 0.00 0.11 -0.64 0.00 0.00 175.07 174.54 2jsa h LYS 76 N 0.00 0.07 -0.61 -2.82 1.57 -1.34 -1.05 116.57 112.40 2jsa h LYS 76 Ca 0.00 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.75 2jsa h LYS 76 Cb 0.00 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2jsa h LYS 76 CO 0.00 0.42 0.00 1.28 -0.57 0.00 0.00 179.45 180.58 2jsa n LEU 77 N -4.10 2.54 -1.61 2.94 7.99 -1.13 -4.84 117.00 118.79 2jsa n LEU 77 Ca -0.02 -1.28 -0.12 0.00 -0.01 0.00 0.00 56.01 54.58 2jsa n LEU 77 Cb 0.41 -0.43 -0.04 0.00 -0.11 0.00 0.00 43.42 43.25 2jsa n LEU 77 CO 0.39 0.43 -0.13 -3.20 -1.51 0.00 0.00 177.39 173.37 2jsa n ASN 78 N 0.36 -3.39 -1.98 -1.43 5.15 -0.40 -4.77 115.26 108.80 2jsa n ASN 78 Ca 0.12 0.28 -0.18 0.00 -0.60 0.00 0.00 54.58 54.20 2jsa n ASN 78 Cb 0.51 -3.12 0.01 0.00 -0.53 0.00 0.00 39.78 36.65 2jsa n ASN 78 CO 0.00 0.00 0.00 1.21 1.40 0.00 0.00 177.26 179.87 2jsa n GLU 79 N -2.04 1.88 0.00 1.20 2.13 -1.26 -4.74 120.64 117.80 2jsa n GLU 79 Ca -0.13 -1.62 0.00 0.00 0.66 0.00 0.00 57.16 56.07 2jsa n GLU 79 Cb 0.45 -1.69 0.00 0.00 0.27 0.00 0.00 31.44 30.47 2jsa n GLU 79 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72