#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 -2.56 0.00 0.55 2.88 -1.26 -5.09 113.62 108.14 2jsa n SER 2 Ca 0.00 1.11 0.00 0.00 -1.33 0.00 0.00 58.87 58.65 2jsa n SER 2 Cb 0.00 -4.16 0.00 0.00 -0.75 0.00 0.00 64.21 59.30 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 1.29 0.00 0.38 -1.46 0.00 -1.26 -4.97 120.51 114.49 2jsa n ALA 3 Ca -0.24 0.00 0.05 0.00 0.00 0.00 0.00 53.44 53.26 2jsa n ALA 3 Cb 0.36 0.00 0.23 0.00 0.00 0.00 0.00 19.45 20.04 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 -0.43 0.00 -0.00 -1.26 -2.88 117.00 112.43 2jsa n LEU 4 Ca 0.00 0.49 0.36 0.00 -0.00 0.00 0.00 56.01 56.86 2jsa n LEU 4 Cb 0.00 -0.49 0.68 0.00 -0.00 0.00 0.00 43.42 43.61 2jsa n LEU 4 CO 0.00 -0.31 1.30 0.28 -0.00 0.00 0.00 177.39 178.66 2jsa h SER 5 N 0.00 0.17 0.38 1.45 0.02 -1.96 0.12 113.55 113.74 2jsa h SER 5 Ca 0.00 0.06 -0.02 0.00 -0.84 0.00 0.00 61.79 61.00 2jsa h SER 5 Cb 0.18 0.04 -0.00 0.00 0.14 0.00 0.00 62.40 62.76 2jsa h SER 5 CO 0.00 -0.04 -0.25 0.00 -1.14 0.00 0.00 176.83 175.40 2jsa n GLN 7 N -3.88 -0.19 -0.38 0.00 6.02 0.39 0.21 117.38 119.55 2jsa n GLN 7 Ca -0.07 1.52 0.30 0.00 -0.01 0.00 0.00 57.00 58.73 2jsa n GLN 7 Cb 0.25 -2.25 0.58 0.00 1.02 0.00 0.00 30.24 29.84 2jsa n GLN 7 CO 0.00 0.00 0.00 0.52 -1.01 0.00 0.00 177.06 176.57 2jsa h MET 8 N 0.00 0.22 -0.72 -1.09 2.86 -1.20 1.53 114.93 116.52 2jsa h MET 8 Ca 0.38 -0.01 -0.03 0.00 -2.06 0.00 0.00 59.70 57.97 2jsa h MET 8 Cb 0.62 -0.05 -0.03 0.00 0.06 0.00 0.00 31.60 32.20 2jsa h MET 8 CO -0.98 0.15 0.32 0.00 1.06 0.00 0.00 176.91 177.46 2jsa n GLU 10 N -4.39 0.18 -0.05 0.00 1.02 0.52 -0.79 120.64 117.12 2jsa n GLU 10 Ca 0.06 0.16 -0.20 0.00 -0.02 0.00 0.00 57.16 57.16 2jsa n GLU 10 Cb 0.15 -1.50 -0.13 0.00 -0.02 0.00 0.00 31.44 29.94 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 -1.32 2.73 -0.01 -4.62 7.94 0.17 -2.85 117.00 119.05 2jsa n LEU 11 Ca 0.06 0.08 -0.17 0.00 -1.11 0.00 0.00 56.01 54.87 2jsa n LEU 11 Cb 0.12 -1.01 -0.09 0.00 0.53 0.00 0.00 43.42 42.97 2jsa n LEU 11 CO 0.11 0.88 0.29 -0.37 -1.11 0.00 0.00 177.39 177.20 2jsa h VAL 12 N 0.04 1.37 0.70 1.96 -1.51 -0.75 -2.62 116.25 115.44 2jsa h VAL 12 Ca -0.48 -1.96 -0.03 0.00 -1.23 0.00 0.00 66.70 62.99 2jsa h VAL 12 Cb 1.99 2.33 0.01 0.00 -2.13 0.00 0.00 31.29 33.49 2jsa h VAL 12 CO 0.02 0.59 -0.33 -0.37 -1.23 0.00 0.00 177.57 176.24 2jsa h VAL 13 N 0.10 0.00 -1.36 7.19 -1.51 -1.16 0.44 116.25 119.95 2jsa h VAL 13 Ca -0.06 -0.26 0.40 0.00 -1.23 0.00 0.00 66.70 65.54 2jsa h VAL 13 Cb 1.28 0.00 -0.08 0.00 -2.13 0.00 0.00 31.29 30.36 2jsa h VAL 13 CO 0.12 0.00 0.95 0.07 -1.23 0.00 0.00 177.57 177.48 2jsa h LYS 14 N -1.20 0.08 0.12 5.19 2.10 -1.65 2.36 116.57 123.58 2jsa h LYS 14 Ca -0.10 -0.00 -0.28 0.00 -2.00 0.00 0.00 60.65 58.27 2jsa h LYS 14 Cb 0.72 -0.02 0.00 0.00 -0.90 0.00 0.00 32.23 32.03 2jsa h LYS 14 CO 0.16 0.05 -1.28 0.87 -2.00 0.00 0.00 179.45 177.25 2jsa h LYS 15 N 0.08 0.26 0.00 0.07 1.79 -1.14 -1.99 116.57 115.64 2jsa h LYS 15 Ca 0.70 -0.44 -0.00 0.00 -2.18 0.00 0.00 60.65 58.73 2jsa h LYS 15 Cb 2.53 0.16 0.00 0.00 -1.58 0.00 0.00 32.23 33.34 2jsa h LYS 15 CO -0.13 1.19 -0.00 -0.92 -1.08 0.00 0.00 179.45 178.51 2jsa h TYR 16 N 0.07 -0.00 0.00 -1.35 3.20 0.81 0.10 116.97 119.80 2jsa h TYR 16 Ca -0.15 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.72 2jsa h TYR 16 Cb 1.97 0.00 0.00 0.00 1.54 0.00 0.00 36.73 40.24 2jsa h TYR 16 CO 0.06 -0.00 0.00 1.05 -1.64 0.00 0.00 178.16 177.63 2jsa h GLU 17 N -0.03 0.00 -0.04 1.82 -0.00 0.99 -0.05 114.58 117.27 2jsa h GLU 17 Ca -0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 59.36 59.32 2jsa h GLU 17 Cb 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 28.75 28.70 2jsa h GLU 17 CO 0.00 0.00 -0.56 0.41 -0.00 0.00 0.00 179.01 178.86 2jsa n GLY 18 N -1.15 4.85 0.07 1.06 0.00 -0.75 -4.75 105.19 104.53 2jsa n GLY 18 Ca -0.02 -1.33 -0.10 0.00 0.00 0.00 0.00 46.02 44.57 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 1.06 0.00 0.00 1.61 0.87 0.12 -3.43 113.55 113.79 2jsa h SER 19 Ca -0.00 -0.49 0.00 0.00 -1.23 0.00 0.00 61.79 60.07 2jsa h SER 19 Cb 1.10 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.06 2jsa h SER 19 CO 0.04 0.88 0.00 0.00 -0.53 0.00 0.00 176.83 177.23 2jsa n ALA 20 N -2.90 0.00 -0.01 6.23 0.00 -1.26 -4.74 120.51 117.82 2jsa n ALA 20 Ca -0.10 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.38 2jsa n ALA 20 Cb 0.33 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.69 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 2.46 -3.20 0.00 5.75 -1.26 -5.04 116.55 115.25 2jsa n ASP 21 Ca 0.00 0.00 -0.09 0.00 -0.01 0.00 0.00 54.79 54.69 2jsa n ASP 21 Cb 0.00 1.36 0.03 0.00 -1.03 0.00 0.00 41.12 41.48 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 -1.99 -1.71 -3.40 0.11 4.76 -1.26 -5.02 118.16 109.66 2jsa n LYS 22 Ca -0.05 1.15 -0.12 0.00 -2.87 0.00 0.00 58.31 56.42 2jsa n LYS 22 Cb 0.40 -5.58 -0.10 0.00 -1.84 0.00 0.00 35.03 27.91 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 -3.19 0.66 0.17 4.39 -1.08 -1.26 -4.98 116.67 111.38 2jsa s ASP 23 Ca 0.22 0.03 0.12 0.00 -0.52 0.00 0.00 52.55 52.40 2jsa s ASP 23 Cb -0.03 0.86 0.65 0.00 -1.46 0.00 0.00 42.92 42.94 2jsa s ASP 23 CO 0.76 -0.31 1.38 0.00 0.52 0.00 0.00 175.17 177.51 2jsa n ALA 24 N 5.35 1.07 -0.02 3.66 0.00 -1.26 -1.02 120.51 128.29 2jsa n ALA 24 Ca -0.04 0.10 -0.07 0.00 0.00 0.00 0.00 53.44 53.43 2jsa n ALA 24 Cb 0.50 -1.18 -0.06 0.00 0.00 0.00 0.00 19.45 18.71 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 -0.06 0.31 0.00 -0.73 -1.99 -1.84 115.58 111.26 2jsa h ASN 25 Ca 0.00 -0.38 0.00 0.00 1.87 0.00 0.00 56.30 57.79 2jsa h ASN 25 Cb 0.02 0.02 0.00 0.00 0.27 0.00 0.00 38.32 38.63 2jsa h ASN 25 CO 0.00 0.60 0.00 0.52 -0.37 0.00 0.00 177.43 178.18 2jsa n VAL 26 N -4.77 0.38 -0.02 2.57 0.31 -0.71 -1.91 118.33 114.17 2jsa n VAL 26 Ca -0.05 0.09 -0.01 0.00 -0.01 0.00 0.00 64.34 64.36 2jsa n VAL 26 Cb 0.22 -0.78 -0.00 0.00 -0.91 0.00 0.00 33.84 32.36 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 -0.97 2.52 2.04 -1.09 -2.75 117.51 117.26 2jsa h ILE 27 Ca 0.00 -0.25 0.20 0.00 1.00 0.00 0.00 64.86 65.81 2jsa h ILE 27 Cb 0.15 0.00 -0.09 0.00 -0.74 0.00 0.00 36.82 36.15 2jsa h ILE 27 CO 0.00 0.00 0.61 0.07 0.00 0.00 0.00 178.15 178.83 2jsa h LYS 28 N -0.25 0.58 -0.10 2.37 2.10 -1.36 0.15 116.57 120.06 2jsa h LYS 28 Ca 0.00 -0.04 -0.02 0.00 -2.00 0.00 0.00 60.65 58.59 2jsa h LYS 28 Cb 0.11 -0.13 -0.00 0.00 -0.90 0.00 0.00 32.23 31.30 2jsa h LYS 28 CO 0.00 0.39 -0.01 0.87 -2.00 0.00 0.00 179.45 178.69 2jsa h LYS 29 N 0.60 0.19 -0.35 0.07 1.57 -1.57 -3.02 116.57 114.06 2jsa h LYS 29 Ca 0.54 -0.07 0.08 0.00 -1.87 0.00 0.00 60.65 59.32 2jsa h LYS 29 Cb 1.05 -0.01 -0.08 0.00 0.08 0.00 0.00 32.23 33.26 2jsa h LYS 29 CO -0.29 0.48 -0.27 -0.44 -0.57 0.00 0.00 179.45 178.36 2jsa h ASP 30 N -0.11 -0.88 -0.68 0.86 3.32 -0.46 -1.68 116.42 116.79 2jsa h ASP 30 Ca 0.03 0.17 0.08 0.00 0.02 0.00 0.00 57.03 57.33 2jsa h ASP 30 Cb 0.40 0.43 -0.11 0.00 0.22 0.00 0.00 39.33 40.27 2jsa h ASP 30 CO 0.01 -0.29 -0.50 0.15 -1.72 0.00 0.00 179.24 176.89 2jsa h PHE 31 N -0.22 -1.52 -1.03 4.55 3.04 -1.08 1.52 116.94 122.20 2jsa h PHE 31 Ca 0.17 0.10 0.30 0.00 3.98 0.00 0.00 57.97 62.52 2jsa h PHE 31 Cb 0.49 0.76 -0.04 0.00 2.56 0.00 0.00 35.95 39.72 2jsa h PHE 31 CO -0.47 -0.43 0.81 0.22 -2.02 0.00 0.00 178.31 176.43 2jsa h ASP 32 N -0.20 0.00 0.55 0.41 1.82 -1.19 0.44 116.42 118.25 2jsa h ASP 32 Ca 0.16 0.00 -0.03 0.00 -0.39 0.00 0.00 57.03 56.78 2jsa h ASP 32 Cb 0.54 0.00 0.01 0.00 0.68 0.00 0.00 39.33 40.55 2jsa h ASP 32 CO -0.75 0.00 -0.26 0.00 -1.61 0.00 0.00 179.24 176.61 2jsa h ALA 33 N 1.34 -0.83 -0.14 -0.78 0.00 0.26 0.25 119.26 119.35 2jsa h ALA 33 Ca 0.49 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 55.19 2jsa h ALA 33 Cb 2.11 0.29 -0.03 0.00 0.00 0.00 0.00 17.79 20.16 2jsa h ALA 33 CO -0.01 -0.78 0.06 -1.91 0.00 0.00 0.00 179.25 176.62 2jsa n GLU 34 N -4.85 1.44 0.00 0.00 4.07 0.15 -3.06 120.64 118.39 2jsa n GLU 34 Ca -0.09 -0.53 0.00 0.00 -0.06 0.00 0.00 57.16 56.47 2jsa n GLU 34 Cb 0.29 -1.41 0.00 0.00 -0.06 0.00 0.00 31.44 30.26 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 0.00 0.98 0.13 0.00 1.57 -0.53 0.78 116.57 119.50 2jsa h LYS 36 Ca 0.00 -0.20 -0.31 0.00 -1.87 0.00 0.00 60.65 58.26 2jsa h LYS 36 Cb 0.82 -0.14 -0.00 0.00 0.08 0.00 0.00 32.23 32.98 2jsa h LYS 36 CO 0.00 0.85 -1.58 0.87 -0.57 0.00 0.00 179.45 179.02 2jsa h LYS 37 N 0.94 0.27 0.26 3.15 6.56 -1.75 -1.80 116.57 124.21 2jsa h LYS 37 Ca 0.21 -0.46 -0.01 0.00 -1.06 0.00 0.00 60.65 59.32 2jsa h LYS 37 Cb 0.30 0.17 0.00 0.00 -0.57 0.00 0.00 32.23 32.14 2jsa h LYS 37 CO -0.00 1.14 -0.13 1.25 -2.06 0.00 0.00 179.45 179.65 2jsa h LEU 38 N 0.07 -0.30 -2.70 2.94 5.85 -1.64 -3.18 115.31 116.35 2jsa h LEU 38 Ca -0.26 0.01 -0.17 0.00 0.84 0.00 0.00 57.88 58.29 2jsa h LEU 38 Cb 2.03 0.08 -0.10 0.00 0.37 0.00 0.00 40.66 43.04 2jsa h LEU 38 CO 0.16 -0.16 0.22 0.49 -0.34 0.00 0.00 178.44 178.81 2jsa n PHE 39 N -3.26 1.27 -0.00 1.25 3.72 0.27 -4.39 117.46 116.32 2jsa n PHE 39 Ca -0.04 -0.90 -0.09 0.00 -0.05 0.00 0.00 57.45 56.36 2jsa n PHE 39 Cb 0.14 -0.49 -0.03 0.00 -0.94 0.00 0.00 39.48 38.16 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 0.81 -0.30 -0.49 1.38 2.07 -1.30 -2.01 115.15 115.31 2jsa h HIS 40 Ca 0.21 0.02 0.07 0.00 -2.85 0.00 0.00 60.37 57.82 2jsa h HIS 40 Cb 1.67 0.15 -0.06 0.00 2.57 0.00 0.00 27.41 31.74 2jsa h HIS 40 CO 0.66 -0.18 0.17 1.79 -3.07 0.00 0.00 177.93 177.30 2jsa h THR 41 N -0.15 0.82 -1.81 6.12 1.35 -1.83 -3.43 112.91 113.99 2jsa h THR 41 Ca 0.09 -0.12 -0.63 0.00 -0.55 0.00 0.00 66.41 65.20 2jsa h THR 41 Cb 0.27 0.46 0.13 0.00 -1.73 0.00 0.00 68.15 67.28 2jsa h THR 41 CO -0.21 0.06 -0.44 -0.38 -0.25 0.00 0.00 175.52 174.30 2jsa n ILE 42 N -5.02 1.69 0.00 6.82 5.41 -0.75 -4.90 119.36 122.61 2jsa n ILE 42 Ca 0.05 -0.50 -0.11 0.00 1.00 0.00 0.00 62.75 63.19 2jsa n ILE 42 Cb 0.20 -0.35 -0.08 0.00 -0.71 0.00 0.00 39.64 38.69 2jsa n ILE 42 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 176.55 178.10 2jsa h PRO 43 N 1.00 -0.11 -0.74 0.38 0.13 -1.83 -3.34 132.00 127.49 2jsa h PRO 43 Ca -0.35 0.01 -0.43 0.00 -0.87 0.00 0.00 66.00 64.35 2jsa h PRO 43 Cb 1.41 0.03 -0.24 0.00 0.13 0.00 0.00 31.00 32.32 2jsa h PRO 43 CO 0.54 0.43 0.28 1.97 -0.23 0.00 0.00 178.00 180.99 2jsa n PHE 44 N -4.82 2.34 -0.07 1.56 1.16 -1.26 -4.58 117.46 111.78 2jsa n PHE 44 Ca -0.08 -2.02 -0.10 0.00 -1.87 0.00 0.00 57.45 53.38 2jsa n PHE 44 Cb 0.29 -0.82 -0.06 0.00 -1.61 0.00 0.00 39.48 37.28 2jsa n PHE 44 CO 0.00 0.00 0.00 0.78 -1.87 0.00 0.00 176.76 175.67 2jsa h GLY 45 N 1.30 0.00 0.98 4.97 0.00 -1.78 -3.10 103.07 105.43 2jsa h GLY 45 Ca 0.46 0.00 0.01 0.00 0.00 0.00 0.00 47.33 47.80 2jsa h GLY 45 CO 0.90 0.00 0.54 -0.91 0.00 0.00 0.00 176.54 177.07 2jsa h THR 46 N -1.00 1.19 -0.73 4.70 1.35 -1.80 0.37 112.91 116.99 2jsa h THR 46 Ca -0.09 -0.37 0.01 0.00 -0.55 0.00 0.00 66.41 65.40 2jsa h THR 46 Cb 0.71 0.01 -0.04 0.00 -1.73 0.00 0.00 68.15 67.11 2jsa h THR 46 CO -0.06 0.20 0.48 0.03 -0.25 0.00 0.00 175.52 175.92 2jsa h ARG 47 N 1.09 0.97 0.00 4.72 2.47 -1.84 -1.62 114.38 120.17 2jsa h ARG 47 Ca 0.30 -0.06 -0.12 0.00 -1.26 0.00 0.00 59.98 58.84 2jsa h ARG 47 Cb -0.10 -0.22 -0.02 0.00 -1.65 0.00 0.00 29.97 27.99 2jsa h ARG 47 CO -0.07 0.65 -0.58 0.93 0.56 0.00 0.00 179.97 181.46 2jsa h GLU 48 N 1.00 0.00 0.20 0.04 4.39 -1.30 -2.59 114.58 116.31 2jsa h GLU 48 Ca 0.27 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.96 2jsa h GLU 48 Cb -0.10 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.54 2jsa h GLU 48 CO -0.06 0.58 -0.20 0.00 -1.16 0.00 0.00 179.01 178.17 2jsa h ASP 50 N -0.39 0.00 -0.01 0.00 1.82 -1.53 1.27 116.42 117.59 2jsa h ASP 50 Ca -0.02 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.62 2jsa h ASP 50 Cb 0.34 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.35 2jsa h ASP 50 CO -0.02 0.00 0.00 1.41 -1.61 0.00 0.00 179.24 179.02 2jsa n HIS 51 N -3.94 0.00 -0.05 0.28 8.25 -0.42 -3.45 115.22 115.89 2jsa n HIS 51 Ca 0.02 -0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.36 2jsa n HIS 51 Cb 0.31 0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.38 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 -0.73 0.00 0.29 4.41 9.36 0.41 -4.23 117.16 126.68 2jsa n TYR 52 Ca 0.22 0.00 0.16 0.00 3.32 0.00 0.00 57.90 61.60 2jsa n TYR 52 Cb 0.16 -0.38 0.79 0.00 -0.63 0.00 0.00 39.34 39.28 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 -0.35 0.07 -2.06 2.97 -1.51 -0.88 -0.41 116.25 114.08 2jsa h VAL 53 Ca -0.27 0.00 -0.57 0.00 -1.23 0.00 0.00 66.70 64.64 2jsa h VAL 53 Cb 1.24 0.65 -0.39 0.00 -2.13 0.00 0.00 31.29 30.66 2jsa h VAL 53 CO -0.15 0.00 -1.04 -3.20 -1.23 0.00 0.00 177.57 171.95 2jsa n ASN 54 N -3.03 0.56 0.00 4.19 2.85 -1.22 -4.39 115.26 114.23 2jsa n ASN 54 Ca -0.00 -2.76 0.00 0.00 -0.11 0.00 0.00 54.58 51.71 2jsa n ASN 54 Cb 0.44 -0.64 0.00 0.00 1.24 0.00 0.00 39.78 40.82 2jsa n ASN 54 CO 0.00 0.00 0.00 -1.20 -2.11 0.00 0.00 177.26 173.95 2jsa n SER 55 N 1.44 0.00 0.00 1.20 7.64 -0.93 -4.83 113.62 118.15 2jsa n SER 55 Ca 0.23 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.11 2jsa n SER 55 Cb 0.51 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.71 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 0.30 -0.10 1.43 4.76 -0.24 -4.70 118.16 119.61 2jsa n LYS 56 Ca 0.00 -0.60 -0.22 0.00 -2.87 0.00 0.00 58.31 54.62 2jsa n LYS 56 Cb 0.00 -0.80 -0.12 0.00 -1.84 0.00 0.00 35.03 32.27 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 -0.11 1.56 -0.24 -0.18 0.31 -0.77 -2.81 118.33 116.09 2jsa n VAL 57 Ca 0.00 -0.48 0.01 0.00 -0.01 0.00 0.00 64.34 63.86 2jsa n VAL 57 Cb 0.19 -1.67 0.13 0.00 -0.91 0.00 0.00 33.84 31.59 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 -0.35 0.44 0.19 4.52 1.82 -1.84 0.50 116.42 121.69 2jsa h ASP 58 Ca -0.56 0.06 -0.01 0.00 -0.39 0.00 0.00 57.03 56.13 2jsa h ASP 58 Cb 1.79 -0.01 0.00 0.00 0.68 0.00 0.00 39.33 41.79 2jsa h ASP 58 CO -0.16 0.25 -0.09 1.55 -1.61 0.00 0.00 179.24 179.18 2jsa h PRO 59 N 0.58 -0.25 -0.59 0.28 0.13 -1.84 -2.26 132.00 128.05 2jsa h PRO 59 Ca 0.34 0.02 0.10 0.00 -0.87 0.00 0.00 66.00 65.60 2jsa h PRO 59 Cb 0.37 0.06 -0.11 0.00 0.13 0.00 0.00 31.00 31.44 2jsa h PRO 59 CO -0.27 0.02 -0.33 0.82 -0.23 0.00 0.00 178.00 178.00 2jsa h ILE 60 N -1.01 0.17 0.00 -3.56 2.04 -1.39 1.87 117.51 115.64 2jsa h ILE 60 Ca -0.03 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.83 2jsa h ILE 60 Cb 0.38 0.17 -0.00 0.00 -0.74 0.00 0.00 36.82 36.63 2jsa h ILE 60 CO 0.04 0.00 -0.03 0.40 0.00 0.00 0.00 178.15 178.56 2jsa h ILE 61 N -0.16 0.40 -0.23 -0.67 2.04 -0.12 -1.52 117.51 117.25 2jsa h ILE 61 Ca 0.23 -0.15 -0.02 0.00 1.00 0.00 0.00 64.86 65.92 2jsa h ILE 61 Cb 0.55 1.11 -0.01 0.00 -0.74 0.00 0.00 36.82 37.73 2jsa h ILE 61 CO -0.68 0.03 0.07 1.12 0.00 0.00 0.00 178.15 178.69 2jsa h HIS 62 N 0.00 0.38 0.23 1.37 2.07 0.35 0.13 115.15 119.69 2jsa h HIS 62 Ca -0.00 -0.04 -0.01 0.00 -2.85 0.00 0.00 60.37 57.47 2jsa h HIS 62 Cb 0.10 -0.11 0.00 0.00 2.57 0.00 0.00 27.41 29.98 2jsa h HIS 62 CO 0.00 0.45 -0.11 1.49 -3.07 0.00 0.00 177.93 176.69 2jsa h GLU 63 N 0.21 -0.30 -0.68 5.12 4.57 -0.15 -1.65 114.58 121.70 2jsa h GLU 63 Ca 0.07 0.02 0.06 0.00 -1.18 0.00 0.00 59.36 58.34 2jsa h GLU 63 Cb 0.25 0.07 -0.04 0.00 -0.16 0.00 0.00 28.75 28.87 2jsa h GLU 63 CO -0.00 -0.18 0.45 -0.07 -1.18 0.00 0.00 179.01 178.02 2jsa h LEU 64 N -0.34 0.60 -1.90 1.64 3.38 -1.42 0.32 115.31 117.59 2jsa h LEU 64 Ca -0.03 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 2jsa h LEU 64 Cb 0.26 -0.13 -0.00 0.00 0.09 0.00 0.00 40.66 40.88 2jsa h LEU 64 CO 0.05 0.39 -0.12 -0.33 0.09 0.00 0.00 178.44 178.52 2jsa h GLU 65 N 0.68 0.00 0.00 1.13 5.08 -0.08 -1.59 114.58 119.81 2jsa h GLU 65 Ca 0.29 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.55 2jsa h GLU 65 Cb 0.28 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.51 2jsa h GLU 65 CO -0.09 0.12 -0.87 0.78 -1.00 0.00 0.00 179.01 177.94 2jsa h GLY 66 N 0.83 0.00 0.00 -3.84 0.00 0.49 -3.47 103.07 97.08 2jsa h GLY 66 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2jsa h GLY 66 CO 0.02 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.17 2jsa n GLY 67 N 1.27 0.55 3.77 4.60 0.00 -0.60 -5.11 105.19 109.68 2jsa n GLY 67 Ca -0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.60 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 -1.46 3.14 0.88 2.61 2.01 -0.36 -4.94 115.64 117.51 2jsa s THR 68 Ca 0.00 1.08 -0.11 0.00 0.31 0.00 0.00 61.69 62.97 2jsa s THR 68 Cb 0.00 -3.66 0.12 0.00 0.01 0.00 0.00 72.50 68.96 2jsa s THR 68 CO 0.00 0.21 1.09 0.00 -0.69 0.00 0.00 174.62 175.23 2jsa s ALA 69 N -1.24 1.64 -0.12 7.40 0.00 -1.26 -3.85 121.76 124.33 2jsa s ALA 69 Ca 0.50 0.08 0.27 0.00 0.00 0.00 0.00 51.96 52.81 2jsa s ALA 69 Cb -0.34 -3.24 0.80 0.00 0.00 0.00 0.00 23.12 20.34 2jsa s ALA 69 CO 0.44 -2.30 1.77 -1.00 0.00 0.00 0.00 175.76 174.68 2jsa h PRO 70 N -1.51 0.00 -0.21 0.00 0.13 -1.99 -2.14 132.00 126.28 2jsa h PRO 70 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2jsa h PRO 70 Cb 1.27 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.40 2jsa h PRO 70 CO 0.52 0.08 0.00 1.63 -0.23 0.00 0.00 178.00 180.00 2jsa n LYS 71 N -3.15 2.20 -0.07 0.86 5.02 -1.26 -3.98 118.16 117.77 2jsa n LYS 71 Ca 0.02 -1.79 -0.08 0.00 -2.02 0.00 0.00 58.31 54.44 2jsa n LYS 71 Cb 0.45 -1.47 -0.11 0.00 -0.02 0.00 0.00 35.03 33.88 2jsa n LYS 71 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 2jsa n ASP 72 N 1.05 1.69 -0.21 4.39 -0.08 -0.96 -4.48 116.55 117.96 2jsa n ASP 72 Ca 0.17 -0.02 -0.08 0.00 -1.51 0.00 0.00 54.79 53.36 2jsa n ASP 72 Cb 0.52 0.62 0.02 0.00 2.34 0.00 0.00 41.12 44.62 2jsa n ASP 72 CO 0.00 0.00 0.00 0.58 0.12 0.00 0.00 177.20 177.90 2jsa h VAL 73 N 0.00 1.23 -0.11 5.18 2.07 -1.53 -2.32 116.25 120.77 2jsa h VAL 73 Ca -0.39 -0.72 -0.70 0.00 0.82 0.00 0.00 66.70 65.70 2jsa h VAL 73 Cb 1.83 0.62 -0.03 0.00 -1.52 0.00 0.00 31.29 32.19 2jsa h VAL 73 CO 0.00 0.28 3.28 0.00 0.02 0.00 0.00 177.57 181.15 2jsa n THR 75 N 4.45 0.00 -0.15 0.00 -1.04 -1.20 -4.17 114.28 112.17 2jsa n THR 75 Ca 0.60 0.00 0.03 0.00 -2.04 0.00 0.00 64.05 62.63 2jsa n THR 75 Cb 0.34 0.00 0.31 0.00 -1.82 0.00 0.00 70.33 69.16 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 0.82 0.00 -2.82 3.64 -1.52 0.47 116.57 117.16 2jsa h LYS 76 Ca 0.00 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.33 2jsa h LYS 76 Cb 0.00 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 31.64 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 -4.45 0.00 -1.25 5.20 7.99 -1.10 -4.82 117.00 118.57 2jsa n LEU 77 Ca 0.07 0.32 -0.11 0.00 -0.01 0.00 0.00 56.01 56.28 2jsa n LEU 77 Cb 0.07 -0.32 -0.01 0.00 -0.11 0.00 0.00 43.42 43.06 2jsa n LEU 77 CO 0.35 -0.15 -0.14 -3.20 -1.51 0.00 0.00 177.39 172.74 2jsa n ASN 78 N -1.32 -3.67 0.00 -1.43 5.15 0.16 -4.96 115.26 109.19 2jsa n ASN 78 Ca 0.07 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 54.05 2jsa n ASN 78 Cb 0.13 -2.87 0.00 0.00 -0.53 0.00 0.00 39.78 36.51 2jsa n ASN 78 CO 0.00 0.00 0.00 -1.84 1.40 0.00 0.00 177.26 176.82 2jsa n GLU 79 N -2.10 0.00 -1.93 1.20 0.28 -1.26 -4.95 120.64 111.88 2jsa n GLU 79 Ca -0.13 0.00 -0.41 0.00 -0.16 0.00 0.00 57.16 56.46 2jsa n GLU 79 Cb 0.59 -0.05 -0.01 0.00 1.43 0.00 0.00 31.44 33.40 2jsa n GLU 79 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97