#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jsa n SER 2 N 0.00 1.86 0.01 0.55 2.88 -1.26 -4.46 113.62 113.20 2jsa n SER 2 Ca 0.00 -3.13 0.00 0.00 -1.33 0.00 0.00 58.87 54.41 2jsa n SER 2 Cb 0.00 -0.42 0.00 0.00 -0.75 0.00 0.00 64.21 63.04 2jsa n SER 2 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2jsa n ALA 3 N -1.11 0.00 -0.32 -1.46 0.00 -1.26 -4.97 120.51 111.40 2jsa n ALA 3 Ca 0.15 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.67 2jsa n ALA 3 Cb 0.68 0.00 0.19 0.00 0.00 0.00 0.00 19.45 20.32 2jsa n ALA 3 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2jsa n LEU 4 N -2.67 -0.23 -0.00 0.00 4.32 -1.26 0.90 117.00 118.06 2jsa n LEU 4 Ca 0.00 1.55 -0.08 0.00 -0.02 0.00 0.00 56.01 57.46 2jsa n LEU 4 Cb 0.00 -0.51 -0.05 0.00 -1.62 0.00 0.00 43.42 41.23 2jsa n LEU 4 CO 0.00 -1.53 0.50 0.77 -1.22 0.00 0.00 177.39 175.92 2jsa h SER 5 N 0.00 -0.95 0.14 -1.43 4.64 -1.87 1.00 113.55 115.09 2jsa h SER 5 Ca 0.48 0.11 -0.01 0.00 -0.47 0.00 0.00 61.79 61.91 2jsa h SER 5 Cb 0.87 0.37 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 2jsa h SER 5 CO -0.90 -0.27 -0.07 0.00 -0.87 0.00 0.00 176.83 174.73 2jsa n GLN 7 N -2.52 -0.19 -0.28 0.00 1.13 0.26 0.20 117.38 115.98 2jsa n GLN 7 Ca -0.02 0.87 0.08 0.00 -1.94 0.00 0.00 57.00 55.98 2jsa n GLN 7 Cb 0.07 -1.29 0.19 0.00 0.11 0.00 0.00 30.24 29.33 2jsa n GLN 7 CO 0.00 0.00 0.00 0.52 -1.44 0.00 0.00 177.06 176.14 2jsa h MET 8 N 0.00 0.11 -0.30 -1.09 2.86 0.11 1.71 114.93 118.32 2jsa h MET 8 Ca 0.07 -0.01 -0.00 0.00 -2.06 0.00 0.00 59.70 57.70 2jsa h MET 8 Cb 0.18 -0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.80 2jsa h MET 8 CO -0.40 0.07 0.16 0.00 1.06 0.00 0.00 176.91 177.80 2jsa n GLU 10 N -4.46 0.52 -0.03 0.00 1.02 0.55 -2.08 120.64 116.17 2jsa n GLU 10 Ca 0.01 -0.03 -0.21 0.00 -0.02 0.00 0.00 57.16 56.92 2jsa n GLU 10 Cb 0.09 -1.50 -0.13 0.00 -0.02 0.00 0.00 31.44 29.88 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 -1.21 2.71 -0.03 -4.62 7.94 0.14 -2.77 117.00 119.15 2jsa n LEU 11 Ca 0.15 0.13 -0.13 0.00 -1.11 0.00 0.00 56.01 55.05 2jsa n LEU 11 Cb 0.23 -1.07 -0.11 0.00 0.53 0.00 0.00 43.42 43.00 2jsa n LEU 11 CO 0.23 0.87 0.55 -0.37 -1.11 0.00 0.00 177.39 177.56 2jsa h VAL 12 N 0.04 1.51 0.81 1.96 -1.51 -1.25 -2.58 116.25 115.23 2jsa h VAL 12 Ca -0.46 -1.54 -0.04 0.00 -1.23 0.00 0.00 66.70 63.43 2jsa h VAL 12 Cb 1.99 2.53 0.01 0.00 -2.13 0.00 0.00 31.29 33.69 2jsa h VAL 12 CO 0.04 0.40 -0.39 -0.37 -1.23 0.00 0.00 177.57 176.03 2jsa h VAL 13 N -0.60 0.16 -1.31 7.19 -1.51 -1.62 0.41 116.25 118.96 2jsa h VAL 13 Ca -0.00 -0.09 0.39 0.00 -1.23 0.00 0.00 66.70 65.77 2jsa h VAL 13 Cb 0.67 0.17 -0.09 0.00 -2.13 0.00 0.00 31.29 29.91 2jsa h VAL 13 CO 0.01 0.01 0.89 0.50 -1.23 0.00 0.00 177.57 177.74 2jsa h LYS 14 N -1.16 0.13 0.13 5.19 3.64 -1.63 1.87 116.57 124.74 2jsa h LYS 14 Ca -0.11 -0.01 -0.30 0.00 -1.27 0.00 0.00 60.65 58.96 2jsa h LYS 14 Cb 0.84 -0.03 0.03 0.00 -0.41 0.00 0.00 32.23 32.66 2jsa h LYS 14 CO 0.18 0.08 -1.25 0.87 -2.27 0.00 0.00 179.45 177.06 2jsa h LYS 15 N 0.13 0.62 0.06 1.90 1.79 -0.95 -3.01 116.57 117.11 2jsa h LYS 15 Ca 0.72 -0.84 -0.00 0.00 -2.18 0.00 0.00 60.65 58.35 2jsa h LYS 15 Cb 2.41 0.28 0.00 0.00 -1.58 0.00 0.00 32.23 33.34 2jsa h LYS 15 CO -0.24 1.39 -0.03 -0.92 -1.08 0.00 0.00 179.45 178.57 2jsa h TYR 16 N 0.26 -0.08 -0.98 -1.35 3.20 0.67 0.86 116.97 119.55 2jsa h TYR 16 Ca -0.19 -0.00 0.40 0.00 3.14 0.00 0.00 58.73 62.07 2jsa h TYR 16 Cb 1.93 0.03 -0.18 0.00 1.54 0.00 0.00 36.73 40.04 2jsa h TYR 16 CO 0.12 -0.05 0.48 0.39 -1.64 0.00 0.00 178.16 177.46 2jsa n GLU 17 N -2.68 -0.06 -2.40 1.82 -0.58 0.50 0.69 120.64 117.92 2jsa n GLU 17 Ca -0.01 1.37 -0.27 0.00 -0.42 0.00 0.00 57.16 57.83 2jsa n GLU 17 Cb 0.03 -2.43 0.00 0.00 -0.57 0.00 0.00 31.44 28.47 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 -1.28 6.03 0.06 0.62 0.00 -1.14 -4.78 105.19 104.70 2jsa n GLY 18 Ca 0.36 -2.75 -0.08 0.00 0.00 0.00 0.00 46.02 43.56 2jsa n GLY 18 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2jsa h SER 19 N 2.55 0.00 0.00 1.61 4.64 0.28 -3.44 113.55 119.19 2jsa h SER 19 Ca 0.32 -0.51 0.00 0.00 -0.47 0.00 0.00 61.79 61.13 2jsa h SER 19 Cb 0.95 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.04 2jsa h SER 19 CO 0.87 0.78 0.00 0.00 -0.87 0.00 0.00 176.83 177.61 2jsa n ALA 20 N -2.73 0.00 0.15 5.18 0.00 -1.26 -4.71 120.51 117.14 2jsa n ALA 20 Ca -0.06 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.40 2jsa n ALA 20 Cb 0.26 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.70 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 0.25 -3.67 0.00 2.03 -1.26 -5.04 116.55 108.85 2jsa n ASP 21 Ca 0.00 -0.62 -0.22 0.00 0.52 0.00 0.00 54.79 54.47 2jsa n ASP 21 Cb 0.00 0.92 0.00 0.00 -0.72 0.00 0.00 41.12 41.32 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 -0.97 -1.54 -3.28 -0.67 4.76 -1.26 -4.97 118.16 110.22 2jsa n LYS 22 Ca 0.01 0.90 -0.05 0.00 -2.87 0.00 0.00 58.31 56.30 2jsa n LYS 22 Cb 0.05 -2.78 -0.06 0.00 -1.84 0.00 0.00 35.03 30.41 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 -2.92 -0.29 0.18 4.39 2.15 -1.26 -4.99 116.67 113.93 2jsa s ASP 23 Ca 0.02 0.39 0.14 0.00 0.43 0.00 0.00 52.55 53.53 2jsa s ASP 23 Cb -0.00 1.46 0.71 0.00 -0.30 0.00 0.00 42.92 44.79 2jsa s ASP 23 CO 0.87 -0.29 1.42 0.00 -0.17 0.00 0.00 175.17 177.01 2jsa n ALA 24 N 5.39 1.12 0.12 3.66 0.00 -1.26 -0.76 120.51 128.78 2jsa n ALA 24 Ca -0.02 0.11 -0.24 0.00 0.00 0.00 0.00 53.44 53.28 2jsa n ALA 24 Cb 0.50 -1.21 -0.15 0.00 0.00 0.00 0.00 19.45 18.60 2jsa n ALA 24 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 2jsa h ASN 25 N 0.00 0.88 0.32 0.00 -0.73 -1.98 -1.00 115.58 113.06 2jsa h ASN 25 Ca 0.00 -0.87 0.00 0.00 1.87 0.00 0.00 56.30 57.30 2jsa h ASN 25 Cb 0.05 -0.28 0.00 0.00 0.27 0.00 0.00 38.32 38.36 2jsa h ASN 25 CO 0.00 1.67 -0.14 0.52 -0.37 0.00 0.00 177.43 179.12 2jsa n VAL 26 N -3.76 0.00 -0.12 2.57 0.31 0.07 -2.31 118.33 115.09 2jsa n VAL 26 Ca -0.15 -0.08 -0.24 0.00 -0.01 0.00 0.00 64.34 63.86 2jsa n VAL 26 Cb 1.05 0.02 -0.10 0.00 -0.91 0.00 0.00 33.84 33.90 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 -0.86 1.53 0.16 2.52 5.41 -0.33 -2.66 119.36 125.12 2jsa n ILE 27 Ca 0.14 -0.15 0.01 0.00 1.00 0.00 0.00 62.75 63.75 2jsa n ILE 27 Cb 0.29 -2.00 0.33 0.00 -0.71 0.00 0.00 39.64 37.55 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 0.08 -0.00 0.38 2.10 -1.28 -1.22 116.57 115.62 2jsa h LYS 28 Ca -0.47 -0.03 -0.02 0.00 -2.00 0.00 0.00 60.65 58.14 2jsa h LYS 28 Cb 1.39 -0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.72 2jsa h LYS 28 CO -0.28 0.43 -0.06 0.87 -2.00 0.00 0.00 179.45 178.41 2jsa h LYS 29 N 0.07 0.04 -0.33 0.07 1.57 -1.64 -2.93 116.57 113.41 2jsa h LYS 29 Ca 0.01 -0.04 0.07 0.00 -1.87 0.00 0.00 60.65 58.81 2jsa h LYS 29 Cb 0.68 0.01 -0.07 0.00 0.08 0.00 0.00 32.23 32.93 2jsa h LYS 29 CO 0.05 0.79 -0.11 -0.44 -0.57 0.00 0.00 179.45 179.17 2jsa h ASP 30 N -0.68 -0.39 -0.95 0.86 3.32 -1.36 0.77 116.42 117.99 2jsa h ASP 30 Ca -0.01 0.11 0.17 0.00 0.02 0.00 0.00 57.03 57.32 2jsa h ASP 30 Cb 0.80 0.24 -0.08 0.00 0.22 0.00 0.00 39.33 40.51 2jsa h ASP 30 CO 0.01 -0.14 0.60 0.15 -1.72 0.00 0.00 179.24 178.14 2jsa h PHE 31 N -0.04 0.89 -0.01 4.55 3.04 -1.29 0.57 116.94 124.64 2jsa h PHE 31 Ca 0.16 0.03 -0.07 0.00 3.98 0.00 0.00 57.97 62.07 2jsa h PHE 31 Cb 0.29 -0.27 -0.01 0.00 2.56 0.00 0.00 35.95 38.52 2jsa h PHE 31 CO -0.33 0.27 -0.32 0.22 -2.02 0.00 0.00 178.31 176.13 2jsa h ASP 32 N 0.70 0.02 0.00 0.41 3.58 -0.70 0.60 116.42 121.04 2jsa h ASP 32 Ca 0.50 -0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.95 2jsa h ASP 32 Cb 0.85 -0.01 0.00 0.00 1.72 0.00 0.00 39.33 41.89 2jsa h ASP 32 CO -0.27 0.34 0.00 0.00 -2.88 0.00 0.00 179.24 176.44 2jsa n ALA 33 N -2.48 -0.22 -0.33 -0.78 0.00 0.19 -0.38 120.51 116.51 2jsa n ALA 33 Ca -0.02 0.00 0.17 0.00 0.00 0.00 0.00 53.44 53.59 2jsa n ALA 33 Cb 0.37 0.00 0.37 0.00 0.00 0.00 0.00 19.45 20.19 2jsa n ALA 33 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2jsa h GLU 34 N 0.00 0.51 0.53 0.00 4.57 -1.40 0.14 114.58 118.93 2jsa h GLU 34 Ca 0.00 -0.03 -0.02 0.00 -1.18 0.00 0.00 59.36 58.13 2jsa h GLU 34 Cb 0.00 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 28.48 2jsa h GLU 34 CO 0.00 0.34 -0.28 0.00 -1.18 0.00 0.00 179.01 177.88 2jsa n LYS 36 N -5.43 0.00 0.00 0.00 5.02 0.49 0.12 118.16 118.36 2jsa n LYS 36 Ca -0.12 0.25 0.00 0.00 -2.02 0.00 0.00 58.31 56.42 2jsa n LYS 36 Cb 0.32 -1.51 0.00 0.00 -0.02 0.00 0.00 35.03 33.82 2jsa n LYS 36 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2jsa n LYS 37 N -1.24 0.00 -0.02 1.97 4.76 0.44 -4.09 118.16 119.99 2jsa n LYS 37 Ca 0.00 0.00 -0.11 0.00 -2.87 0.00 0.00 58.31 55.33 2jsa n LYS 37 Cb 0.01 -0.23 -0.05 0.00 -1.84 0.00 0.00 35.03 32.92 2jsa n LYS 37 CO 0.00 0.00 0.00 1.37 -1.37 0.00 0.00 177.40 177.40 2jsa h LEU 38 N 0.00 0.15 -2.87 -0.35 -0.00 0.46 -2.07 115.31 110.64 2jsa h LEU 38 Ca 0.00 -0.07 -0.17 0.00 -0.00 0.00 0.00 57.88 57.64 2jsa h LEU 38 Cb 0.00 -0.04 -0.09 0.00 -0.00 0.00 0.00 40.66 40.54 2jsa h LEU 38 CO 0.00 0.18 0.21 0.49 -0.00 0.00 0.00 178.44 179.33 2jsa n PHE 39 N -4.96 0.89 0.01 0.17 3.72 0.33 -3.88 117.46 113.73 2jsa n PHE 39 Ca -0.05 -1.17 -0.18 0.00 -0.05 0.00 0.00 57.45 56.00 2jsa n PHE 39 Cb 0.07 -0.58 -0.14 0.00 -0.94 0.00 0.00 39.48 37.88 2jsa n PHE 39 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 2jsa h HIS 40 N 0.70 0.37 0.00 1.38 2.76 -1.21 -3.12 115.15 116.03 2jsa h HIS 40 Ca 0.18 -0.27 -0.02 0.00 -2.20 0.00 0.00 60.37 58.06 2jsa h HIS 40 Cb 1.28 -0.01 -0.00 0.00 1.55 0.00 0.00 27.41 30.23 2jsa h HIS 40 CO 0.50 1.54 -0.09 1.79 -1.30 0.00 0.00 177.93 180.37 2jsa h THR 41 N 0.06 0.53 -3.93 6.26 1.35 -1.76 -3.43 112.91 111.98 2jsa h THR 41 Ca -0.37 -0.41 -0.53 0.00 -0.55 0.00 0.00 66.41 64.55 2jsa h THR 41 Cb 2.03 1.27 0.09 0.00 -1.73 0.00 0.00 68.15 69.81 2jsa h THR 41 CO 0.10 0.09 0.73 -0.63 -0.25 0.00 0.00 175.52 175.56 2jsa s ILE 42 N -4.27 2.28 -2.00 6.82 1.01 -1.25 -4.86 121.20 118.92 2jsa s ILE 42 Ca -0.03 0.28 0.23 0.00 0.00 0.00 0.00 60.65 61.12 2jsa s ILE 42 Cb 0.13 -3.18 0.64 0.00 0.01 0.00 0.00 42.46 40.07 2jsa s ILE 42 CO 0.57 0.07 1.73 -0.81 0.00 0.00 0.00 174.94 176.50 2jsa n PRO 43 N 0.55 0.75 -0.47 2.79 -0.04 -1.26 -3.15 135.00 134.16 2jsa n PRO 43 Ca 0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.47 2jsa n PRO 43 Cb 0.40 -1.47 0.00 0.00 -0.04 0.00 0.00 33.50 32.39 2jsa n PRO 43 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2jsa n PHE 44 N -0.97 0.00 0.29 0.54 3.72 -1.26 -4.96 117.46 114.82 2jsa n PHE 44 Ca 0.17 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.44 2jsa n PHE 44 Cb 0.08 0.18 -0.07 0.00 -0.94 0.00 0.00 39.48 38.73 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 -0.81 0.80 1.37 0.00 -1.67 -1.17 103.07 101.60 2jsa h GLY 45 Ca 0.00 0.30 0.13 0.00 0.00 0.00 0.00 47.33 47.76 2jsa h GLY 45 CO 0.00 -0.29 0.47 -0.91 0.00 0.00 0.00 176.54 175.81 2jsa h THR 46 N -1.13 0.84 -0.05 4.70 1.35 -1.79 0.60 112.91 117.43 2jsa h THR 46 Ca -0.08 -0.15 -0.01 0.00 -0.55 0.00 0.00 66.41 65.63 2jsa h THR 46 Cb 0.63 0.37 -0.00 0.00 -1.73 0.00 0.00 68.15 67.42 2jsa h THR 46 CO 0.13 0.08 0.01 0.03 -0.25 0.00 0.00 175.52 175.51 2jsa h ARG 47 N 0.43 0.09 0.00 4.72 2.47 -1.90 -2.77 114.38 117.42 2jsa h ARG 47 Ca 0.34 -0.03 -0.06 0.00 -1.26 0.00 0.00 59.98 58.98 2jsa h ARG 47 Cb 0.73 -0.01 -0.01 0.00 -1.65 0.00 0.00 29.97 29.03 2jsa h ARG 47 CO -0.11 0.34 -0.28 0.93 0.56 0.00 0.00 179.97 181.41 2jsa h GLU 48 N -0.17 0.00 0.08 0.04 3.07 0.07 -2.18 114.58 115.49 2jsa h GLU 48 Ca 0.02 0.00 0.02 0.00 -0.50 0.00 0.00 59.36 58.90 2jsa h GLU 48 Cb 0.30 0.00 -0.04 0.00 -0.84 0.00 0.00 28.75 28.16 2jsa h GLU 48 CO 0.00 0.28 -0.34 0.00 -1.40 0.00 0.00 179.01 177.56 2jsa h ASP 50 N -0.54 0.00 -0.07 0.00 3.58 -1.46 -2.09 116.42 115.85 2jsa h ASP 50 Ca 0.04 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.49 2jsa h ASP 50 Cb 0.59 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.64 2jsa h ASP 50 CO -0.22 0.00 0.00 1.57 -2.88 0.00 0.00 179.24 177.71 2jsa n HIS 51 N -2.51 0.08 -0.03 0.28 -0.00 0.32 -3.91 115.22 109.44 2jsa n HIS 51 Ca 0.03 -0.04 -0.05 0.00 0.46 0.00 0.00 57.72 58.12 2jsa n HIS 51 Cb 0.36 0.00 -0.03 0.00 -0.12 0.00 0.00 29.99 30.20 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 -0.10 0.00 -1.00 1.57 9.36 0.14 -4.61 117.16 122.52 2jsa n TYR 52 Ca 0.18 0.00 -0.13 0.00 3.32 0.00 0.00 57.90 61.27 2jsa n TYR 52 Cb 0.26 -0.25 -0.13 0.00 -0.63 0.00 0.00 39.34 38.59 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 -2.86 2.93 0.00 2.97 0.24 -0.86 -1.00 118.33 119.74 2jsa n VAL 53 Ca -0.12 -1.57 0.00 0.00 -2.04 0.00 0.00 64.34 60.61 2jsa n VAL 53 Cb 0.61 -1.89 0.00 0.00 -1.47 0.00 0.00 33.84 31.10 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 2.16 0.00 0.00 -1.34 5.15 -1.26 -4.90 115.26 115.07 2jsa n ASN 54 Ca 0.39 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.37 2jsa n ASN 54 Cb 0.82 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 40.07 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 -0.01 1.20 7.64 -1.21 -4.93 113.62 116.32 2jsa n SER 55 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 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 5.10 -0.13 1.43 4.76 -0.17 -4.52 118.16 124.63 2jsa n LYS 56 Ca 0.00 -0.12 -0.27 0.00 -2.87 0.00 0.00 58.31 55.05 2jsa n LYS 56 Cb 0.00 -0.64 -0.11 0.00 -1.84 0.00 0.00 35.03 32.45 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 -0.78 1.53 -0.26 -0.18 0.31 -0.39 -2.83 118.33 115.72 2jsa n VAL 57 Ca 0.00 -0.35 0.05 0.00 -0.01 0.00 0.00 64.34 64.04 2jsa n VAL 57 Cb 0.01 -1.86 0.19 0.00 -0.91 0.00 0.00 33.84 31.28 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 -0.86 0.30 0.17 4.52 5.19 -1.84 0.35 116.42 124.26 2jsa h ASP 58 Ca -0.62 0.11 -0.01 0.00 -0.62 0.00 0.00 57.03 55.89 2jsa h ASP 58 Cb 1.60 0.08 0.00 0.00 0.18 0.00 0.00 39.33 41.20 2jsa h ASP 58 CO -0.34 0.11 -0.08 1.55 -3.12 0.00 0.00 179.24 177.36 2jsa h PRO 59 N 0.46 -0.22 -0.71 3.56 0.13 -1.79 -2.68 132.00 130.75 2jsa h PRO 59 Ca 0.42 0.02 0.10 0.00 -0.87 0.00 0.00 66.00 65.67 2jsa h PRO 59 Cb 0.64 0.05 -0.12 0.00 0.13 0.00 0.00 31.00 31.70 2jsa h PRO 59 CO -0.40 0.10 -0.43 0.82 -0.23 0.00 0.00 178.00 177.86 2jsa h ILE 60 N -0.98 0.07 -0.06 -3.56 2.04 -1.33 2.44 117.51 116.13 2jsa h ILE 60 Ca -0.02 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.85 2jsa h ILE 60 Cb 0.43 0.07 -0.00 0.00 -0.74 0.00 0.00 36.82 36.58 2jsa h ILE 60 CO 0.04 0.00 0.07 0.40 0.00 0.00 0.00 178.15 178.66 2jsa h ILE 61 N -0.15 0.46 0.00 -0.67 2.04 -0.42 0.25 117.51 119.02 2jsa h ILE 61 Ca 0.22 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 66.05 2jsa h ILE 61 Cb 0.55 0.94 -0.00 0.00 -0.74 0.00 0.00 36.82 37.57 2jsa h ILE 61 CO -0.77 0.00 -0.13 1.12 0.00 0.00 0.00 178.15 178.36 2jsa h HIS 62 N 0.00 0.00 0.01 1.37 2.07 0.45 0.19 115.15 119.24 2jsa h HIS 62 Ca 0.03 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.55 2jsa h HIS 62 Cb 0.17 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.15 2jsa h HIS 62 CO 0.00 0.13 -0.01 0.93 -3.07 0.00 0.00 177.93 175.92 2jsa h GLU 63 N 0.00 -0.02 -0.78 5.12 4.39 0.17 -2.24 114.58 121.22 2jsa h GLU 63 Ca -0.00 0.00 0.03 0.00 0.34 0.00 0.00 59.36 59.73 2jsa h GLU 63 Cb 0.25 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.86 2jsa h GLU 63 CO 0.02 0.78 0.51 -0.07 -1.16 0.00 0.00 179.01 179.09 2jsa h LEU 64 N -0.88 0.83 -1.12 1.33 3.38 -1.32 0.26 115.31 117.79 2jsa h LEU 64 Ca -0.00 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.87 2jsa h LEU 64 Cb 0.80 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 2jsa h LEU 64 CO 0.00 0.58 -0.40 -0.33 0.09 0.00 0.00 178.44 178.38 2jsa h GLU 65 N 0.97 0.00 0.14 1.13 5.08 -0.70 -3.03 114.58 118.17 2jsa h GLU 65 Ca 0.31 0.00 -0.29 0.00 -1.00 0.00 0.00 59.36 58.38 2jsa h GLU 65 Cb 0.03 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.31 2jsa h GLU 65 CO -0.09 0.40 -1.22 0.78 -1.00 0.00 0.00 179.01 177.88 2jsa h GLY 66 N 1.53 0.66 0.00 -3.84 0.00 -0.27 -3.48 103.07 97.67 2jsa h GLY 66 Ca -0.00 -1.42 0.00 0.00 0.00 0.00 0.00 47.33 45.90 2jsa h GLY 66 CO 0.05 1.25 0.00 0.61 0.00 0.00 0.00 176.54 178.45 2jsa n GLY 67 N 1.45 0.55 3.77 4.60 0.00 0.67 -5.09 105.19 111.14 2jsa n GLY 67 Ca -0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.48 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 0.00 2.18 0.94 2.61 2.01 0.17 -4.92 115.64 118.62 2jsa s THR 68 Ca 0.00 0.16 -0.12 0.00 0.31 0.00 0.00 61.69 62.04 2jsa s THR 68 Cb 0.00 -3.09 0.15 0.00 0.01 0.00 0.00 72.50 69.57 2jsa s THR 68 CO 0.00 0.02 1.10 0.00 -0.69 0.00 0.00 174.62 175.06 2jsa s ALA 69 N -1.21 1.40 -0.10 7.40 0.00 -1.26 -3.71 121.76 124.28 2jsa s ALA 69 Ca 0.60 -0.31 0.25 0.00 0.00 0.00 0.00 51.96 52.50 2jsa s ALA 69 Cb -0.43 -3.12 0.74 0.00 0.00 0.00 0.00 23.12 20.32 2jsa s ALA 69 CO 0.55 -2.50 1.75 -1.00 0.00 0.00 0.00 175.76 174.56 2jsa h PRO 70 N -1.65 0.00 -0.63 0.00 0.13 -1.98 -2.07 132.00 125.81 2jsa h PRO 70 Ca -0.52 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.61 2jsa h PRO 70 Cb 1.31 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.44 2jsa h PRO 70 CO 0.58 0.13 0.00 1.63 -0.23 0.00 0.00 178.00 180.11 2jsa n LYS 71 N -3.19 2.49 -0.03 0.86 5.02 -1.26 -4.01 118.16 118.03 2jsa n LYS 71 Ca 0.02 -2.25 -0.04 0.00 -2.02 0.00 0.00 58.31 54.02 2jsa n LYS 71 Cb 0.47 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 33.94 2jsa n LYS 71 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2jsa n ASP 72 N 1.31 3.52 -0.34 4.39 9.92 -0.97 -4.61 116.55 129.76 2jsa n ASP 72 Ca 0.21 -0.02 -0.01 0.00 -0.53 0.00 0.00 54.79 54.44 2jsa n ASP 72 Cb 0.54 0.26 0.12 0.00 -0.64 0.00 0.00 41.12 41.40 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 1.14 0.00 2.53 2.07 -1.52 -2.86 116.25 117.61 2jsa h VAL 73 Ca -0.16 -0.39 -0.54 0.00 0.82 0.00 0.00 66.70 66.43 2jsa h VAL 73 Cb 1.30 -0.10 0.02 0.00 -1.52 0.00 0.00 31.29 30.99 2jsa h VAL 73 CO -0.01 0.21 2.97 0.00 0.02 0.00 0.00 177.57 180.76 2jsa n THR 75 N 4.44 0.00 0.25 0.00 -1.04 -1.15 -4.29 114.28 112.50 2jsa n THR 75 Ca 0.56 0.00 0.13 0.00 -2.04 0.00 0.00 64.05 62.69 2jsa n THR 75 Cb 0.23 0.00 0.64 0.00 -1.82 0.00 0.00 70.33 69.39 2jsa n THR 75 CO 0.00 0.00 0.00 0.50 -0.64 0.00 0.00 175.07 174.93 2jsa h LYS 76 N 0.00 0.00 -0.38 -2.82 3.11 -1.47 -0.68 116.57 114.34 2jsa h LYS 76 Ca 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.84 2jsa h LYS 76 Cb 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.23 2jsa h LYS 76 CO 0.00 0.14 0.00 1.28 -2.81 0.00 0.00 179.45 178.06 2jsa n LEU 77 N -3.43 1.52 -2.40 5.20 7.99 -0.93 -4.85 117.00 120.09 2jsa n LEU 77 Ca -0.01 -0.76 -0.10 0.00 -0.01 0.00 0.00 56.01 55.13 2jsa n LEU 77 Cb 0.32 -0.25 -0.01 0.00 -0.11 0.00 0.00 43.42 43.37 2jsa n LEU 77 CO 0.30 0.32 -0.13 0.59 -1.51 0.00 0.00 177.39 176.97 2jsa n ASN 78 N 0.18 -3.38 -0.03 -1.43 4.13 -0.26 -4.83 115.26 109.64 2jsa n ASN 78 Ca 0.08 0.25 -0.01 0.00 1.68 0.00 0.00 54.58 56.58 2jsa n ASN 78 Cb 0.27 -2.91 -0.00 0.00 -1.54 0.00 0.00 39.78 35.60 2jsa n ASN 78 CO 0.00 0.00 0.00 -0.33 0.28 0.00 0.00 177.26 177.21 2jsa h GLU 79 N 0.00 0.00 -6.49 3.52 5.08 -1.83 -3.47 114.58 111.39 2jsa h GLU 79 Ca -0.24 0.00 -0.53 0.00 -1.00 0.00 0.00 59.36 57.59 2jsa h GLU 79 Cb 1.16 0.00 0.23 0.00 0.50 0.00 0.00 28.75 30.63 2jsa h GLU 79 CO 0.29 0.00 -1.11 0.00 -1.00 0.00 0.00 179.01 177.19