#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 1.16 0.00 2.89 1.04 -1.26 -4.80 113.70 112.73 2jsa s SER 2 Ca 0.00 -0.02 0.00 0.00 0.48 0.00 0.00 55.95 56.41 2jsa s SER 2 Cb 0.00 -0.29 0.00 0.00 0.10 0.00 0.00 66.02 65.83 2jsa s SER 2 CO 0.00 -0.19 0.00 0.00 0.98 0.00 0.00 173.24 174.03 2jsa n ALA 3 N 4.93 0.00 0.32 5.32 0.00 -1.26 -4.95 120.51 124.87 2jsa n ALA 3 Ca -0.11 0.00 0.18 0.00 0.00 0.00 0.00 53.44 53.51 2jsa n ALA 3 Cb 0.50 0.00 0.95 0.00 0.00 0.00 0.00 19.45 20.90 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 -0.95 0.00 -0.00 -1.99 -1.57 115.31 110.80 2jsa h LEU 4 Ca 0.00 0.00 0.27 0.00 -0.00 0.00 0.00 57.88 58.15 2jsa h LEU 4 Cb 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 40.66 40.52 2jsa h LEU 4 CO 0.00 0.00 0.45 -1.28 -0.00 0.00 0.00 178.44 177.61 2jsa h SER 5 N 0.00 0.36 0.58 0.17 0.87 -1.92 0.63 113.55 114.23 2jsa h SER 5 Ca 0.00 0.18 -0.03 0.00 -1.23 0.00 0.00 61.79 60.71 2jsa h SER 5 Cb 0.33 0.16 0.01 0.00 -0.44 0.00 0.00 62.40 62.46 2jsa h SER 5 CO 0.00 -0.08 -0.28 0.00 -0.53 0.00 0.00 176.83 175.94 2jsa n GLN 7 N -4.24 -0.08 -0.30 0.00 3.00 -0.23 0.20 117.38 115.73 2jsa n GLN 7 Ca -0.10 1.46 0.09 0.00 -0.01 0.00 0.00 57.00 58.44 2jsa n GLN 7 Cb 0.31 -2.30 0.25 0.00 0.00 0.00 0.00 30.24 28.49 2jsa n GLN 7 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.06 177.58 2jsa h MET 8 N 0.00 0.59 -0.18 -1.09 2.86 -0.75 0.77 114.93 117.14 2jsa h MET 8 Ca 0.57 -0.04 0.01 0.00 -2.06 0.00 0.00 59.70 58.19 2jsa h MET 8 Cb 1.15 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 32.67 2jsa h MET 8 CO -0.92 0.39 0.12 0.00 1.06 0.00 0.00 176.91 177.55 2jsa n GLU 10 N -4.51 0.15 -0.03 0.00 1.02 0.26 -2.10 120.64 115.44 2jsa n GLU 10 Ca -0.00 -0.00 -0.22 0.00 -0.02 0.00 0.00 57.16 56.92 2jsa n GLU 10 Cb 0.11 -1.50 -0.13 0.00 -0.02 0.00 0.00 31.44 29.90 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 -1.42 2.46 -0.03 -4.62 7.94 0.18 -2.66 117.00 118.85 2jsa n LEU 11 Ca 0.10 0.25 -0.13 0.00 -1.11 0.00 0.00 56.01 55.12 2jsa n LEU 11 Cb 0.31 -1.08 -0.08 0.00 0.53 0.00 0.00 43.42 43.10 2jsa n LEU 11 CO 0.26 0.72 0.66 -0.37 -1.11 0.00 0.00 177.39 177.55 2jsa h VAL 12 N -0.20 1.33 0.83 1.96 -1.51 -1.20 -2.46 116.25 115.00 2jsa h VAL 12 Ca -0.42 -1.07 -0.04 0.00 -1.23 0.00 0.00 66.70 63.95 2jsa h VAL 12 Cb 1.85 1.88 0.01 0.00 -2.13 0.00 0.00 31.29 32.90 2jsa h VAL 12 CO 0.00 0.30 -0.40 -0.37 -1.23 0.00 0.00 177.57 175.87 2jsa h VAL 13 N -0.22 0.16 -1.50 7.19 -1.51 -1.61 0.47 116.25 119.23 2jsa h VAL 13 Ca 0.02 -0.05 0.45 0.00 -1.23 0.00 0.00 66.70 65.88 2jsa h VAL 13 Cb 0.49 0.17 -0.08 0.00 -2.13 0.00 0.00 31.29 29.73 2jsa h VAL 13 CO 0.01 0.00 1.05 0.50 -1.23 0.00 0.00 177.57 177.91 2jsa h LYS 14 N -1.16 0.05 0.23 5.19 3.64 -1.57 2.04 116.57 124.99 2jsa h LYS 14 Ca -0.11 -0.00 -0.33 0.00 -1.27 0.00 0.00 60.65 58.94 2jsa h LYS 14 Cb 0.86 -0.01 0.03 0.00 -0.41 0.00 0.00 32.23 32.70 2jsa h LYS 14 CO 0.19 0.03 -1.49 0.87 -2.27 0.00 0.00 179.45 176.78 2jsa h LYS 15 N 0.05 0.48 0.12 1.90 1.79 -0.84 -2.92 116.57 117.16 2jsa h LYS 15 Ca 0.77 -0.82 -0.01 0.00 -2.18 0.00 0.00 60.65 58.41 2jsa h LYS 15 Cb 2.85 0.31 0.00 0.00 -1.58 0.00 0.00 32.23 33.80 2jsa h LYS 15 CO -0.13 1.39 -0.06 -0.92 -1.08 0.00 0.00 179.45 178.65 2jsa h TYR 16 N 0.08 -0.15 -1.05 -1.35 3.20 0.75 0.24 116.97 118.68 2jsa h TYR 16 Ca -0.27 -0.00 0.30 0.00 3.14 0.00 0.00 58.73 61.89 2jsa h TYR 16 Cb 2.10 0.05 -0.12 0.00 1.54 0.00 0.00 36.73 40.30 2jsa h TYR 16 CO 0.13 -0.10 0.64 0.93 -1.64 0.00 0.00 178.16 178.12 2jsa h GLU 17 N -0.36 0.38 -0.83 1.82 4.39 0.14 0.69 114.58 120.81 2jsa h GLU 17 Ca -0.02 -0.02 -0.54 0.00 0.34 0.00 0.00 59.36 59.12 2jsa h GLU 17 Cb 0.13 -0.09 -0.30 0.00 -0.10 0.00 0.00 28.75 28.39 2jsa h GLU 17 CO 0.03 0.25 0.23 0.41 -1.16 0.00 0.00 179.01 178.77 2jsa n GLY 18 N -1.38 5.70 0.08 -3.84 0.00 -1.10 -4.60 105.19 100.05 2jsa n GLY 18 Ca 0.29 -2.09 -0.09 0.00 0.00 0.00 0.00 46.02 44.14 2jsa n GLY 18 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2jsa h SER 19 N 1.77 0.00 0.00 1.61 0.87 0.26 -3.45 113.55 114.61 2jsa h SER 19 Ca 0.49 -0.19 0.00 0.00 -1.23 0.00 0.00 61.79 60.86 2jsa h SER 19 Cb 1.39 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.35 2jsa h SER 19 CO 1.12 0.91 0.00 0.00 -0.53 0.00 0.00 176.83 178.32 2jsa n ALA 20 N -3.37 0.00 0.17 6.23 0.00 -1.26 -4.76 120.51 117.52 2jsa n ALA 20 Ca -0.12 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.36 2jsa n ALA 20 Cb 0.34 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.72 2jsa n ALA 20 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2jsa n ASP 21 N 0.00 1.90 -3.69 0.00 5.75 -1.26 -5.02 116.55 114.23 2jsa n ASP 21 Ca 0.00 -0.29 -0.27 0.00 -0.01 0.00 0.00 54.79 54.22 2jsa n ASP 21 Cb 0.00 1.24 0.03 0.00 -1.03 0.00 0.00 41.12 41.37 2jsa n ASP 21 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 2jsa n LYS 22 N -1.57 -2.28 -3.63 0.11 4.76 -1.26 -4.98 118.16 109.32 2jsa n LYS 22 Ca -0.00 0.51 -0.24 0.00 -2.87 0.00 0.00 58.31 55.71 2jsa n LYS 22 Cb 0.20 -4.52 -0.17 0.00 -1.84 0.00 0.00 35.03 28.69 2jsa n LYS 22 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2jsa s ASP 23 N -3.76 1.94 0.00 4.39 1.01 -1.26 -4.98 116.67 114.01 2jsa s ASP 23 Ca 0.32 -0.38 0.15 0.00 0.71 0.00 0.00 52.55 53.35 2jsa s ASP 23 Cb -0.10 -0.19 0.77 0.00 1.01 0.00 0.00 42.92 44.41 2jsa s ASP 23 CO 0.85 -0.32 1.41 0.00 0.21 0.00 0.00 175.17 177.32 2jsa n ALA 24 N 5.29 1.87 -0.08 5.23 0.00 -1.26 -1.55 120.51 130.00 2jsa n ALA 24 Ca -0.06 -0.07 -0.15 0.00 0.00 0.00 0.00 53.44 53.16 2jsa n ALA 24 Cb 0.49 -1.24 -0.11 0.00 0.00 0.00 0.00 19.45 18.59 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 0.00 0.88 0.00 -1.24 -1.99 -2.45 115.58 110.78 2jsa h ASN 25 Ca 0.00 -0.72 0.00 0.00 0.71 0.00 0.00 56.30 56.29 2jsa h ASN 25 Cb 0.13 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.18 2jsa h ASN 25 CO 0.00 1.12 0.00 0.52 -1.29 0.00 0.00 177.43 177.78 2jsa n VAL 26 N -4.56 0.45 0.00 2.57 0.31 -1.05 -2.49 118.33 113.57 2jsa n VAL 26 Ca -0.17 0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.22 2jsa n VAL 26 Cb 0.51 -0.72 0.00 0.00 -0.91 0.00 0.00 33.84 32.72 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 -1.66 0.00 -0.43 2.52 5.41 -0.60 -2.40 119.36 122.20 2jsa n ILE 27 Ca 0.05 0.25 0.36 0.00 1.00 0.00 0.00 62.75 64.42 2jsa n ILE 27 Cb 0.29 -0.90 0.64 0.00 -0.71 0.00 0.00 39.64 38.96 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 0.00 0.09 -0.13 0.38 2.10 -1.56 1.69 116.57 119.13 2jsa h LYS 28 Ca 0.00 -0.01 -0.03 0.00 -2.00 0.00 0.00 60.65 58.62 2jsa h LYS 28 Cb 0.00 -0.02 -0.00 0.00 -0.90 0.00 0.00 32.23 31.31 2jsa h LYS 28 CO 0.00 0.06 -0.03 0.87 -2.00 0.00 0.00 179.45 178.34 2jsa h LYS 29 N 0.09 0.25 -0.41 0.07 1.57 -1.65 -2.94 116.57 113.55 2jsa h LYS 29 Ca 0.82 -0.10 0.06 0.00 -1.87 0.00 0.00 60.65 59.56 2jsa h LYS 29 Cb 2.52 -0.01 -0.05 0.00 0.08 0.00 0.00 32.23 34.77 2jsa h LYS 29 CO -0.45 0.55 0.12 0.22 -0.57 0.00 0.00 179.45 179.32 2jsa h ASP 30 N -0.06 0.09 -0.57 0.86 1.82 0.27 -2.24 116.42 116.59 2jsa h ASP 30 Ca 0.03 0.06 0.10 0.00 -0.39 0.00 0.00 57.03 56.83 2jsa h ASP 30 Cb 0.46 0.06 -0.11 0.00 0.68 0.00 0.00 39.33 40.42 2jsa h ASP 30 CO 0.01 0.09 -0.36 0.15 -1.61 0.00 0.00 179.24 177.52 2jsa h PHE 31 N 0.27 -1.02 -0.08 0.28 3.04 -0.70 1.43 116.94 120.16 2jsa h PHE 31 Ca 0.19 0.07 0.02 0.00 3.98 0.00 0.00 57.97 62.24 2jsa h PHE 31 Cb 0.21 0.53 -0.00 0.00 2.56 0.00 0.00 35.95 39.24 2jsa h PHE 31 CO -0.17 -0.39 0.12 -0.44 -2.02 0.00 0.00 178.31 175.40 2jsa h ASP 32 N -0.19 0.00 0.00 0.41 5.19 -1.24 0.18 116.42 120.76 2jsa h ASP 32 Ca 0.21 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.62 2jsa h ASP 32 Cb 0.56 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.07 2jsa h ASP 32 CO -0.67 0.00 0.00 0.00 -3.12 0.00 0.00 179.24 175.45 2jsa n ALA 33 N -2.24 -0.20 -0.07 3.45 0.00 0.48 -0.09 120.51 121.85 2jsa n ALA 33 Ca -0.01 0.00 0.24 0.00 0.00 0.00 0.00 53.44 53.67 2jsa n ALA 33 Cb 0.22 0.00 0.71 0.00 0.00 0.00 0.00 19.45 20.38 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 0.00 0.31 0.00 4.57 -1.10 0.07 114.58 118.43 2jsa h GLU 34 Ca 0.00 0.00 -0.02 0.00 -1.18 0.00 0.00 59.36 58.16 2jsa h GLU 34 Cb 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.59 2jsa h GLU 34 CO 0.00 0.00 -0.15 0.00 -1.18 0.00 0.00 179.01 177.68 2jsa h LYS 36 N -0.78 0.00 0.00 0.00 1.79 0.15 1.75 116.57 119.48 2jsa h LYS 36 Ca -0.04 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.43 2jsa h LYS 36 Cb 0.51 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.16 2jsa h LYS 36 CO 0.07 0.00 -0.16 1.63 -1.08 0.00 0.00 179.45 179.91 2jsa n LYS 37 N -2.43 0.08 -0.01 3.15 5.02 -0.82 -3.95 118.16 119.20 2jsa n LYS 37 Ca -0.01 0.03 -0.09 0.00 -2.02 0.00 0.00 58.31 56.22 2jsa n LYS 37 Cb 0.45 -0.60 -0.03 0.00 -0.02 0.00 0.00 35.03 34.83 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 -0.16 -0.53 -3.23 -0.35 5.85 0.38 -0.33 115.31 116.94 2jsa h LEU 38 Ca 0.00 0.10 -0.27 0.00 0.84 0.00 0.00 57.88 58.55 2jsa h LEU 38 Cb 0.16 0.25 -0.13 0.00 0.37 0.00 0.00 40.66 41.31 2jsa h LEU 38 CO 0.00 -0.22 0.35 0.49 -0.34 0.00 0.00 178.44 178.72 2jsa n PHE 39 N -5.32 1.37 -2.51 1.25 3.72 0.59 -4.70 117.46 111.87 2jsa n PHE 39 Ca -0.03 -1.59 -0.43 0.00 -0.05 0.00 0.00 57.45 55.35 2jsa n PHE 39 Cb 0.23 -0.78 0.01 0.00 -0.94 0.00 0.00 39.48 37.99 2jsa n PHE 39 CO 0.00 0.00 0.00 1.58 -0.05 0.00 0.00 176.76 178.29 2jsa n HIS 40 N 0.22 2.94 0.00 1.38 -0.00 -0.14 -3.22 115.22 116.40 2jsa n HIS 40 Ca 0.27 -2.79 0.00 0.00 0.46 0.00 0.00 57.72 55.66 2jsa n HIS 40 Cb 0.73 -1.82 0.00 0.00 -0.12 0.00 0.00 29.99 28.77 2jsa n HIS 40 CO 0.00 0.00 0.00 -2.37 0.46 0.00 0.00 176.34 174.43 2jsa n THR 41 N 3.00 0.00 -1.36 3.57 5.66 -1.26 -5.01 114.28 118.88 2jsa n THR 41 Ca 0.37 0.00 -0.45 0.00 -3.05 0.00 0.00 64.05 60.91 2jsa n THR 41 Cb 0.36 0.00 -0.02 0.00 -1.55 0.00 0.00 70.33 69.12 2jsa n THR 41 CO 0.00 0.00 0.00 -0.38 -3.05 0.00 0.00 175.07 171.64 2jsa n ILE 42 N 0.00 1.42 0.75 1.09 2.08 -1.25 -4.70 119.36 118.74 2jsa n ILE 42 Ca 0.00 -0.50 0.00 0.00 0.56 0.00 0.00 62.75 62.81 2jsa n ILE 42 Cb 0.00 -0.01 0.00 0.00 -0.75 0.00 0.00 39.64 38.88 2jsa n ILE 42 CO 0.00 0.00 0.00 -0.81 0.56 0.00 0.00 176.55 176.30 2jsa n PRO 43 N 1.14 0.75 0.00 0.38 -0.04 -1.26 -3.36 135.00 132.61 2jsa n PRO 43 Ca 0.15 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.61 2jsa n PRO 43 Cb 0.32 -1.22 0.00 0.00 -0.04 0.00 0.00 33.50 32.56 2jsa n PRO 43 CO 0.00 0.00 0.00 1.97 -0.04 0.00 0.00 175.50 177.43 2jsa n PHE 44 N 0.44 0.00 -0.06 0.54 1.16 -1.26 -5.06 117.46 113.21 2jsa n PHE 44 Ca 0.00 0.00 -0.05 0.00 -1.87 0.00 0.00 57.45 55.53 2jsa n PHE 44 Cb 0.30 0.00 -0.02 0.00 -1.61 0.00 0.00 39.48 38.16 2jsa n PHE 44 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 2jsa n GLY 45 N 0.00 -0.69 0.24 4.97 0.00 -1.21 -3.36 105.19 105.15 2jsa n GLY 45 Ca 0.00 -0.18 0.06 0.00 0.00 0.00 0.00 46.02 45.90 2jsa n GLY 45 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2jsa h THR 46 N -0.74 1.07 0.11 2.61 1.35 -1.81 0.91 112.91 116.41 2jsa h THR 46 Ca 0.00 -0.31 -0.01 0.00 -0.55 0.00 0.00 66.41 65.54 2jsa h THR 46 Cb 0.56 1.15 0.00 0.00 -1.73 0.00 0.00 68.15 68.13 2jsa h THR 46 CO 0.00 0.09 -0.05 0.03 -0.25 0.00 0.00 175.52 175.34 2jsa h ARG 47 N 0.02 -0.15 -0.55 4.72 2.47 -1.91 -2.82 114.38 116.16 2jsa h ARG 47 Ca 0.00 0.01 0.16 0.00 -1.26 0.00 0.00 59.98 58.89 2jsa h ARG 47 Cb 0.16 0.03 -0.02 0.00 -1.65 0.00 0.00 29.97 28.49 2jsa h ARG 47 CO 0.01 -0.10 0.51 1.49 0.56 0.00 0.00 179.97 182.45 2jsa h GLU 48 N -0.32 0.00 0.47 0.04 4.22 -1.55 0.80 114.58 118.23 2jsa h GLU 48 Ca -0.02 0.00 -0.02 0.00 0.08 0.00 0.00 59.36 59.40 2jsa h GLU 48 Cb 0.12 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.37 2jsa h GLU 48 CO 0.03 0.00 -0.23 0.00 -2.18 0.00 0.00 179.01 176.63 2jsa h ASP 50 N -0.72 0.00 -0.30 0.00 3.58 -0.58 1.36 116.42 119.75 2jsa h ASP 50 Ca -0.06 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.39 2jsa h ASP 50 Cb 0.53 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.58 2jsa h ASP 50 CO 0.11 0.00 0.00 1.41 -2.88 0.00 0.00 179.24 177.88 2jsa n HIS 51 N -2.61 0.39 -0.10 0.28 8.25 -0.33 -4.38 115.22 116.72 2jsa n HIS 51 Ca -0.02 -0.26 -0.21 0.00 -0.26 0.00 0.00 57.72 56.97 2jsa n HIS 51 Cb 0.15 -0.01 -0.07 0.00 1.12 0.00 0.00 29.99 31.19 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 1.08 0.00 -0.31 4.41 9.36 0.45 -3.88 117.16 128.27 2jsa n TYR 52 Ca 0.15 0.00 0.23 0.00 3.32 0.00 0.00 57.90 61.60 2jsa n TYR 52 Cb 0.49 -0.72 0.52 0.00 -0.63 0.00 0.00 39.34 39.01 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 -0.79 0.54 -0.77 2.97 -1.51 -1.42 1.28 116.25 116.55 2jsa h VAL 53 Ca -0.45 -0.13 -0.43 0.00 -1.23 0.00 0.00 66.70 64.46 2jsa h VAL 53 Cb 1.36 0.14 -0.24 0.00 -2.13 0.00 0.00 31.29 30.41 2jsa h VAL 53 CO -0.28 0.07 0.37 0.59 -1.23 0.00 0.00 177.57 177.09 2jsa n ASN 54 N -4.58 3.84 -3.09 4.19 4.13 -1.26 -4.26 115.26 114.23 2jsa n ASN 54 Ca 0.24 -3.70 0.05 0.00 1.68 0.00 0.00 54.58 52.85 2jsa n ASN 54 Cb 0.87 -0.77 0.00 0.00 -1.54 0.00 0.00 39.78 38.34 2jsa n ASN 54 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 2jsa s SER 55 N -1.89 -0.42 0.00 6.41 0.01 0.44 -4.92 113.70 113.32 2jsa s SER 55 Ca 0.54 0.01 0.00 0.00 1.31 0.00 0.00 55.95 57.80 2jsa s SER 55 Cb 0.46 1.15 0.00 0.00 0.21 0.00 0.00 66.02 67.83 2jsa s SER 55 CO 0.05 -0.07 0.00 0.29 0.41 0.00 0.00 173.24 173.92 2jsa n LYS 56 N 4.88 0.00 -0.01 12.44 4.76 -1.22 -4.31 118.16 134.71 2jsa n LYS 56 Ca 0.09 0.00 0.07 0.00 -2.87 0.00 0.00 58.31 55.60 2jsa n LYS 56 Cb 0.59 0.00 -0.14 0.00 -1.84 0.00 0.00 35.03 33.63 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 -1.71 0.38 0.07 -0.18 0.31 -1.22 -2.98 118.33 113.00 2jsa n VAL 57 Ca 0.00 -0.58 -0.21 0.00 -0.01 0.00 0.00 64.34 63.54 2jsa n VAL 57 Cb 0.00 -0.16 -0.13 0.00 -0.91 0.00 0.00 33.84 32.63 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 0.00 0.69 0.05 4.52 1.82 -1.89 -2.99 116.42 118.63 2jsa h ASP 58 Ca -0.10 -0.86 -0.00 0.00 -0.39 0.00 0.00 57.03 55.67 2jsa h ASP 58 Cb 1.25 -0.22 0.00 0.00 0.68 0.00 0.00 39.33 41.04 2jsa h ASP 58 CO 0.01 1.49 -0.03 1.55 -1.61 0.00 0.00 179.24 180.65 2jsa h PRO 59 N -0.00 -0.07 -0.74 0.28 0.13 -1.98 -2.43 132.00 127.19 2jsa h PRO 59 Ca -0.16 0.00 0.16 0.00 -0.87 0.00 0.00 66.00 65.14 2jsa h PRO 59 Cb 1.75 0.02 -0.13 0.00 0.13 0.00 0.00 31.00 32.77 2jsa h PRO 59 CO 0.20 0.54 -0.04 0.82 -0.23 0.00 0.00 178.00 179.29 2jsa h ILE 60 N -0.83 0.34 0.00 -3.56 2.04 -1.69 1.74 117.51 115.55 2jsa h ILE 60 Ca -0.01 -0.03 -0.05 0.00 1.00 0.00 0.00 64.86 65.78 2jsa h ILE 60 Cb 0.65 0.25 -0.01 0.00 -0.74 0.00 0.00 36.82 36.97 2jsa h ILE 60 CO 0.01 0.01 -0.23 0.40 0.00 0.00 0.00 178.15 178.35 2jsa h ILE 61 N 0.08 0.90 0.00 -0.67 2.04 -1.60 -0.33 117.51 117.92 2jsa h ILE 61 Ca 0.39 -0.86 0.00 0.00 1.00 0.00 0.00 64.86 65.39 2jsa h ILE 61 Cb 0.67 1.50 0.00 0.00 -0.74 0.00 0.00 36.82 38.25 2jsa h ILE 61 CO -0.67 0.22 0.00 0.00 0.00 0.00 0.00 178.15 177.70 2jsa n HIS 62 N -3.88 0.78 -0.08 1.37 1.44 0.58 -0.76 115.22 114.67 2jsa n HIS 62 Ca -0.02 0.30 -0.16 0.00 -2.01 0.00 0.00 57.72 55.83 2jsa n HIS 62 Cb 0.32 -0.98 -0.12 0.00 0.12 0.00 0.00 29.99 29.33 2jsa n HIS 62 CO 0.00 0.00 0.00 0.93 -2.81 0.00 0.00 176.34 174.46 2jsa h GLU 63 N 0.00 0.00 0.00 -1.40 3.07 0.54 -2.96 114.58 113.83 2jsa h GLU 63 Ca 0.00 0.00 -0.08 0.00 -0.50 0.00 0.00 59.36 58.78 2jsa h GLU 63 Cb 0.40 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 28.30 2jsa h GLU 63 CO 0.00 0.96 -0.40 -0.07 -1.40 0.00 0.00 179.01 178.09 2jsa h LEU 64 N -1.00 0.00 -0.62 1.33 3.38 -1.42 0.62 115.31 117.61 2jsa h LEU 64 Ca -0.10 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.75 2jsa h LEU 64 Cb 1.05 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.79 2jsa h LEU 64 CO -0.06 0.40 -0.24 -0.33 0.09 0.00 0.00 178.44 178.30 2jsa h GLU 65 N 0.00 0.84 0.04 1.13 5.08 -1.06 -3.26 114.58 117.35 2jsa h GLU 65 Ca -0.00 -0.35 -0.00 0.00 -1.00 0.00 0.00 59.36 58.00 2jsa h GLU 65 Cb 0.86 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.08 2jsa h GLU 65 CO 0.05 0.99 -0.02 0.78 -1.00 0.00 0.00 179.01 179.81 2jsa h GLY 66 N 0.93 -0.06 0.00 -3.84 0.00 -1.32 -3.47 103.07 95.31 2jsa h GLY 66 Ca 0.09 0.02 0.00 0.00 0.00 0.00 0.00 47.33 47.45 2jsa h GLY 66 CO 0.06 -0.02 0.00 0.61 0.00 0.00 0.00 176.54 177.19 2jsa n GLY 67 N 1.05 0.00 3.11 4.60 0.00 -0.47 -5.11 105.19 108.37 2jsa n GLY 67 Ca -0.08 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.61 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 2.04 1.02 2.61 2.01 0.20 -4.97 115.64 118.56 2jsa s THR 68 Ca 0.00 -0.98 -0.15 0.00 0.31 0.00 0.00 61.69 60.86 2jsa s THR 68 Cb 0.00 -1.87 0.06 0.00 0.01 0.00 0.00 72.50 70.69 2jsa s THR 68 CO 0.00 0.48 0.20 0.00 -0.69 0.00 0.00 174.62 174.62 2jsa n ALA 69 N 4.61 -3.31 0.29 7.40 0.00 -1.26 -3.02 120.51 125.23 2jsa n ALA 69 Ca -0.20 -0.88 0.14 0.00 0.00 0.00 0.00 53.44 52.50 2jsa n ALA 69 Cb 0.49 -1.67 0.44 0.00 0.00 0.00 0.00 19.45 18.71 2jsa n ALA 69 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2jsa h PRO 70 N -1.74 0.00 -0.61 0.00 0.13 -1.97 -2.35 132.00 125.46 2jsa h PRO 70 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 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 0.35 0.00 0.00 0.36 -0.23 0.00 0.00 178.00 178.48 2jsa n LYS 71 N -2.95 2.50 -0.03 0.86 -0.00 -1.26 -4.03 118.16 113.24 2jsa n LYS 71 Ca 0.03 -2.20 -0.04 0.00 -0.00 0.00 0.00 58.31 56.09 2jsa n LYS 71 Cb 0.40 -1.51 -0.03 0.00 -0.00 0.00 0.00 35.03 33.89 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 1.22 3.51 -0.04 -5.58 9.92 -0.95 -4.68 116.55 119.95 2jsa n ASP 72 Ca 0.20 -0.03 -0.09 0.00 -0.53 0.00 0.00 54.79 54.35 2jsa n ASP 72 Cb 0.54 0.02 -0.02 0.00 -0.64 0.00 0.00 41.12 41.02 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 0.39 -0.24 2.53 2.07 -1.58 -2.94 116.25 116.48 2jsa h VAL 73 Ca -0.15 0.00 -0.63 0.00 0.82 0.00 0.00 66.70 66.74 2jsa h VAL 73 Cb 1.25 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 31.39 2jsa h VAL 73 CO -0.02 0.00 2.40 0.00 0.02 0.00 0.00 177.57 179.97 2jsa n THR 75 N 6.03 0.00 0.15 0.00 -1.04 -1.12 -4.43 114.28 113.87 2jsa n THR 75 Ca 0.50 0.00 0.01 0.00 -2.04 0.00 0.00 64.05 62.52 2jsa n THR 75 Cb 0.42 0.00 0.20 0.00 -1.82 0.00 0.00 70.33 69.13 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 0.00 -2.82 3.64 -1.53 -2.28 116.57 113.58 2jsa h LYS 76 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2jsa h LYS 76 Cb 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 2jsa h LYS 76 CO 0.00 0.54 0.00 1.28 -2.27 0.00 0.00 179.45 179.00 2jsa n LEU 77 N -3.61 0.00 -1.64 5.20 7.99 -1.02 -4.81 117.00 119.11 2jsa n LEU 77 Ca -0.00 0.11 -0.18 0.00 -0.01 0.00 0.00 56.01 55.92 2jsa n LEU 77 Cb 0.61 -0.11 -0.05 0.00 -0.11 0.00 0.00 43.42 43.76 2jsa n LEU 77 CO 0.40 -0.04 -0.19 -3.20 -1.51 0.00 0.00 177.39 172.85 2jsa n ASN 78 N -1.11 -5.19 -0.33 -1.43 2.85 -0.86 -4.83 115.26 104.37 2jsa n ASN 78 Ca 0.13 0.26 0.11 0.00 -0.11 0.00 0.00 54.58 54.97 2jsa n ASN 78 Cb 0.10 -4.27 -0.02 0.00 1.24 0.00 0.00 39.78 36.83 2jsa n ASN 78 CO 0.00 0.00 0.00 -1.84 -2.11 0.00 0.00 177.26 173.31 2jsa n GLU 79 N -2.58 0.80 -3.76 1.20 0.28 -1.26 -4.76 120.64 110.57 2jsa n GLU 79 Ca -0.19 -0.66 -0.12 0.00 -0.16 0.00 0.00 57.16 56.03 2jsa n GLU 79 Cb 0.62 -1.49 -0.12 0.00 1.43 0.00 0.00 31.44 31.88 2jsa n GLU 79 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97