#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 6.19 0.00 6.15 0.15 -1.26 -4.74 113.70 120.19 2jsa s SER 2 Ca 0.00 -1.29 0.00 0.00 0.70 0.00 0.00 55.95 55.36 2jsa s SER 2 Cb 0.00 -2.28 0.00 0.00 -1.71 0.00 0.00 66.02 62.03 2jsa s SER 2 CO 0.00 -1.00 0.00 0.00 1.20 0.00 0.00 173.24 173.44 2jsa n ALA 3 N 6.13 0.00 1.31 5.45 0.00 -1.26 -4.97 120.51 127.17 2jsa n ALA 3 Ca -0.09 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.47 2jsa n ALA 3 Cb 0.43 0.00 0.66 0.00 0.00 0.00 0.00 19.45 20.54 2jsa n ALA 3 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 2jsa n LEU 4 N 0.00 0.00 -0.34 0.00 -0.00 -1.26 -3.30 117.00 112.10 2jsa n LEU 4 Ca 0.00 0.15 0.06 0.00 -0.00 0.00 0.00 56.01 56.22 2jsa n LEU 4 Cb 0.00 -0.15 0.21 0.00 -0.00 0.00 0.00 43.42 43.48 2jsa n LEU 4 CO 0.00 -0.03 1.20 -1.28 -0.00 0.00 0.00 177.39 177.28 2jsa h SER 5 N 0.00 0.84 0.05 1.45 0.87 -1.92 -0.80 113.55 114.04 2jsa h SER 5 Ca 0.00 0.05 0.01 0.00 -1.23 0.00 0.00 61.79 60.61 2jsa h SER 5 Cb 0.12 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 61.95 2jsa h SER 5 CO 0.00 0.45 -0.07 0.00 -0.53 0.00 0.00 176.83 176.68 2jsa h GLN 7 N -0.16 -0.02 -0.85 0.00 -0.00 -1.40 0.24 115.11 112.92 2jsa h GLN 7 Ca 0.01 0.00 0.21 0.00 -0.00 0.00 0.00 58.65 58.87 2jsa h GLN 7 Cb 0.16 0.01 -0.13 0.00 0.00 0.00 0.00 27.48 27.52 2jsa h GLN 7 CO -0.04 -0.02 0.28 0.52 0.00 0.00 0.00 178.83 179.58 2jsa h MET 8 N -0.03 0.29 -0.16 1.69 2.86 -0.88 1.62 114.93 120.32 2jsa h MET 8 Ca 0.30 -0.02 0.05 0.00 -2.06 0.00 0.00 59.70 57.97 2jsa h MET 8 Cb 0.49 -0.06 -0.01 0.00 0.06 0.00 0.00 31.60 32.08 2jsa h MET 8 CO -0.67 0.19 0.12 0.00 1.06 0.00 0.00 176.91 177.61 2jsa n GLU 10 N -4.49 0.33 -0.06 0.00 -0.00 0.54 -2.59 120.64 114.38 2jsa n GLU 10 Ca 0.01 -0.08 -0.22 0.00 -0.00 0.00 0.00 57.16 56.87 2jsa n GLU 10 Cb 0.25 -1.50 -0.12 0.00 -0.00 0.00 0.00 31.44 30.06 2jsa n GLU 10 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.13 178.38 2jsa h LEU 11 N 0.19 0.17 0.25 -1.84 5.85 0.18 -2.80 115.31 117.30 2jsa h LEU 11 Ca 0.00 -0.68 -0.01 0.00 0.84 0.00 0.00 57.88 58.03 2jsa h LEU 11 Cb 0.40 -0.05 0.00 0.00 0.37 0.00 0.00 40.66 41.38 2jsa h LEU 11 CO 0.00 1.62 -0.12 -0.37 -0.34 0.00 0.00 178.44 179.23 2jsa h VAL 12 N -0.60 0.81 0.76 1.05 -1.51 -1.31 -1.27 116.25 114.18 2jsa h VAL 12 Ca -0.37 -0.44 -0.03 0.00 -1.23 0.00 0.00 66.70 64.63 2jsa h VAL 12 Cb 1.58 1.06 -0.00 0.00 -2.13 0.00 0.00 31.29 31.80 2jsa h VAL 12 CO -0.09 0.10 -0.44 -0.37 -1.23 0.00 0.00 177.57 175.53 2jsa h VAL 13 N -0.56 0.11 -1.42 7.19 -1.51 -1.70 0.50 116.25 118.87 2jsa h VAL 13 Ca -0.03 0.00 0.41 0.00 -1.23 0.00 0.00 66.70 65.85 2jsa h VAL 13 Cb 0.41 0.11 -0.06 0.00 -2.13 0.00 0.00 31.29 29.62 2jsa h VAL 13 CO 0.06 0.00 1.01 0.50 -1.23 0.00 0.00 177.57 177.91 2jsa h LYS 14 N -1.12 0.03 0.19 5.19 3.64 -1.52 2.09 116.57 125.06 2jsa h LYS 14 Ca -0.10 -0.00 -0.31 0.00 -1.27 0.00 0.00 60.65 58.97 2jsa h LYS 14 Cb 0.89 -0.01 0.02 0.00 -0.41 0.00 0.00 32.23 32.72 2jsa h LYS 14 CO 0.12 0.02 -1.43 0.87 -2.27 0.00 0.00 179.45 176.75 2jsa h LYS 15 N 0.03 0.40 0.05 1.90 1.79 0.04 -2.86 116.57 117.92 2jsa h LYS 15 Ca 0.69 -0.68 -0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2jsa h LYS 15 Cb 2.68 0.25 0.00 0.00 -1.58 0.00 0.00 32.23 33.59 2jsa h LYS 15 CO -0.05 1.32 -0.02 -0.92 -1.08 0.00 0.00 179.45 178.70 2jsa h TYR 16 N 0.11 -0.06 -1.11 -1.35 3.20 0.77 -0.83 116.97 117.71 2jsa h TYR 16 Ca -0.22 -0.00 0.31 0.00 3.14 0.00 0.00 58.73 61.96 2jsa h TYR 16 Cb 2.08 0.02 -0.10 0.00 1.54 0.00 0.00 36.73 40.27 2jsa h TYR 16 CO 0.10 -0.04 0.71 1.05 -1.64 0.00 0.00 178.16 178.34 2jsa h GLU 17 N -0.29 0.30 -1.47 1.82 -0.00 0.12 0.16 114.58 115.22 2jsa h GLU 17 Ca -0.01 -0.02 -0.62 0.00 -0.00 0.00 0.00 59.36 58.72 2jsa h GLU 17 Cb 0.05 -0.07 -0.39 0.00 -0.00 0.00 0.00 28.75 28.34 2jsa h GLU 17 CO 0.01 0.20 -0.38 0.41 -0.00 0.00 0.00 179.01 179.25 2jsa n GLY 18 N -1.49 5.98 0.12 1.06 0.00 -1.08 -4.70 105.19 105.09 2jsa n GLY 18 Ca 0.28 -2.69 -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 -1.26 0.00 0.00 0.00 173.32 172.06 2jsa n SER 19 N -0.54 1.94 0.00 1.61 2.88 0.56 -4.70 113.62 115.36 2jsa n SER 19 Ca 0.43 0.36 0.00 0.00 -1.33 0.00 0.00 58.87 58.33 2jsa n SER 19 Cb 0.63 -0.82 0.00 0.00 -0.75 0.00 0.00 64.21 63.27 2jsa n SER 19 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2jsa n ALA 20 N -4.17 0.00 0.35 -1.46 0.00 -1.26 -4.76 120.51 109.21 2jsa n ALA 20 Ca -0.41 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.10 2jsa n ALA 20 Cb 0.76 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 20.11 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 1.12 -4.12 0.00 -0.08 -1.26 -4.99 116.55 107.22 2jsa n ASP 21 Ca 0.00 -0.44 -0.32 0.00 -1.51 0.00 0.00 54.79 52.52 2jsa n ASP 21 Cb 0.00 1.32 -0.02 0.00 2.34 0.00 0.00 41.12 44.76 2jsa n ASP 21 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 2jsa n LYS 22 N -1.66 -3.25 -3.98 -0.67 4.76 -1.26 -4.93 118.16 107.17 2jsa n LYS 22 Ca 0.00 0.38 -0.30 0.00 -2.87 0.00 0.00 58.31 55.53 2jsa n LYS 22 Cb 0.30 -4.87 -0.16 0.00 -1.84 0.00 0.00 35.03 28.46 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 -3.70 2.97 0.00 4.39 -1.08 -1.26 -4.97 116.67 113.03 2jsa s ASP 23 Ca 0.46 -0.67 0.18 0.00 -0.52 0.00 0.00 52.55 52.01 2jsa s ASP 23 Cb -0.25 -1.14 0.93 0.00 -1.46 0.00 0.00 42.92 40.99 2jsa s ASP 23 CO 0.91 -0.11 1.56 0.00 0.52 0.00 0.00 175.17 178.05 2jsa n ALA 24 N 4.76 1.98 -0.09 3.66 0.00 -1.26 -0.82 120.51 128.74 2jsa n ALA 24 Ca -0.15 -0.09 -0.18 0.00 0.00 0.00 0.00 53.44 53.02 2jsa n ALA 24 Cb 0.48 -1.30 -0.10 0.00 0.00 0.00 0.00 19.45 18.53 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 0.00 0.85 0.00 2.35 -1.99 -2.95 115.58 113.84 2jsa h ASN 25 Ca 0.00 -0.53 0.00 0.00 -0.55 0.00 0.00 56.30 55.22 2jsa h ASN 25 Cb 0.18 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.55 2jsa h ASN 25 CO 0.00 1.32 0.00 0.52 -1.65 0.00 0.00 177.43 177.62 2jsa n VAL 26 N -4.49 0.15 -0.02 2.81 0.31 -1.13 -2.29 118.33 113.68 2jsa n VAL 26 Ca -0.25 0.04 -0.01 0.00 -0.01 0.00 0.00 64.34 64.11 2jsa n VAL 26 Cb 0.59 -0.58 -0.00 0.00 -0.91 0.00 0.00 33.84 32.94 2jsa n VAL 26 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 2jsa h ILE 27 N 0.00 0.00 -0.88 2.52 2.04 -1.11 -2.69 117.51 117.39 2jsa h ILE 27 Ca 0.00 -0.29 0.19 0.00 1.00 0.00 0.00 64.86 65.76 2jsa h ILE 27 Cb 0.42 0.00 -0.06 0.00 -0.74 0.00 0.00 36.82 36.44 2jsa h ILE 27 CO 0.00 0.00 0.58 0.07 0.00 0.00 0.00 178.15 178.80 2jsa h LYS 28 N -0.29 0.41 -0.42 2.37 2.10 -1.62 0.33 116.57 119.45 2jsa h LYS 28 Ca 0.00 -0.02 -0.07 0.00 -2.00 0.00 0.00 60.65 58.56 2jsa h LYS 28 Cb 0.07 -0.09 -0.01 0.00 -0.90 0.00 0.00 32.23 31.29 2jsa h LYS 28 CO 0.00 0.27 -0.01 0.87 -2.00 0.00 0.00 179.45 178.59 2jsa h LYS 29 N 0.42 0.74 -0.32 0.07 1.57 -1.61 -2.93 116.57 114.52 2jsa h LYS 29 Ca 0.45 -0.24 0.05 0.00 -1.87 0.00 0.00 60.65 59.05 2jsa h LYS 29 Cb 1.10 -0.07 -0.05 0.00 0.08 0.00 0.00 32.23 33.29 2jsa h LYS 29 CO -0.17 0.82 0.02 0.22 -0.57 0.00 0.00 179.45 179.77 2jsa h ASP 30 N 0.58 -0.09 -0.63 0.86 1.82 -0.04 -2.07 116.42 116.84 2jsa h ASP 30 Ca 0.12 0.07 0.11 0.00 -0.39 0.00 0.00 57.03 56.94 2jsa h ASP 30 Cb 0.49 0.11 -0.12 0.00 0.68 0.00 0.00 39.33 40.49 2jsa h ASP 30 CO 0.02 -0.01 -0.33 0.15 -1.61 0.00 0.00 179.24 177.46 2jsa h PHE 31 N 0.11 -0.90 -0.02 0.28 3.04 -1.11 1.65 116.94 119.99 2jsa h PHE 31 Ca 0.15 0.07 0.01 0.00 3.98 0.00 0.00 57.97 62.18 2jsa h PHE 31 Cb 0.19 0.49 -0.00 0.00 2.56 0.00 0.00 35.95 39.19 2jsa h PHE 31 CO -0.21 -0.38 0.03 0.22 -2.02 0.00 0.00 178.31 175.95 2jsa h ASP 32 N -0.14 0.00 0.03 0.41 1.82 -1.30 0.25 116.42 117.50 2jsa h ASP 32 Ca 0.25 0.00 -0.00 0.00 -0.39 0.00 0.00 57.03 56.89 2jsa h ASP 32 Cb 0.55 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.56 2jsa h ASP 32 CO -0.71 0.00 -0.02 0.00 -1.61 0.00 0.00 179.24 176.90 2jsa h ALA 33 N 1.96 -0.39 -0.53 -0.78 0.00 0.30 0.14 119.26 119.94 2jsa h ALA 33 Ca 0.01 -0.01 0.16 0.00 0.00 0.00 0.00 54.91 55.06 2jsa h ALA 33 Cb 0.07 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2jsa h ALA 33 CO -0.00 -0.39 0.44 1.49 0.00 0.00 0.00 179.25 180.79 2jsa h GLU 34 N -0.10 0.00 -0.07 0.00 4.57 -0.74 0.20 114.58 118.45 2jsa h GLU 34 Ca -0.00 0.00 -0.09 0.00 -1.18 0.00 0.00 59.36 58.09 2jsa h GLU 34 Cb 0.04 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.63 2jsa h GLU 34 CO 0.01 0.00 -0.29 0.00 -1.18 0.00 0.00 179.01 177.55 2jsa h LYS 36 N -0.19 0.00 0.00 0.00 1.79 0.23 0.95 116.57 119.35 2jsa h LYS 36 Ca -0.02 0.00 -0.27 0.00 -2.18 0.00 0.00 60.65 58.18 2jsa h LYS 36 Cb 0.94 0.00 -0.05 0.00 -1.58 0.00 0.00 32.23 31.55 2jsa h LYS 36 CO 0.06 0.00 -1.98 1.63 -1.08 0.00 0.00 179.45 178.08 2jsa n LYS 37 N -2.87 0.41 0.21 3.15 5.02 -0.94 -3.90 118.16 119.23 2jsa n LYS 37 Ca -0.02 0.13 -0.08 0.00 -2.02 0.00 0.00 58.31 56.31 2jsa n LYS 37 Cb 0.40 -1.26 -0.04 0.00 -0.02 0.00 0.00 35.03 34.11 2jsa n LYS 37 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 2jsa h LEU 38 N -0.26 -0.46 -3.05 -0.35 5.85 0.48 -3.11 115.31 114.42 2jsa h LEU 38 Ca -0.41 0.02 -0.25 0.00 0.84 0.00 0.00 57.88 58.08 2jsa h LEU 38 Cb 1.51 0.12 -0.13 0.00 0.37 0.00 0.00 40.66 42.53 2jsa h LEU 38 CO -0.15 -0.27 0.32 0.49 -0.34 0.00 0.00 178.44 178.49 2jsa n PHE 39 N -3.77 1.36 0.27 1.25 3.72 0.32 -4.25 117.46 116.36 2jsa n PHE 39 Ca -0.07 -1.34 0.15 0.00 -0.05 0.00 0.00 57.45 56.14 2jsa n PHE 39 Cb 0.21 -0.67 0.70 0.00 -0.94 0.00 0.00 39.48 38.79 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 0.75 0.00 -2.29 1.38 2.07 -1.43 -3.13 115.15 112.50 2jsa h HIS 40 Ca 0.27 0.00 -0.63 0.00 -2.85 0.00 0.00 60.37 57.16 2jsa h HIS 40 Cb 1.54 0.00 -0.39 0.00 2.57 0.00 0.00 27.41 31.13 2jsa h HIS 40 CO 0.72 0.10 -0.34 0.25 -3.07 0.00 0.00 177.93 175.59 2jsa n THR 41 N -3.34 3.55 -3.81 6.12 -2.24 -1.26 -5.01 114.28 108.28 2jsa n THR 41 Ca -0.01 -5.62 -0.12 0.00 -2.27 0.00 0.00 64.05 56.03 2jsa n THR 41 Cb 0.29 -1.51 -0.11 0.00 -2.10 0.00 0.00 70.33 66.90 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 -4.21 0.03 -0.50 2.28 1.01 -1.18 -5.07 121.20 113.55 2jsa s ILE 42 Ca 0.46 -0.23 -0.28 0.00 0.00 0.00 0.00 60.65 60.60 2jsa s ILE 42 Cb 0.25 -0.37 0.01 0.00 0.01 0.00 0.00 42.46 42.35 2jsa s ILE 42 CO -0.12 -0.13 1.47 -2.16 0.00 0.00 0.00 174.94 174.00 2jsa s PRO 43 N -0.43 3.34 0.00 2.79 0.04 -1.26 -2.82 135.00 136.66 2jsa s PRO 43 Ca -0.05 0.67 0.00 0.00 0.04 0.00 0.00 61.00 61.66 2jsa s PRO 43 Cb -0.04 -4.12 0.00 0.00 0.04 0.00 0.00 34.50 30.39 2jsa s PRO 43 CO 0.01 -1.87 0.00 1.19 0.04 0.00 0.00 177.00 176.37 2jsa n PHE 44 N 9.60 0.00 -0.24 0.56 3.72 -1.26 -4.87 117.46 124.97 2jsa n PHE 44 Ca 0.15 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.59 2jsa n PHE 44 Cb 0.49 -0.20 0.17 0.00 -0.94 0.00 0.00 39.48 38.99 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 1.04 1.84 1.37 0.00 -1.79 0.31 103.07 105.84 2jsa h GLY 45 Ca 0.00 -0.10 -0.13 0.00 0.00 0.00 0.00 47.33 47.10 2jsa h GLY 45 CO 0.00 -0.13 -0.54 -0.91 0.00 0.00 0.00 176.54 174.96 2jsa h THR 46 N 0.37 1.37 0.65 4.70 1.35 -1.77 -2.50 112.91 117.08 2jsa h THR 46 Ca 0.40 -1.84 -0.03 0.00 -0.55 0.00 0.00 66.41 64.38 2jsa h THR 46 Cb 0.62 1.93 0.01 0.00 -1.73 0.00 0.00 68.15 68.97 2jsa h THR 46 CO -0.43 0.54 -0.31 0.03 -0.25 0.00 0.00 175.52 175.10 2jsa h ARG 47 N 0.14 -0.85 -0.62 4.72 2.47 -1.04 -2.45 114.38 116.75 2jsa h ARG 47 Ca 0.00 0.06 0.18 0.00 -1.26 0.00 0.00 59.98 58.96 2jsa h ARG 47 Cb 1.00 0.19 -0.02 0.00 -1.65 0.00 0.00 29.97 29.49 2jsa h ARG 47 CO 0.08 -0.56 0.48 1.49 0.56 0.00 0.00 179.97 182.02 2jsa h GLU 48 N -1.12 0.00 0.35 0.04 4.22 -0.60 0.55 114.58 118.02 2jsa h GLU 48 Ca -0.09 0.00 -0.02 0.00 0.08 0.00 0.00 59.36 59.33 2jsa h GLU 48 Cb 0.67 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.93 2jsa h GLU 48 CO 0.15 0.00 -0.17 0.00 -2.18 0.00 0.00 179.01 176.81 2jsa n ASP 50 N -5.26 0.30 -0.81 0.00 -0.08 0.10 0.31 116.55 111.10 2jsa n ASP 50 Ca -0.10 0.61 0.09 0.00 -1.51 0.00 0.00 54.79 53.88 2jsa n ASP 50 Cb 0.23 -0.66 0.12 0.00 2.34 0.00 0.00 41.12 43.15 2jsa n ASP 50 CO 0.00 0.00 0.00 1.41 0.12 0.00 0.00 177.20 178.73 2jsa n HIS 51 N -1.87 0.20 -0.08 -0.67 8.25 -0.20 -4.41 115.22 116.44 2jsa n HIS 51 Ca 0.01 -0.14 -0.14 0.00 -0.26 0.00 0.00 57.72 57.19 2jsa n HIS 51 Cb 0.08 -0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.12 2jsa n HIS 51 CO 0.00 0.00 0.00 0.98 0.64 0.00 0.00 176.34 177.96 2jsa n TYR 52 N 1.06 0.00 0.28 4.41 9.36 0.15 -4.03 117.16 128.39 2jsa n TYR 52 Ca 0.13 0.00 0.16 0.00 3.32 0.00 0.00 57.90 61.50 2jsa n TYR 52 Cb 0.48 -0.61 0.84 0.00 -0.63 0.00 0.00 39.34 39.41 2jsa n TYR 52 CO 0.00 0.00 0.00 -0.39 0.22 0.00 0.00 176.86 176.69 2jsa h VAL 53 N -0.24 0.00 -1.58 2.97 -1.51 -1.36 -0.85 116.25 113.68 2jsa h VAL 53 Ca -0.39 0.00 -0.47 0.00 -1.23 0.00 0.00 66.70 64.61 2jsa h VAL 53 Cb 1.48 0.68 -0.41 0.00 -2.13 0.00 0.00 31.29 30.92 2jsa h VAL 53 CO -0.14 0.00 -1.04 -3.20 -1.23 0.00 0.00 177.57 171.96 2jsa n ASN 54 N -2.71 2.26 0.01 4.19 5.15 -1.26 -4.42 115.26 118.49 2jsa n ASN 54 Ca -0.02 -3.12 0.00 0.00 -0.60 0.00 0.00 54.58 50.84 2jsa n ASN 54 Cb 0.21 -0.55 0.00 0.00 -0.53 0.00 0.00 39.78 38.91 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 -0.06 -0.23 -0.45 1.20 7.64 -0.50 -4.92 113.62 116.30 2jsa n SER 55 Ca 0.22 0.06 0.04 0.00 1.01 0.00 0.00 58.87 60.20 2jsa n SER 55 Cb 0.68 0.58 0.12 0.00 -1.01 0.00 0.00 64.21 64.58 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 -2.45 2.86 -0.12 1.43 4.01 -0.44 -4.58 118.16 118.87 2jsa n LYS 56 Ca 0.00 -1.97 -0.26 0.00 -0.51 0.00 0.00 58.31 55.57 2jsa n LYS 56 Cb 0.00 -1.24 -0.10 0.00 -0.51 0.00 0.00 35.03 33.18 2jsa n LYS 56 CO 0.00 0.00 0.00 0.28 -1.11 0.00 0.00 177.40 176.57 2jsa n VAL 57 N 0.08 1.53 -0.28 -0.18 0.31 -1.07 -2.70 118.33 116.02 2jsa n VAL 57 Ca 0.09 -0.22 0.10 0.00 -0.01 0.00 0.00 64.34 64.29 2jsa n VAL 57 Cb 0.42 -1.96 0.24 0.00 -0.91 0.00 0.00 33.84 31.63 2jsa n VAL 57 CO 0.00 0.00 0.00 -0.78 -1.32 0.00 0.00 176.83 174.73 2jsa h ASP 58 N -1.00 0.09 0.09 4.52 1.82 -1.81 0.82 116.42 120.95 2jsa h ASP 58 Ca -0.54 0.16 -0.00 0.00 -0.39 0.00 0.00 57.03 56.26 2jsa h ASP 58 Cb 1.46 0.20 0.00 0.00 0.68 0.00 0.00 39.33 41.68 2jsa h ASP 58 CO -0.33 -0.06 -0.04 1.55 -1.61 0.00 0.00 179.24 178.75 2jsa h PRO 59 N 0.29 -0.11 -0.23 0.28 0.13 -1.81 -2.42 132.00 128.13 2jsa h PRO 59 Ca 0.49 0.01 0.05 0.00 -0.87 0.00 0.00 66.00 65.68 2jsa h PRO 59 Cb 0.92 0.03 -0.07 0.00 0.13 0.00 0.00 31.00 32.00 2jsa h PRO 59 CO -0.56 0.42 -0.48 0.82 -0.23 0.00 0.00 178.00 177.96 2jsa h ILE 60 N -0.86 0.07 -0.02 -3.56 2.04 -1.15 1.02 117.51 115.05 2jsa h ILE 60 Ca -0.01 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.85 2jsa h ILE 60 Cb 0.58 0.07 -0.00 0.00 -0.74 0.00 0.00 36.82 36.73 2jsa h ILE 60 CO 0.02 0.00 0.06 0.40 0.00 0.00 0.00 178.15 178.63 2jsa h ILE 61 N -0.48 0.15 -0.34 -0.67 2.04 0.51 0.16 117.51 118.88 2jsa h ILE 61 Ca 0.07 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 65.89 2jsa h ILE 61 Cb 0.64 0.94 -0.02 0.00 -0.74 0.00 0.00 36.82 37.64 2jsa h ILE 61 CO -0.48 0.00 0.02 1.12 0.00 0.00 0.00 178.15 178.82 2jsa h HIS 62 N 0.00 0.52 0.02 1.37 2.07 0.16 -0.86 115.15 118.44 2jsa h HIS 62 Ca 0.01 -0.04 -0.00 0.00 -2.85 0.00 0.00 60.37 57.48 2jsa h HIS 62 Cb 0.13 -0.15 0.00 0.00 2.57 0.00 0.00 27.41 29.96 2jsa h HIS 62 CO 0.00 0.50 -0.01 0.93 -3.07 0.00 0.00 177.93 176.28 2jsa h GLU 63 N 0.49 -0.03 -0.93 5.12 4.39 -0.09 -2.96 114.58 120.57 2jsa h GLU 63 Ca 0.11 0.00 0.27 0.00 0.34 0.00 0.00 59.36 60.08 2jsa h GLU 63 Cb 0.28 0.01 -0.15 0.00 -0.10 0.00 0.00 28.75 28.80 2jsa h GLU 63 CO 0.01 0.30 0.37 -0.07 -1.16 0.00 0.00 179.01 178.46 2jsa h LEU 64 N -1.00 0.20 -0.85 1.33 3.38 -1.44 1.24 115.31 118.17 2jsa h LEU 64 Ca -0.00 0.20 -0.04 0.00 0.09 0.00 0.00 57.88 58.12 2jsa h LEU 64 Cb 0.35 0.22 -0.04 0.00 0.09 0.00 0.00 40.66 41.28 2jsa h LEU 64 CO 0.01 -0.15 0.34 -0.33 0.09 0.00 0.00 178.44 178.39 2jsa h GLU 65 N 0.25 1.18 -0.65 1.13 5.08 -1.25 -2.37 114.58 117.95 2jsa h GLU 65 Ca 0.63 -0.20 -0.02 0.00 -1.00 0.00 0.00 59.36 58.77 2jsa h GLU 65 Cb 1.35 -0.20 -0.03 0.00 0.50 0.00 0.00 28.75 30.37 2jsa h GLU 65 CO -0.64 0.94 0.31 0.78 -1.00 0.00 0.00 179.01 179.39 2jsa h GLY 66 N 1.17 0.98 0.00 -3.84 0.00 0.16 -3.46 103.07 98.09 2jsa h GLY 66 Ca 0.27 -0.47 0.00 0.00 0.00 0.00 0.00 47.33 47.13 2jsa h GLY 66 CO -0.03 0.44 0.00 0.61 0.00 0.00 0.00 176.54 177.57 2jsa n GLY 67 N -1.12 0.35 3.64 4.60 0.00 -0.24 -5.11 105.19 107.31 2jsa n GLY 67 Ca 0.06 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.78 2jsa n GLY 67 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2jsa s THR 68 N -0.14 2.08 0.60 2.61 2.01 -0.99 -4.95 115.64 116.87 2jsa s THR 68 Ca 0.00 0.03 -0.09 0.00 0.31 0.00 0.00 61.69 61.94 2jsa s THR 68 Cb 0.00 -2.07 -0.02 0.00 0.01 0.00 0.00 72.50 70.43 2jsa s THR 68 CO 0.00 -0.04 0.97 0.00 -0.69 0.00 0.00 174.62 174.86 2jsa s ALA 69 N -2.62 3.16 -1.32 7.40 0.00 -1.26 -4.26 121.76 122.86 2jsa s ALA 69 Ca 0.67 -0.36 0.23 0.00 0.00 0.00 0.00 51.96 52.49 2jsa s ALA 69 Cb -0.23 -2.86 1.10 0.00 0.00 0.00 0.00 23.12 21.12 2jsa s ALA 69 CO 0.59 -0.74 1.73 -0.35 0.00 0.00 0.00 175.76 177.00 2jsa n PRO 70 N -2.67 0.24 -0.02 0.00 -0.04 -1.26 -1.04 135.00 130.22 2jsa n PRO 70 Ca 0.05 0.08 0.02 0.00 -0.04 0.00 0.00 63.50 63.61 2jsa n PRO 70 Cb 0.56 -1.50 0.02 0.00 -0.04 0.00 0.00 33.50 32.54 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 -1.34 0.77 -0.04 0.54 0.00 -1.26 -4.55 118.16 112.28 2jsa n LYS 71 Ca 0.09 -1.05 -0.03 0.00 -0.00 0.00 0.00 58.31 57.32 2jsa n LYS 71 Cb 0.20 -1.07 -0.06 0.00 -0.00 0.00 0.00 35.03 34.10 2jsa n LYS 71 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 2jsa n ASP 72 N 0.03 3.12 0.00 -5.58 2.03 -0.90 -4.50 116.55 110.75 2jsa n ASP 72 Ca 0.02 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.33 2jsa n ASP 72 Cb 0.16 0.71 0.00 0.00 -0.72 0.00 0.00 41.12 41.28 2jsa n ASP 72 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 2jsa n VAL 73 N -2.26 0.00 -0.27 5.18 0.31 -0.20 -0.22 118.33 120.86 2jsa n VAL 73 Ca -0.12 0.31 0.11 0.00 -0.01 0.00 0.00 64.34 64.63 2jsa n VAL 73 Cb 0.73 -0.95 0.21 0.00 -0.91 0.00 0.00 33.84 32.91 2jsa n VAL 73 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2jsa n THR 75 N -5.13 0.00 0.22 0.00 -1.04 -0.90 0.19 114.28 107.63 2jsa n THR 75 Ca 0.17 1.31 0.08 0.00 -2.04 0.00 0.00 64.05 63.58 2jsa n THR 75 Cb 0.57 -1.76 0.52 0.00 -1.82 0.00 0.00 70.33 67.85 2jsa n THR 75 CO 0.00 0.00 0.00 0.07 -0.64 0.00 0.00 175.07 174.50 2jsa h LYS 76 N 0.00 0.00 0.00 -2.82 2.10 0.25 -0.77 116.57 115.33 2jsa h LYS 76 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2jsa h LYS 76 Cb 0.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.33 2jsa h LYS 76 CO 0.00 0.24 0.00 1.28 -2.00 0.00 0.00 179.45 178.97 2jsa n LEU 77 N -3.71 0.00 -2.28 7.07 7.99 0.20 -4.82 117.00 121.44 2jsa n LEU 77 Ca -0.01 0.00 -0.02 0.00 -0.01 0.00 0.00 56.01 55.97 2jsa n LEU 77 Cb 0.35 0.00 -0.00 0.00 -0.11 0.00 0.00 43.42 43.66 2jsa n LEU 77 CO 0.34 0.00 -0.03 0.59 -1.51 0.00 0.00 177.39 176.78 2jsa n ASN 78 N -0.51 -1.37 -3.67 -1.43 4.13 0.51 -4.78 115.26 108.14 2jsa n ASN 78 Ca 0.01 0.39 -0.37 0.00 1.68 0.00 0.00 54.58 56.29 2jsa n ASN 78 Cb 0.00 -1.34 -0.01 0.00 -1.54 0.00 0.00 39.78 36.89 2jsa n ASN 78 CO 0.00 0.00 0.00 1.21 0.28 0.00 0.00 177.26 178.75 2jsa n GLU 79 N -2.35 4.10 0.00 3.52 0.00 0.91 -4.49 120.64 122.33 2jsa n GLU 79 Ca -0.02 -4.64 0.00 0.00 0.00 0.00 0.00 57.16 52.49 2jsa n GLU 79 Cb 0.45 -2.41 0.00 0.00 0.00 0.00 0.00 31.44 29.48 2jsa n GLU 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13