#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 -2.01 0.00 2.89 2.88 -1.25 -4.88 113.62 111.25 2jsa n SER 2 Ca 0.00 -0.03 0.00 0.00 -1.33 0.00 0.00 58.87 57.51 2jsa n SER 2 Cb 0.00 -0.73 0.00 0.00 -0.75 0.00 0.00 64.21 62.73 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 -1.17 0.00 0.02 -1.46 0.00 -1.26 -4.95 120.51 111.69 2jsa n ALA 3 Ca -0.01 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.28 2jsa n ALA 3 Cb 0.51 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.92 2jsa n ALA 3 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2jsa h LEU 4 N 0.00 0.75 -1.01 0.00 -0.00 -1.99 -2.79 115.31 110.28 2jsa h LEU 4 Ca 0.00 -0.52 0.19 0.00 -0.00 0.00 0.00 57.88 57.55 2jsa h LEU 4 Cb 0.00 -0.22 -0.11 0.00 -0.00 0.00 0.00 40.66 40.33 2jsa h LEU 4 CO 0.00 1.30 0.61 0.28 -0.00 0.00 0.00 178.44 180.64 2jsa h SER 5 N 0.40 0.78 0.45 -0.43 0.02 -1.92 1.48 113.55 114.33 2jsa h SER 5 Ca -0.06 0.10 -0.02 0.00 -0.84 0.00 0.00 61.79 60.97 2jsa h SER 5 Cb 1.44 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 63.94 2jsa h SER 5 CO 0.16 0.26 -0.22 0.00 -1.14 0.00 0.00 176.83 175.89 2jsa h GLN 7 N -1.11 -0.35 -0.87 0.00 4.20 -1.04 -0.25 115.11 115.70 2jsa h GLN 7 Ca -0.06 0.02 0.21 0.00 0.06 0.00 0.00 58.65 58.89 2jsa h GLN 7 Cb 0.52 0.08 -0.13 0.00 0.30 0.00 0.00 27.48 28.25 2jsa h GLN 7 CO 0.10 -0.23 0.33 0.52 -0.67 0.00 0.00 178.83 178.88 2jsa h MET 8 N -0.36 0.33 -0.19 1.46 2.86 0.20 1.54 114.93 120.76 2jsa h MET 8 Ca 0.12 -0.02 0.04 0.00 -2.06 0.00 0.00 59.70 57.77 2jsa h MET 8 Cb 0.55 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 32.12 2jsa h MET 8 CO -0.41 0.22 0.13 0.00 1.06 0.00 0.00 176.91 177.92 2jsa n GLU 10 N -4.50 0.11 -0.01 0.00 1.02 0.52 -1.74 120.64 116.06 2jsa n GLU 10 Ca 0.01 0.01 -0.21 0.00 -0.02 0.00 0.00 57.16 56.95 2jsa n GLU 10 Cb 0.21 -1.50 -0.14 0.00 -0.02 0.00 0.00 31.44 29.99 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 -1.44 2.67 -0.03 -4.62 7.94 0.24 -2.68 117.00 119.08 2jsa n LEU 11 Ca 0.09 0.18 -0.14 0.00 -1.11 0.00 0.00 56.01 55.03 2jsa n LEU 11 Cb 0.30 -1.11 -0.09 0.00 0.53 0.00 0.00 43.42 43.05 2jsa n LEU 11 CO 0.25 0.86 0.49 -0.37 -1.11 0.00 0.00 177.39 177.51 2jsa h VAL 12 N 0.06 1.44 0.89 1.96 -1.51 -1.21 -2.60 116.25 115.28 2jsa h VAL 12 Ca -0.44 -1.62 -0.04 0.00 -1.23 0.00 0.00 66.70 63.37 2jsa h VAL 12 Cb 2.02 2.32 0.01 0.00 -2.13 0.00 0.00 31.29 33.51 2jsa h VAL 12 CO 0.07 0.45 -0.43 -0.37 -1.23 0.00 0.00 177.57 176.07 2jsa h VAL 13 N -0.26 0.04 -1.39 7.19 -1.51 -1.53 0.34 116.25 119.14 2jsa h VAL 13 Ca -0.01 -0.10 0.41 0.00 -1.23 0.00 0.00 66.70 65.77 2jsa h VAL 13 Cb 0.85 0.05 -0.08 0.00 -2.13 0.00 0.00 31.29 29.98 2jsa h VAL 13 CO 0.05 0.00 0.97 0.50 -1.23 0.00 0.00 177.57 177.86 2jsa h LYS 14 N -1.29 0.07 0.13 5.19 3.64 -1.62 1.91 116.57 124.61 2jsa h LYS 14 Ca -0.12 -0.00 -0.29 0.00 -1.27 0.00 0.00 60.65 58.96 2jsa h LYS 14 Cb 0.92 -0.02 0.03 0.00 -0.41 0.00 0.00 32.23 32.75 2jsa h LYS 14 CO 0.20 0.05 -1.23 0.87 -2.27 0.00 0.00 179.45 177.07 2jsa h LYS 15 N 0.07 0.59 0.00 1.90 1.79 -0.97 -2.93 116.57 117.03 2jsa h LYS 15 Ca 0.71 -0.82 0.00 0.00 -2.18 0.00 0.00 60.65 58.36 2jsa h LYS 15 Cb 2.59 0.28 0.00 0.00 -1.58 0.00 0.00 32.23 33.52 2jsa h LYS 15 CO -0.13 1.37 0.00 0.98 -1.08 0.00 0.00 179.45 180.60 2jsa n TYR 16 N -3.82 0.00 -0.44 -1.35 9.36 0.55 -1.06 117.16 120.39 2jsa n TYR 16 Ca -0.14 0.00 0.38 0.00 3.32 0.00 0.00 57.90 61.46 2jsa n TYR 16 Cb 0.98 -0.43 0.65 0.00 -0.63 0.00 0.00 39.34 39.92 2jsa n TYR 16 CO 0.00 0.00 0.00 1.05 0.22 0.00 0.00 176.86 178.13 2jsa h GLU 17 N 0.00 0.04 -1.29 2.98 -0.00 0.13 0.87 114.58 117.30 2jsa h GLU 17 Ca 0.00 -0.00 -0.59 0.00 -0.00 0.00 0.00 59.36 58.77 2jsa h GLU 17 Cb 0.00 -0.01 -0.41 0.00 -0.00 0.00 0.00 28.75 28.33 2jsa h GLU 17 CO 0.00 0.02 -0.62 0.41 -0.00 0.00 0.00 179.01 178.82 2jsa n GLY 18 N -1.48 6.11 0.11 1.06 0.00 -1.11 -4.72 105.19 105.16 2jsa n GLY 18 Ca 0.39 -2.71 -0.22 0.00 0.00 0.00 0.00 46.02 43.48 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 -0.57 1.89 0.00 1.61 2.88 0.30 -4.71 113.62 115.02 2jsa n SER 19 Ca 0.42 0.41 0.00 0.00 -1.33 0.00 0.00 58.87 58.37 2jsa n SER 19 Cb 0.73 -0.90 0.00 0.00 -0.75 0.00 0.00 64.21 63.29 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 -3.75 0.00 0.34 -1.46 0.00 -1.26 -4.75 120.51 109.63 2jsa n ALA 20 Ca -0.36 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.12 2jsa n ALA 20 Cb 0.70 -0.10 -0.05 0.00 0.00 0.00 0.00 19.45 20.00 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 -0.01 0.81 -4.10 0.00 2.03 -1.26 -5.00 116.55 109.02 2jsa n ASP 21 Ca 0.00 -0.59 -0.28 0.00 0.52 0.00 0.00 54.79 54.44 2jsa n ASP 21 Cb 0.00 1.06 -0.05 0.00 -0.72 0.00 0.00 41.12 41.42 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 -1.30 -2.23 -3.70 -0.67 4.76 -1.26 -4.93 118.16 108.84 2jsa n LYS 22 Ca 0.01 0.27 -0.28 0.00 -2.87 0.00 0.00 58.31 55.44 2jsa n LYS 22 Cb 0.15 -4.09 -0.16 0.00 -1.84 0.00 0.00 35.03 29.09 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 -4.34 3.05 0.04 4.39 2.15 -1.26 -4.97 116.67 115.73 2jsa s ASP 23 Ca 0.02 -0.95 0.08 0.00 0.43 0.00 0.00 52.55 52.13 2jsa s ASP 23 Cb -0.01 -0.56 0.36 0.00 -0.30 0.00 0.00 42.92 42.41 2jsa s ASP 23 CO 0.93 -0.34 1.25 0.00 -0.17 0.00 0.00 175.17 176.85 2jsa n ALA 24 N 5.07 1.26 -0.07 3.66 0.00 -1.26 -0.93 120.51 128.23 2jsa n ALA 24 Ca -0.07 0.01 -0.15 0.00 0.00 0.00 0.00 53.44 53.23 2jsa n ALA 24 Cb 0.46 -1.13 -0.13 0.00 0.00 0.00 0.00 19.45 18.66 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 0.64 0.00 -0.73 -1.99 -1.78 115.58 111.72 2jsa h ASN 25 Ca 0.00 -0.92 0.00 0.00 1.87 0.00 0.00 56.30 57.25 2jsa h ASN 25 Cb 0.10 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.69 2jsa h ASN 25 CO 0.00 1.04 0.00 0.52 -0.37 0.00 0.00 177.43 178.62 2jsa n VAL 26 N -4.59 0.25 -0.03 2.57 0.31 -0.74 -2.10 118.33 114.00 2jsa n VAL 26 Ca -0.12 0.06 -0.02 0.00 -0.01 0.00 0.00 64.34 64.25 2jsa n VAL 26 Cb 0.49 -0.65 -0.01 0.00 -0.91 0.00 0.00 33.84 32.77 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 -1.00 2.52 2.04 -1.08 -2.81 117.51 117.18 2jsa h ILE 27 Ca 0.00 -0.46 0.18 0.00 1.00 0.00 0.00 64.86 65.59 2jsa h ILE 27 Cb 0.32 0.00 -0.11 0.00 -0.74 0.00 0.00 36.82 36.30 2jsa h ILE 27 CO 0.00 0.00 0.60 0.07 0.00 0.00 0.00 178.15 178.82 2jsa h LYS 28 N -0.46 0.75 -0.17 2.37 2.10 -1.40 0.13 116.57 119.89 2jsa h LYS 28 Ca 0.00 -0.05 -0.02 0.00 -2.00 0.00 0.00 60.65 58.58 2jsa h LYS 28 Cb 0.21 -0.17 -0.01 0.00 -0.90 0.00 0.00 32.23 31.36 2jsa h LYS 28 CO 0.00 0.50 0.03 0.87 -2.00 0.00 0.00 179.45 178.84 2jsa h LYS 29 N 0.77 0.28 -0.41 0.07 1.57 -1.61 -2.98 116.57 114.26 2jsa h LYS 29 Ca 0.57 -0.08 0.09 0.00 -1.87 0.00 0.00 60.65 59.36 2jsa h LYS 29 Cb 0.87 -0.03 -0.09 0.00 0.08 0.00 0.00 32.23 33.05 2jsa h LYS 29 CO -0.38 0.45 -0.23 -0.44 -0.57 0.00 0.00 179.45 178.29 2jsa h ASP 30 N 0.07 -0.77 -0.61 0.86 3.32 -0.54 -0.17 116.42 118.58 2jsa h ASP 30 Ca 0.05 0.17 0.09 0.00 0.02 0.00 0.00 57.03 57.36 2jsa h ASP 30 Cb 0.31 0.40 -0.11 0.00 0.22 0.00 0.00 39.33 40.15 2jsa h ASP 30 CO 0.00 -0.25 -0.43 0.15 -1.72 0.00 0.00 179.24 176.99 2jsa h PHE 31 N -0.15 -1.26 0.00 4.55 3.04 -1.00 1.61 116.94 123.73 2jsa h PHE 31 Ca 0.20 0.08 -0.00 0.00 3.98 0.00 0.00 57.97 62.23 2jsa h PHE 31 Cb 0.46 0.64 -0.00 0.00 2.56 0.00 0.00 35.95 39.61 2jsa h PHE 31 CO -0.47 -0.42 -0.00 0.22 -2.02 0.00 0.00 178.31 175.62 2jsa h ASP 32 N -0.21 0.00 0.30 0.41 3.58 -1.12 0.16 116.42 119.55 2jsa h ASP 32 Ca 0.19 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.63 2jsa h ASP 32 Cb 0.56 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.61 2jsa h ASP 32 CO -0.71 0.00 -0.15 0.00 -2.88 0.00 0.00 179.24 175.51 2jsa h ALA 33 N 2.00 -0.56 -0.44 -0.78 0.00 0.39 0.16 119.26 120.03 2jsa h ALA 33 Ca -0.00 -0.09 0.06 0.00 0.00 0.00 0.00 54.91 54.88 2jsa h ALA 33 Cb 0.00 0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.90 2jsa h ALA 33 CO 0.00 -0.53 0.15 1.49 0.00 0.00 0.00 179.25 180.36 2jsa h GLU 34 N -0.77 0.31 -0.25 0.00 4.57 -0.40 -1.67 114.58 116.38 2jsa h GLU 34 Ca -0.04 -0.02 0.02 0.00 -1.18 0.00 0.00 59.36 58.14 2jsa h GLU 34 Cb 0.31 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.81 2jsa h GLU 34 CO 0.07 0.21 0.11 0.00 -1.18 0.00 0.00 179.01 178.21 2jsa h LYS 36 N 0.23 0.04 0.00 0.00 1.79 0.29 2.22 116.57 121.15 2jsa h LYS 36 Ca 0.10 -0.00 -0.18 0.00 -2.18 0.00 0.00 60.65 58.39 2jsa h LYS 36 Cb 0.05 -0.01 -0.03 0.00 -1.58 0.00 0.00 32.23 30.66 2jsa h LYS 36 CO -0.09 0.03 -1.33 1.17 -1.08 0.00 0.00 179.45 178.15 2jsa n LYS 37 N -4.90 0.53 -0.27 3.15 4.81 -0.32 -2.17 118.16 118.99 2jsa n LYS 37 Ca 0.38 0.41 0.07 0.00 -0.87 0.00 0.00 58.31 58.31 2jsa n LYS 37 Cb 1.42 -1.60 0.19 0.00 0.02 0.00 0.00 35.03 35.06 2jsa n LYS 37 CO 0.00 0.00 0.00 1.25 1.17 0.00 0.00 177.40 179.82 2jsa h LEU 38 N -1.00 -0.30 -4.00 3.14 5.85 0.41 -0.15 115.31 119.26 2jsa h LEU 38 Ca -0.28 0.20 -0.58 0.00 0.84 0.00 0.00 57.88 58.07 2jsa h LEU 38 Cb 1.11 0.34 -0.41 0.00 0.37 0.00 0.00 40.66 42.08 2jsa h LEU 38 CO -0.17 -0.19 -0.60 0.49 -0.34 0.00 0.00 178.44 177.64 2jsa n PHE 39 N -5.34 2.96 0.26 1.25 3.01 0.74 -4.72 117.46 115.62 2jsa n PHE 39 Ca 0.16 -2.51 0.13 0.00 1.01 0.00 0.00 57.45 56.24 2jsa n PHE 39 Cb 0.53 -0.39 0.65 0.00 -0.01 0.00 0.00 39.48 40.26 2jsa n PHE 39 CO 0.00 0.00 0.00 1.12 1.01 0.00 0.00 176.76 178.89 2jsa h HIS 40 N 2.29 0.00 0.06 1.38 2.07 -0.50 -3.06 115.15 117.39 2jsa h HIS 40 Ca 0.38 0.00 -0.31 0.00 -2.85 0.00 0.00 60.37 57.59 2jsa h HIS 40 Cb 1.28 0.00 -0.03 0.00 2.57 0.00 0.00 27.41 31.23 2jsa h HIS 40 CO 0.90 0.13 -1.72 0.25 -3.07 0.00 0.00 177.93 174.42 2jsa n THR 41 N -3.40 1.66 -1.30 6.12 -2.24 -1.26 -4.95 114.28 108.91 2jsa n THR 41 Ca -0.01 -0.37 -0.44 0.00 -2.27 0.00 0.00 64.05 60.97 2jsa n THR 41 Cb 0.31 -1.87 -0.02 0.00 -2.10 0.00 0.00 70.33 66.65 2jsa n THR 41 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 2jsa n ILE 42 N -3.92 1.53 -0.03 2.28 2.08 -1.15 -4.89 119.36 115.26 2jsa n ILE 42 Ca -0.33 -0.47 -0.13 0.00 0.56 0.00 0.00 62.75 62.38 2jsa n ILE 42 Cb 0.88 0.00 -0.11 0.00 -0.75 0.00 0.00 39.64 39.67 2jsa n ILE 42 CO 0.00 0.00 0.00 1.55 0.56 0.00 0.00 176.55 178.66 2jsa h PRO 43 N 0.77 -0.03 -0.70 0.38 0.13 -1.92 -3.33 132.00 127.28 2jsa h PRO 43 Ca -0.29 0.00 -0.41 0.00 -0.87 0.00 0.00 66.00 64.43 2jsa h PRO 43 Cb 1.36 0.01 -0.24 0.00 0.13 0.00 0.00 31.00 32.26 2jsa h PRO 43 CO 0.51 0.65 0.21 1.97 -0.23 0.00 0.00 178.00 181.11 2jsa n PHE 44 N -4.76 2.24 -0.10 1.56 1.16 -1.26 -4.55 117.46 111.76 2jsa n PHE 44 Ca -0.09 -2.03 -0.17 0.00 -1.87 0.00 0.00 57.45 53.29 2jsa n PHE 44 Cb 0.34 -0.78 -0.08 0.00 -1.61 0.00 0.00 39.48 37.35 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 -1.04 -0.84 0.17 4.97 0.00 -1.25 -3.11 105.19 104.08 2jsa n GLY 45 Ca 0.48 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.45 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 -1.00 1.39 0.46 2.61 1.35 -1.78 0.05 112.91 115.99 2jsa h THR 46 Ca -0.26 -1.97 -0.02 0.00 -0.55 0.00 0.00 66.41 63.61 2jsa h THR 46 Cb 1.08 2.00 0.00 0.00 -1.73 0.00 0.00 68.15 69.50 2jsa h THR 46 CO -0.16 0.58 -0.22 0.03 -0.25 0.00 0.00 175.52 175.50 2jsa h ARG 47 N 0.15 -0.60 -0.11 4.72 2.47 -1.80 -0.53 114.38 118.68 2jsa h ARG 47 Ca -0.00 0.04 -0.02 0.00 -1.26 0.00 0.00 59.98 58.73 2jsa h ARG 47 Cb 1.09 0.14 -0.01 0.00 -1.65 0.00 0.00 29.97 29.53 2jsa h ARG 47 CO 0.09 -0.32 -0.03 1.49 0.56 0.00 0.00 179.97 181.76 2jsa h GLU 48 N -1.07 0.15 0.15 0.04 4.22 -1.60 -1.44 114.58 115.04 2jsa h GLU 48 Ca -0.06 -0.02 -0.01 0.00 0.08 0.00 0.00 59.36 59.35 2jsa h GLU 48 Cb 0.56 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.78 2jsa h GLU 48 CO 0.10 0.20 -0.07 0.00 -2.18 0.00 0.00 179.01 177.06 2jsa n ASP 50 N -5.07 0.55 -0.79 0.00 2.03 -0.21 0.52 116.55 113.58 2jsa n ASP 50 Ca -0.09 0.72 0.09 0.00 0.52 0.00 0.00 54.79 56.04 2jsa n ASP 50 Cb 0.20 -0.81 0.10 0.00 -0.72 0.00 0.00 41.12 39.89 2jsa n ASP 50 CO 0.00 0.00 0.00 1.57 -1.92 0.00 0.00 177.20 176.85 2jsa n HIS 51 N -2.20 0.10 -0.11 -0.67 -0.00 -0.59 -4.41 115.22 107.34 2jsa n HIS 51 Ca -0.00 -0.07 -0.16 0.00 0.46 0.00 0.00 57.72 57.95 2jsa n HIS 51 Cb 0.08 -0.00 -0.10 0.00 -0.12 0.00 0.00 29.99 29.85 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 1.07 0.00 0.27 1.57 9.36 0.18 -4.12 117.16 125.49 2jsa n TYR 52 Ca 0.12 0.00 0.15 0.00 3.32 0.00 0.00 57.90 61.49 2jsa n TYR 52 Cb 0.48 -0.82 0.80 0.00 -0.63 0.00 0.00 39.34 39.17 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 -0.09 0.00 -2.03 2.97 -1.51 -1.37 -2.17 116.25 112.05 2jsa h VAL 53 Ca -0.49 0.00 -0.56 0.00 -1.23 0.00 0.00 66.70 64.42 2jsa h VAL 53 Cb 1.71 0.65 -0.39 0.00 -2.13 0.00 0.00 31.29 31.13 2jsa h VAL 53 CO -0.11 0.00 -1.04 0.59 -1.23 0.00 0.00 177.57 175.78 2jsa n ASN 54 N -2.66 0.73 0.00 4.19 3.02 -1.26 -4.39 115.26 114.89 2jsa n ASN 54 Ca -0.02 -2.82 0.00 0.00 -0.03 0.00 0.00 54.58 51.71 2jsa n ASN 54 Cb 0.20 -0.64 0.00 0.00 -0.61 0.00 0.00 39.78 38.73 2jsa n ASN 54 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 2jsa n SER 55 N 1.26 0.00 -0.01 6.41 2.88 -1.00 -4.91 113.62 118.25 2jsa n SER 55 Ca 0.23 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.77 2jsa n SER 55 Cb 0.52 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.98 2jsa n SER 55 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2jsa n LYS 56 N 0.00 1.20 -0.10 -1.46 5.02 -0.85 -4.77 118.16 117.20 2jsa n LYS 56 Ca 0.00 -0.93 -0.23 0.00 -2.02 0.00 0.00 58.31 55.13 2jsa n LYS 56 Cb 0.00 -0.71 -0.12 0.00 -0.02 0.00 0.00 35.03 34.18 2jsa n LYS 56 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2jsa n VAL 57 N -0.21 1.56 -0.24 -0.18 0.31 -1.16 -2.82 118.33 115.60 2jsa n VAL 57 Ca 0.00 -0.45 0.03 0.00 -0.01 0.00 0.00 64.34 63.91 2jsa n VAL 57 Cb 0.41 -1.70 0.15 0.00 -0.91 0.00 0.00 33.84 31.78 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 -0.43 0.28 0.09 4.52 5.19 -1.86 0.29 116.42 124.51 2jsa h ASP 58 Ca -0.56 0.09 -0.00 0.00 -0.62 0.00 0.00 57.03 55.94 2jsa h ASP 58 Cb 1.76 0.07 0.00 0.00 0.18 0.00 0.00 39.33 41.33 2jsa h ASP 58 CO -0.18 0.13 -0.05 1.55 -3.12 0.00 0.00 179.24 177.58 2jsa h PRO 59 N 0.45 -0.12 -0.63 3.56 0.13 -1.87 -2.77 132.00 130.75 2jsa h PRO 59 Ca 0.37 0.01 0.10 0.00 -0.87 0.00 0.00 66.00 65.61 2jsa h PRO 59 Cb 0.51 0.03 -0.12 0.00 0.13 0.00 0.00 31.00 31.55 2jsa h PRO 59 CO -0.36 0.39 -0.37 0.82 -0.23 0.00 0.00 178.00 178.25 2jsa h ILE 60 N -0.87 0.13 -0.05 -3.56 2.04 -1.32 2.05 117.51 115.92 2jsa h ILE 60 Ca -0.01 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.86 2jsa h ILE 60 Cb 0.57 0.13 -0.00 0.00 -0.74 0.00 0.00 36.82 36.78 2jsa h ILE 60 CO 0.02 0.00 0.05 0.40 0.00 0.00 0.00 178.15 178.62 2jsa h ILE 61 N -0.16 0.53 0.00 -0.67 2.04 -0.53 0.42 117.51 119.14 2jsa h ILE 61 Ca 0.23 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 66.08 2jsa h ILE 61 Cb 0.56 0.96 -0.00 0.00 -0.74 0.00 0.00 36.82 37.60 2jsa h ILE 61 CO -0.72 0.00 -0.03 1.12 0.00 0.00 0.00 178.15 178.52 2jsa h HIS 62 N 0.00 0.00 0.11 1.37 2.07 0.36 0.16 115.15 119.22 2jsa h HIS 62 Ca 0.02 0.00 -0.29 0.00 -2.85 0.00 0.00 60.37 57.25 2jsa h HIS 62 Cb 0.12 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.09 2jsa h HIS 62 CO 0.00 0.03 -1.53 1.49 -3.07 0.00 0.00 177.93 174.86 2jsa h GLU 63 N 0.00 0.22 -0.54 5.12 4.57 0.67 -2.80 114.58 121.81 2jsa h GLU 63 Ca -0.00 -0.38 -0.08 0.00 -1.18 0.00 0.00 59.36 57.72 2jsa h GLU 63 Cb 0.40 0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 29.11 2jsa h GLU 63 CO 0.00 1.18 0.03 -0.07 -1.18 0.00 0.00 179.01 178.98 2jsa h LEU 64 N -0.30 0.92 -0.97 1.64 3.38 -1.20 0.41 115.31 119.20 2jsa h LEU 64 Ca -0.34 -0.29 -0.10 0.00 0.09 0.00 0.00 57.88 57.24 2jsa h LEU 64 Cb 1.77 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 42.27 2jsa h LEU 64 CO 0.04 0.98 -0.36 1.05 0.09 0.00 0.00 178.44 180.24 2jsa h GLU 65 N 0.82 0.29 -0.06 1.13 -0.00 -0.84 -3.11 114.58 112.82 2jsa h GLU 65 Ca 0.16 -0.13 -0.02 0.00 -0.00 0.00 0.00 59.36 59.37 2jsa h GLU 65 Cb 0.50 -0.01 -0.00 0.00 -0.00 0.00 0.00 28.75 29.24 2jsa h GLU 65 CO 0.02 0.62 -0.03 0.78 -0.00 0.00 0.00 179.01 180.41 2jsa h GLY 66 N 1.14 0.13 0.00 1.06 0.00 -1.18 -3.47 103.07 100.75 2jsa h GLY 66 Ca 0.03 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.24 2jsa h GLY 66 CO 0.06 0.11 0.00 0.61 0.00 0.00 0.00 176.54 177.32 2jsa n GLY 67 N 0.02 0.20 3.59 4.60 0.00 -0.23 -5.08 105.19 108.28 2jsa n GLY 67 Ca -0.07 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.57 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 3.52 -2.35 2.61 -1.04 0.13 -4.91 114.28 112.24 2jsa n THR 68 Ca 0.00 -0.50 -0.26 0.00 -2.04 0.00 0.00 64.05 61.25 2jsa n THR 68 Cb 0.00 -1.06 0.04 0.00 -1.82 0.00 0.00 70.33 67.49 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 -1.56 3.29 -1.89 2.41 0.00 -1.26 -3.87 121.76 118.88 2jsa s ALA 69 Ca 0.75 -0.82 0.24 0.00 0.00 0.00 0.00 51.96 52.13 2jsa s ALA 69 Cb -0.42 -2.56 1.38 0.00 0.00 0.00 0.00 23.12 21.52 2jsa s ALA 69 CO 0.48 -0.97 1.79 -0.35 0.00 0.00 0.00 175.76 176.71 2jsa n PRO 70 N -2.68 0.67 -0.02 0.00 -0.04 -1.26 -1.33 135.00 130.34 2jsa n PRO 70 Ca 0.06 0.01 0.01 0.00 -0.04 0.00 0.00 63.50 63.55 2jsa n PRO 70 Cb 0.59 -1.50 0.03 0.00 -0.04 0.00 0.00 33.50 32.57 2jsa n PRO 70 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2jsa n LYS 71 N -1.05 1.13 -0.03 0.54 5.02 -1.26 -4.61 118.16 117.89 2jsa n LYS 71 Ca 0.17 -1.14 -0.04 0.00 -2.02 0.00 0.00 58.31 55.27 2jsa n LYS 71 Cb 0.10 -1.06 -0.03 0.00 -0.02 0.00 0.00 35.03 34.02 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 -0.03 3.52 -0.37 4.39 8.00 -0.78 -4.70 116.55 126.59 2jsa n ASP 72 Ca 0.02 -0.03 -0.06 0.00 0.71 0.00 0.00 54.79 55.44 2jsa n ASP 72 Cb 0.18 0.04 -0.02 0.00 -0.02 0.00 0.00 41.12 41.30 2jsa n ASP 72 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 2jsa h VAL 73 N 0.00 0.01 -0.03 2.53 2.07 -1.46 -1.24 116.25 118.14 2jsa h VAL 73 Ca -0.15 0.00 -0.70 0.00 0.82 0.00 0.00 66.70 66.68 2jsa h VAL 73 Cb 1.25 0.01 -0.02 0.00 -1.52 0.00 0.00 31.29 31.01 2jsa h VAL 73 CO -0.02 0.00 2.95 0.00 0.02 0.00 0.00 177.57 180.52 2jsa n THR 75 N 5.32 0.00 0.07 0.00 -1.04 -0.50 -4.48 114.28 113.64 2jsa n THR 75 Ca 0.51 0.00 -0.21 0.00 -2.04 0.00 0.00 64.05 62.31 2jsa n THR 75 Cb 0.39 0.00 -0.12 0.00 -1.82 0.00 0.00 70.33 68.78 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 0.62 0.00 -2.82 2.10 -1.58 -3.01 116.57 111.87 2jsa h LYS 76 Ca 0.00 -0.76 0.00 0.00 -2.00 0.00 0.00 60.65 57.89 2jsa h LYS 76 Cb 0.00 0.24 0.00 0.00 -0.90 0.00 0.00 32.23 31.57 2jsa h LYS 76 CO 0.00 1.33 0.17 1.25 -2.00 0.00 0.00 179.45 180.20 2jsa h LEU 77 N 0.24 0.00 -2.62 7.07 5.85 -1.64 -3.45 115.31 120.77 2jsa h LEU 77 Ca -0.16 0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.53 2jsa h LEU 77 Cb 1.78 0.00 0.02 0.00 0.37 0.00 0.00 40.66 42.83 2jsa h LEU 77 CO 0.21 0.00 -0.09 -3.20 -0.34 0.00 0.00 178.44 175.02 2jsa n ASN 78 N -2.43 -2.36 0.00 1.25 5.15 -1.14 -5.04 115.26 110.69 2jsa n ASN 78 Ca -0.02 -0.08 0.00 0.00 -0.60 0.00 0.00 54.58 53.89 2jsa n ASN 78 Cb 0.20 -1.03 0.00 0.00 -0.53 0.00 0.00 39.78 38.43 2jsa n ASN 78 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2jsa n GLU 79 N -1.58 0.00 -0.13 1.20 -0.58 -1.26 -4.72 120.64 113.57 2jsa n GLU 79 Ca -0.02 0.00 -0.05 0.00 -0.42 0.00 0.00 57.16 56.68 2jsa n GLU 79 Cb 0.52 -0.27 0.04 0.00 -0.57 0.00 0.00 31.44 31.16 2jsa n GLU 79 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65