#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jow s ALA 2 N 0.00 -1.24 0.37 3.04 0.00 -1.26 -5.16 121.76 117.52 2jow s ALA 2 Ca 0.00 0.12 -0.24 0.00 0.00 0.00 0.00 51.96 51.84 2jow s ALA 2 Cb 0.00 0.83 -0.10 0.00 0.00 0.00 0.00 23.12 23.85 2jow s ALA 2 CO 0.00 -0.77 0.98 0.95 0.00 0.00 0.00 175.76 176.92 2jow s THR 3 N -3.81 4.09 0.07 0.00 -4.23 -1.26 -4.97 115.64 105.54 2jow s THR 3 Ca 0.04 1.59 -0.31 0.00 -1.18 0.00 0.00 61.69 61.83 2jow s THR 3 Cb -0.01 -3.81 -0.08 0.00 1.34 0.00 0.00 72.50 69.94 2jow s THR 3 CO -0.09 -0.01 1.67 -2.84 -0.54 0.00 0.00 174.62 172.82 2jow s PRO 4 N -2.46 4.19 0.64 3.99 0.02 -1.26 -4.88 135.00 135.25 2jow s PRO 4 Ca 0.55 2.36 0.41 0.00 0.02 0.00 0.00 61.00 64.35 2jow s PRO 4 Cb -0.17 -3.60 2.23 0.00 0.02 0.00 0.00 34.50 32.98 2jow s PRO 4 CO 0.22 -0.75 2.32 -1.49 -0.33 0.00 0.00 177.00 176.97 2jow h TRP 5 N 8.36 0.00 -0.04 6.54 6.55 -1.97 -1.62 115.95 133.77 2jow h TRP 5 Ca -0.43 0.00 0.01 0.00 0.95 0.00 0.00 58.89 59.42 2jow h TRP 5 Cb 1.20 0.00 -0.00 0.00 -0.86 0.00 0.00 29.16 29.50 2jow h TRP 5 CO 0.78 0.00 0.12 0.66 -1.05 0.00 0.00 178.44 178.95 2jow h SER 6 N 0.00 0.00 0.33 -3.49 4.64 -1.98 0.13 113.55 113.18 2jow h SER 6 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2jow h SER 6 Cb 0.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.15 2jow h SER 6 CO 0.00 0.00 -0.20 0.61 -0.87 0.00 0.00 176.83 176.37 2jow n GLY 7 N -1.21 -0.82 0.00 -0.77 0.00 -0.61 -4.28 105.19 97.49 2jow n GLY 7 Ca -0.02 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.67 2jow n GLY 7 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2jow n TYR 8 N -0.87 0.00 -0.24 1.61 4.01 -0.50 -4.99 117.16 116.19 2jow n TYR 8 Ca 0.12 0.00 0.01 0.00 -0.16 0.00 0.00 57.90 57.88 2jow n TYR 8 Cb 0.32 0.00 0.09 0.00 -0.31 0.00 0.00 39.34 39.44 2jow n TYR 8 CO 0.00 0.00 0.00 1.25 -0.46 0.00 0.00 176.86 177.65 2jow h LEU 9 N 0.00 -0.60 -0.26 7.72 5.85 -0.97 -0.93 115.31 126.12 2jow h LEU 9 Ca 0.00 0.21 0.00 0.00 0.84 0.00 0.00 57.88 58.93 2jow h LEU 9 Cb 0.92 0.42 0.00 0.00 0.37 0.00 0.00 40.66 42.37 2jow h LEU 9 CO 0.00 -0.22 0.00 -0.67 -0.34 0.00 0.00 178.44 177.21 2jow n ASP 10 N -5.45 0.21 -0.05 1.25 2.03 -1.26 -0.87 116.55 112.41 2jow n ASP 10 Ca 0.10 -1.64 0.00 0.00 0.52 0.00 0.00 54.79 53.77 2jow n ASP 10 Cb 0.38 -0.11 0.00 0.00 -0.72 0.00 0.00 41.12 40.67 2jow n ASP 10 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 2jow n ASP 11 N -0.35 0.00 0.03 1.67 2.03 -0.39 -4.52 116.55 115.02 2jow n ASP 11 Ca 0.00 -1.09 -0.01 0.00 0.52 0.00 0.00 54.79 54.20 2jow n ASP 11 Cb 0.05 -0.02 -0.00 0.00 -0.72 0.00 0.00 41.12 40.43 2jow n ASP 11 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 2jow n VAL 12 N 0.00 1.19 0.02 5.18 0.31 -0.79 -4.31 118.33 119.92 2jow n VAL 12 Ca 0.00 0.34 -0.13 0.00 -0.01 0.00 0.00 64.34 64.54 2jow n VAL 12 Cb 0.52 -1.68 -0.09 0.00 -0.91 0.00 0.00 33.84 31.68 2jow n VAL 12 CO 0.00 0.00 0.00 -1.28 -1.32 0.00 0.00 176.83 174.23 2jow h SER 13 N -0.13 -0.03 1.06 4.52 0.87 -1.27 -3.32 113.55 115.25 2jow h SER 13 Ca -0.01 -0.31 -0.09 0.00 -1.23 0.00 0.00 61.79 60.15 2jow h SER 13 Cb 0.21 0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 62.17 2jow h SER 13 CO -0.00 0.30 -0.42 0.00 -0.53 0.00 0.00 176.83 176.17 2jow h ALA 14 N 0.61 0.87 -0.88 6.23 0.00 -1.76 -0.26 119.26 124.07 2jow h ALA 14 Ca -0.00 -0.38 0.14 0.00 0.00 0.00 0.00 54.91 54.66 2jow h ALA 14 Cb 0.34 -0.07 -0.09 0.00 0.00 0.00 0.00 17.79 17.97 2jow h ALA 14 CO 0.01 0.53 0.49 -0.22 0.00 0.00 0.00 179.25 180.05 2jow h LYS 15 N 0.00 0.70 0.21 0.00 3.64 -1.75 -0.46 116.57 118.92 2jow h LYS 15 Ca -0.00 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.32 2jow h LYS 15 Cb 1.07 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.73 2jow h LYS 15 CO 0.05 0.46 -0.10 0.35 -2.27 0.00 0.00 179.45 177.95 2jow h PHE 16 N 0.72 -0.26 0.00 1.91 3.57 -1.53 -3.30 116.94 118.05 2jow h PHE 16 Ca 0.47 -0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.96 2jow h PHE 16 Cb 0.61 0.09 -0.00 0.00 2.79 0.00 0.00 35.95 39.43 2jow h PHE 16 CO -0.06 0.12 -0.00 0.22 -2.23 0.00 0.00 178.31 176.35 2jow h ASP 17 N -0.90 0.00 0.52 0.41 3.58 -0.44 0.67 116.42 120.27 2jow h ASP 17 Ca -0.03 0.00 -0.29 0.00 0.42 0.00 0.00 57.03 57.13 2jow h ASP 17 Cb 0.50 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 41.50 2jow h ASP 17 CO 0.05 0.00 -1.64 0.00 -2.88 0.00 0.00 179.24 174.76 2jow h THR 18 N 0.00 0.93 0.22 2.25 1.03 -1.30 -3.18 112.91 112.86 2jow h THR 18 Ca -0.00 -2.76 -0.30 0.00 -0.01 0.00 0.00 66.41 63.34 2jow h THR 18 Cb 0.00 2.48 0.03 0.00 -1.07 0.00 0.00 68.15 69.59 2jow h THR 18 CO 0.00 0.56 -1.32 1.23 -0.01 0.00 0.00 175.52 175.99 2jow h GLY 19 N 3.28 0.58 0.62 2.99 0.00 -1.50 -3.03 103.07 106.01 2jow h GLY 19 Ca -0.26 -1.44 0.09 0.00 0.00 0.00 0.00 47.33 45.72 2jow h GLY 19 CO 0.09 1.26 0.61 -0.24 0.00 0.00 0.00 176.54 178.26 2jow h VAL 20 N 0.05 1.01 0.00 4.60 3.04 -1.07 -2.37 116.25 121.51 2jow h VAL 20 Ca -0.23 -0.36 -0.03 0.00 -1.01 0.00 0.00 66.70 65.07 2jow h VAL 20 Cb 2.03 -0.13 -0.00 0.00 -2.01 0.00 0.00 31.29 31.18 2jow h VAL 20 CO 0.25 0.19 -0.16 -0.78 -1.01 0.00 0.00 177.57 176.05 2jow h ASP 21 N 1.05 0.00 0.60 3.17 3.58 -1.53 0.42 116.42 123.71 2jow h ASP 21 Ca 0.44 0.00 -0.08 0.00 0.42 0.00 0.00 57.03 57.81 2jow h ASP 21 Cb 0.30 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.34 2jow h ASP 21 CO -0.21 0.16 -0.39 0.78 -2.88 0.00 0.00 179.24 176.70 2jow h ASN 22 N 0.00 0.00 0.14 2.28 2.35 -1.30 0.17 115.58 119.22 2jow h ASN 22 Ca -0.00 0.00 -0.19 0.00 -0.55 0.00 0.00 56.30 55.55 2jow h ASN 22 Cb 0.50 0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.89 2jow h ASN 22 CO 0.02 0.39 -0.88 0.25 -1.65 0.00 0.00 177.43 175.56 2jow h LEU 23 N 0.00 0.45 -0.41 1.61 7.12 -1.15 -3.29 115.31 119.64 2jow h LEU 23 Ca -0.00 -0.94 0.04 0.00 0.13 0.00 0.00 57.88 57.10 2jow h LEU 23 Cb 0.80 -0.15 -0.04 0.00 -0.53 0.00 0.00 40.66 40.74 2jow h LEU 23 CO 0.05 1.42 0.19 -0.61 -0.13 0.00 0.00 178.44 179.36 2jow h GLN 24 N -0.38 0.38 -0.46 1.25 5.75 -0.14 0.11 115.11 121.62 2jow h GLN 24 Ca -0.16 -0.02 0.05 0.00 -0.15 0.00 0.00 58.65 58.36 2jow h GLN 24 Cb 1.65 -0.09 -0.05 0.00 1.07 0.00 0.00 27.48 30.07 2jow h GLN 24 CO 0.14 0.25 0.20 0.00 -2.65 0.00 0.00 178.83 176.77 2jow h THR 25 N 0.39 0.91 0.08 2.39 1.03 -0.83 0.26 112.91 117.15 2jow h THR 25 Ca 0.18 -0.14 0.01 0.00 -0.01 0.00 0.00 66.41 66.45 2jow h THR 25 Cb 0.10 0.48 -0.01 0.00 -1.07 0.00 0.00 68.15 67.65 2jow h THR 25 CO -0.14 0.07 -0.11 1.56 -0.01 0.00 0.00 175.52 176.90 2jow h GLN 26 N 0.40 -0.22 -0.53 0.00 4.20 -1.48 0.57 115.11 118.05 2jow h GLN 26 Ca 0.21 0.01 -0.07 0.00 0.06 0.00 0.00 58.65 58.86 2jow h GLN 26 Cb 0.16 0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.97 2jow h GLN 26 CO -0.18 -0.15 0.04 -0.39 -0.67 0.00 0.00 178.83 177.49 2jow h VAL 27 N -0.23 1.25 0.00 -0.54 -1.51 -0.47 -2.15 116.25 112.60 2jow h VAL 27 Ca 0.01 -0.99 -0.06 0.00 -1.23 0.00 0.00 66.70 64.43 2jow h VAL 27 Cb 0.23 0.79 -0.01 0.00 -2.13 0.00 0.00 31.29 30.18 2jow h VAL 27 CO -0.05 0.36 -0.31 0.74 -1.23 0.00 0.00 177.57 177.08 2jow h THR 28 N 0.82 0.99 0.00 7.19 2.02 -0.25 0.57 112.91 124.24 2jow h THR 28 Ca 0.16 -1.15 -0.18 0.00 0.77 0.00 0.00 66.41 66.01 2jow h THR 28 Cb 0.43 1.67 -0.03 0.00 -1.74 0.00 0.00 68.15 68.48 2jow h THR 28 CO 0.02 0.30 -0.85 -0.33 0.37 0.00 0.00 175.52 175.02 2jow h GLU 29 N 0.00 0.00 -0.68 6.66 5.08 -0.43 0.62 114.58 125.84 2jow h GLU 29 Ca -0.00 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.28 2jow h GLU 29 Cb 0.64 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.86 2jow h GLU 29 CO 0.04 0.85 0.11 0.00 -1.00 0.00 0.00 179.01 179.01 2jow h ALA 30 N 1.15 0.91 0.00 3.43 0.00 -0.87 -2.55 119.26 121.33 2jow h ALA 30 Ca -0.01 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.55 2jow h ALA 30 Cb 1.60 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 19.13 2jow h ALA 30 CO 0.11 0.67 -0.36 1.25 0.00 0.00 0.00 179.25 180.92 2jow h LEU 31 N 1.05 0.00 -1.86 0.00 5.85 -0.78 -0.94 115.31 118.63 2jow h LEU 31 Ca 0.21 0.00 0.02 0.00 0.84 0.00 0.00 57.88 58.94 2jow h LEU 31 Cb 0.45 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.47 2jow h LEU 31 CO 0.01 0.36 0.13 -0.78 -0.34 0.00 0.00 178.44 177.82 2jow h ASP 32 N 0.00 0.16 -0.01 1.25 3.58 0.67 0.55 116.42 122.62 2jow h ASP 32 Ca -0.00 -0.00 -0.14 0.00 0.42 0.00 0.00 57.03 57.31 2jow h ASP 32 Cb 0.65 -0.04 0.01 0.00 1.72 0.00 0.00 39.33 41.67 2jow h ASP 32 CO 0.05 0.11 -0.52 0.11 -2.88 0.00 0.00 179.24 176.11 2jow h LYS 33 N 0.19 0.38 0.00 0.28 1.79 -1.26 -3.07 116.57 114.87 2jow h LYS 33 Ca 0.07 -0.39 0.00 0.00 -2.18 0.00 0.00 60.65 58.15 2jow h LYS 33 Cb 0.07 0.11 0.00 0.00 -1.58 0.00 0.00 32.23 30.83 2jow h LYS 33 CO -0.01 1.06 0.00 1.25 -1.08 0.00 0.00 179.45 180.67 2jow h LEU 34 N -0.14 0.00 0.00 2.94 6.46 0.22 0.08 115.31 124.87 2jow h LEU 34 Ca -0.06 0.00 -0.06 0.00 -0.12 0.00 0.00 57.88 57.63 2jow h LEU 34 Cb 1.23 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 41.15 2jow h LEU 34 CO 0.10 0.00 -0.45 0.00 -0.62 0.00 0.00 178.44 177.48 2jow h ALA 35 N 2.02 0.77 0.00 1.25 0.00 -0.08 -3.05 119.26 120.17 2jow h ALA 35 Ca 0.00 -0.29 -0.02 0.00 0.00 0.00 0.00 54.91 54.60 2jow h ALA 35 Cb 0.61 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 2jow h ALA 35 CO 0.00 0.38 -0.10 0.00 0.00 0.00 0.00 179.25 179.53 2jow h ALA 36 N 1.71 0.02 -0.89 0.00 0.00 -0.94 -3.43 119.26 115.73 2jow h ALA 36 Ca -0.02 -0.46 -0.34 0.00 0.00 0.00 0.00 54.91 54.09 2jow h ALA 36 Cb 1.24 0.06 -0.38 0.00 0.00 0.00 0.00 17.79 18.70 2jow h ALA 36 CO 0.04 0.06 -1.14 1.17 0.00 0.00 0.00 179.25 179.38 2jow n LYS 37 N -4.63 1.19 0.00 0.00 4.81 -0.44 -5.10 118.16 114.00 2jow n LYS 37 Ca -0.10 -3.17 0.00 0.00 -0.87 0.00 0.00 58.31 54.17 2jow n LYS 37 Cb 0.41 -1.19 0.00 0.00 0.02 0.00 0.00 35.03 34.27 2jow n LYS 37 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 2jow n PRO 38 N -0.15 0.00 0.00 1.64 -0.01 -1.15 -1.94 135.00 133.40 2jow n PRO 38 Ca 0.08 0.00 0.00 0.00 -0.01 0.00 0.00 63.50 63.57 2jow n PRO 38 Cb 0.82 0.00 0.00 0.00 -0.01 0.00 0.00 33.50 34.31 2jow n PRO 38 CO 0.00 0.00 0.00 -1.13 -0.01 0.00 0.00 175.50 174.36 2jow n SER 39 N 0.00 0.04 -4.45 2.55 3.41 -1.26 -4.27 113.62 109.65 2jow n SER 39 Ca 0.00 -1.61 -0.48 0.00 -0.26 0.00 0.00 58.87 56.52 2jow n SER 39 Cb 0.00 -0.02 -0.08 0.00 -0.26 0.00 0.00 64.21 63.85 2jow n SER 39 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2jow n ASP 40 N -0.47 1.70 0.26 4.04 2.03 -0.82 -4.83 116.55 118.46 2jow n ASP 40 Ca 0.00 0.27 0.13 0.00 0.52 0.00 0.00 54.79 55.71 2jow n ASP 40 Cb 0.01 -1.21 0.69 0.00 -0.72 0.00 0.00 41.12 39.89 2jow n ASP 40 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 2jow h PRO 41 N 12.99 0.00 -0.41 -0.67 0.13 -1.90 0.83 132.00 142.97 2jow h PRO 41 Ca -0.21 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.77 2jow h PRO 41 Cb 1.32 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.44 2jow h PRO 41 CO 1.11 0.13 -0.32 0.00 -0.23 0.00 0.00 178.00 178.69 2jow h ALA 42 N 1.87 0.59 0.20 -0.56 0.00 -1.96 0.58 119.26 119.97 2jow h ALA 42 Ca -0.00 -0.43 -0.26 0.00 0.00 0.00 0.00 54.91 54.22 2jow h ALA 42 Cb 0.41 -0.13 0.03 0.00 0.00 0.00 0.00 17.79 18.10 2jow h ALA 42 CO 0.02 0.65 -1.15 1.37 0.00 0.00 0.00 179.25 180.14 2jow h LEU 43 N 0.77 0.65 -0.49 0.00 8.10 -1.83 -3.18 115.31 119.32 2jow h LEU 43 Ca 0.08 -0.94 -0.02 0.00 0.11 0.00 0.00 57.88 57.11 2jow h LEU 43 Cb 0.91 -0.21 -0.02 0.00 -0.44 0.00 0.00 40.66 40.90 2jow h LEU 43 CO 0.08 1.55 0.23 0.25 -4.11 0.00 0.00 178.44 176.44 2jow h LEU 44 N -0.12 0.66 -0.91 0.17 7.12 -0.89 -1.26 115.31 120.07 2jow h LEU 44 Ca -0.20 -0.14 0.00 0.00 0.13 0.00 0.00 57.88 57.67 2jow h LEU 44 Cb 1.90 -0.17 0.00 0.00 -0.53 0.00 0.00 40.66 41.86 2jow h LEU 44 CO 0.21 0.61 0.00 0.00 -0.13 0.00 0.00 178.44 179.13 2jow h ALA 45 N 1.07 1.00 -0.32 1.25 0.00 -1.03 0.16 119.26 121.39 2jow h ALA 45 Ca 0.17 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.96 2jow h ALA 45 Cb 0.14 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2jow h ALA 45 CO -0.02 0.00 -0.30 0.00 0.00 0.00 0.00 179.25 178.94 2jow h ALA 46 N 2.00 0.89 0.10 0.00 0.00 -1.40 0.11 119.26 120.96 2jow h ALA 46 Ca 0.00 -0.39 -0.00 0.00 0.00 0.00 0.00 54.91 54.51 2jow h ALA 46 Cb 0.69 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.35 2jow h ALA 46 CO 0.00 0.63 -0.05 -0.92 0.00 0.00 0.00 179.25 178.91 2jow h TYR 47 N 0.57 -0.12 -0.61 0.00 3.20 -0.02 -0.56 116.97 119.43 2jow h TYR 47 Ca 0.07 -0.00 0.15 0.00 3.14 0.00 0.00 58.73 62.09 2jow h TYR 47 Cb 0.79 0.04 -0.03 0.00 1.54 0.00 0.00 36.73 39.07 2jow h TYR 47 CO 0.04 -0.01 0.42 1.96 -1.64 0.00 0.00 178.16 178.93 2jow h GLN 48 N -0.21 0.14 0.02 1.82 1.08 -0.58 0.13 115.11 117.51 2jow h GLN 48 Ca -0.01 -0.01 -0.00 0.00 -1.45 0.00 0.00 58.65 57.18 2jow h GLN 48 Cb 0.17 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.57 2jow h GLN 48 CO 0.02 0.09 -0.01 1.03 -0.95 0.00 0.00 178.83 179.01 2jow h SER 49 N 0.14 -0.02 -0.02 1.46 0.87 -0.41 -2.96 113.55 112.61 2jow h SER 49 Ca 0.29 -0.62 -0.10 0.00 -1.23 0.00 0.00 61.79 60.14 2jow h SER 49 Cb 0.95 0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 62.91 2jow h SER 49 CO -0.04 0.62 -0.27 0.11 -0.53 0.00 0.00 176.83 176.72 2jow h LYS 50 N -0.69 0.44 -0.78 2.24 1.79 -0.22 0.12 116.57 119.48 2jow h LYS 50 Ca -0.00 -0.17 0.11 0.00 -2.18 0.00 0.00 60.65 58.41 2jow h LYS 50 Cb 0.64 -0.03 -0.08 0.00 -1.58 0.00 0.00 32.23 31.19 2jow h LYS 50 CO 0.00 0.68 0.40 1.25 -1.08 0.00 0.00 179.45 180.70 2jow h LEU 51 N 0.39 0.53 -0.12 2.94 6.46 -0.90 0.23 115.31 124.83 2jow h LEU 51 Ca 0.06 0.07 -0.18 0.00 -0.12 0.00 0.00 57.88 57.71 2jow h LEU 51 Cb 0.68 -0.02 0.01 0.00 -0.73 0.00 0.00 40.66 40.59 2jow h LEU 51 CO 0.05 0.28 -0.62 0.28 -0.62 0.00 0.00 178.44 177.81 2jow h SER 52 N 0.65 0.75 -0.32 1.25 0.02 -1.11 -2.76 113.55 112.03 2jow h SER 52 Ca 0.39 -0.64 -0.00 0.00 -0.84 0.00 0.00 61.79 60.70 2jow h SER 52 Cb 0.45 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.75 2jow h SER 52 CO -0.29 1.27 0.19 -0.33 -1.14 0.00 0.00 176.83 176.53 2jow h GLU 53 N 0.27 0.44 -0.20 3.45 4.39 -0.26 0.26 114.58 122.94 2jow h GLU 53 Ca -0.04 -0.03 -0.16 0.00 0.34 0.00 0.00 59.36 59.46 2jow h GLU 53 Cb 1.26 -0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 29.80 2jow h GLU 53 CO 0.13 0.32 -0.53 -0.92 -1.16 0.00 0.00 179.01 176.84 2jow h TYR 54 N 0.45 0.73 0.00 4.33 3.20 -0.58 0.21 116.97 125.31 2jow h TYR 54 Ca 0.12 -0.25 -0.05 0.00 3.14 0.00 0.00 58.73 61.68 2jow h TYR 54 Cb -0.01 -0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.11 2jow h TYR 54 CO 0.00 0.99 -0.26 -0.97 -1.64 0.00 0.00 178.16 176.28 2jow h ASN 55 N 0.45 0.00 -0.20 -2.11 -0.73 -1.01 -0.54 115.58 111.44 2jow h ASN 55 Ca 0.01 0.00 -0.20 0.00 1.87 0.00 0.00 56.30 57.98 2jow h ASN 55 Cb 1.07 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.67 2jow h ASN 55 CO 0.10 0.26 -0.66 -0.07 -0.37 0.00 0.00 177.43 176.69 2jow h LEU 56 N 0.00 0.94 -0.81 0.34 4.07 -0.55 0.26 115.31 119.56 2jow h LEU 56 Ca -0.00 -0.56 0.10 0.00 0.08 0.00 0.00 57.88 57.50 2jow h LEU 56 Cb 0.63 -0.27 -0.07 0.00 1.08 0.00 0.00 40.66 42.02 2jow h LEU 56 CO 0.03 1.36 0.45 0.22 -1.08 0.00 0.00 178.44 179.42 2jow h TYR 57 N 0.60 0.82 -0.35 1.13 3.20 -0.23 -0.09 116.97 122.04 2jow h TYR 57 Ca -0.02 0.03 -0.09 0.00 3.14 0.00 0.00 58.73 61.80 2jow h TYR 57 Cb 1.28 -0.25 -0.02 0.00 1.54 0.00 0.00 36.73 39.28 2jow h TYR 57 CO 0.08 0.32 -0.14 -0.09 -1.64 0.00 0.00 178.16 176.68 2jow h ARG 58 N 0.75 0.62 -0.29 1.82 9.65 -0.87 0.11 114.38 126.18 2jow h ARG 58 Ca 0.40 -0.20 -0.05 0.00 -1.10 0.00 0.00 59.98 59.02 2jow h ARG 58 Cb 0.39 -0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 28.90 2jow h ARG 58 CO -0.26 0.75 -0.01 -0.97 2.80 0.00 0.00 179.97 182.28 2jow h ASN 59 N 0.57 0.52 -0.71 -3.80 -0.73 0.27 -1.98 115.58 109.71 2jow h ASN 59 Ca 0.10 -0.32 -0.02 0.00 1.87 0.00 0.00 56.30 57.93 2jow h ASN 59 Cb 0.58 -0.14 -0.03 0.00 0.27 0.00 0.00 38.32 38.99 2jow h ASN 59 CO 0.04 0.71 0.36 0.00 -0.37 0.00 0.00 177.43 178.16 2jow h ALA 60 N 0.82 0.91 0.00 1.57 0.00 -0.95 -1.93 119.26 119.69 2jow h ALA 60 Ca 0.08 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2jow h ALA 60 Cb 0.45 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.96 2jow h ALA 60 CO 0.02 0.45 0.00 0.94 0.00 0.00 0.00 179.25 180.66 2jow n GLN 61 N -4.45 0.96 -0.39 0.00 0.00 0.38 -0.99 117.38 112.89 2jow n GLN 61 Ca 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 57.06 2jow n GLN 61 Cb 0.12 -1.02 0.00 0.00 0.00 0.00 0.00 30.24 29.34 2jow n GLN 61 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 2jow n SER 62 N 0.55 0.00 0.01 1.69 2.88 -0.75 -4.79 113.62 113.21 2jow n SER 62 Ca 0.00 -1.54 0.00 0.00 -1.33 0.00 0.00 58.87 56.00 2jow n SER 62 Cb 0.48 -0.11 0.00 0.00 -0.75 0.00 0.00 64.21 63.83 2jow n SER 62 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 2jow n ASN 63 N 0.00 0.08 -0.33 -3.46 2.85 -0.16 -4.68 115.26 109.55 2jow n ASN 63 Ca 0.00 0.02 0.10 0.00 -0.11 0.00 0.00 54.58 54.59 2jow n ASN 63 Cb 0.61 -0.01 0.27 0.00 1.24 0.00 0.00 39.78 41.89 2jow n ASN 63 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2jow h THR 64 N 0.00 0.74 -0.89 -0.44 1.03 -1.63 0.54 112.91 112.25 2jow h THR 64 Ca 0.00 -0.25 0.26 0.00 -0.01 0.00 0.00 66.41 66.41 2jow h THR 64 Cb 0.66 -0.06 -0.04 0.00 -1.07 0.00 0.00 68.15 67.64 2jow h THR 64 CO 0.00 0.13 0.65 0.58 -0.01 0.00 0.00 175.52 176.88 2jow h VAL 65 N 0.73 0.53 -0.23 0.00 2.07 -1.86 0.50 116.25 118.00 2jow h VAL 65 Ca 0.53 0.00 0.00 0.00 0.82 0.00 0.00 66.70 68.05 2jow h VAL 65 Cb 0.76 0.54 0.00 0.00 -1.52 0.00 0.00 31.29 31.07 2jow h VAL 65 CO -0.36 0.00 0.00 0.29 0.02 0.00 0.00 177.57 177.52 2jow n LYS 66 N -4.24 2.75 -0.02 1.57 5.02 0.12 -4.12 118.16 119.23 2jow n LYS 66 Ca 0.18 -2.29 -0.03 0.00 -2.02 0.00 0.00 58.31 54.15 2jow n LYS 66 Cb 0.97 -1.45 -0.03 0.00 -0.02 0.00 0.00 35.03 34.50 2jow n LYS 66 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2jow n VAL 67 N -0.18 0.29 0.30 -0.18 0.31 -0.20 -4.31 118.33 114.36 2jow n VAL 67 Ca 0.14 -0.15 0.19 0.00 -0.01 0.00 0.00 64.34 64.51 2jow n VAL 67 Cb 0.58 -0.80 0.91 0.00 -0.91 0.00 0.00 33.84 33.63 2jow n VAL 67 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 2jow h PHE 68 N 0.00 0.00 -0.65 3.52 0.04 -1.18 0.15 116.94 118.82 2jow h PHE 68 Ca -0.11 0.00 0.01 0.00 2.80 0.00 0.00 57.97 60.66 2jow h PHE 68 Cb 1.22 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 39.34 2jow h PHE 68 CO 0.00 0.02 0.43 -0.22 -0.60 0.00 0.00 178.31 177.95 2jow h LYS 69 N 0.00 0.86 0.06 1.51 3.11 -1.75 0.13 116.57 120.48 2jow h LYS 69 Ca -0.00 -0.05 -0.24 0.00 -2.81 0.00 0.00 60.65 57.55 2jow h LYS 69 Cb 0.27 -0.19 -0.01 0.00 -1.00 0.00 0.00 32.23 31.30 2jow h LYS 69 CO 0.00 0.57 -1.07 0.22 -2.81 0.00 0.00 179.45 176.36 2jow h ASP 70 N 0.88 0.26 -0.45 4.20 3.58 -0.95 -0.42 116.42 123.53 2jow h ASP 70 Ca 0.24 -0.26 -0.08 0.00 0.42 0.00 0.00 57.03 57.35 2jow h ASP 70 Cb -0.10 -0.08 -0.01 0.00 1.72 0.00 0.00 39.33 40.85 2jow h ASP 70 CO -0.05 1.16 -0.05 -0.29 -2.88 0.00 0.00 179.24 177.13 2jow h ILE 71 N 0.06 1.27 -0.11 2.25 -0.00 -1.01 -2.71 117.51 117.27 2jow h ILE 71 Ca -0.07 -1.14 -0.06 0.00 -0.00 0.00 0.00 64.86 63.59 2jow h ILE 71 Cb 1.79 1.10 -0.01 0.00 -0.00 0.00 0.00 36.82 39.70 2jow h ILE 71 CO 0.16 0.39 -0.22 -0.78 -0.00 0.00 0.00 178.15 177.70 2jow h ASP 72 N 0.66 0.18 0.18 2.19 3.58 -0.74 -0.73 116.42 121.74 2jow h ASP 72 Ca 0.12 -0.05 -0.03 0.00 0.42 0.00 0.00 57.03 57.49 2jow h ASP 72 Cb 0.57 -0.05 -0.00 0.00 1.72 0.00 0.00 39.33 41.57 2jow h ASP 72 CO 0.03 0.41 -0.14 0.00 -2.88 0.00 0.00 179.24 176.66 2jow h ALA 73 N 1.61 1.64 0.02 -0.78 0.00 -0.91 0.19 119.26 121.03 2jow h ALA 73 Ca 0.03 -0.13 -0.23 0.00 0.00 0.00 0.00 54.91 54.58 2jow h ALA 73 Cb 0.50 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.26 2jow h ALA 73 CO 0.03 0.18 -0.98 0.00 0.00 0.00 0.00 179.25 178.49 2jow h ALA 74 N 1.86 0.35 -0.43 0.00 0.00 -0.93 -2.84 119.26 117.27 2jow h ALA 74 Ca -0.00 -0.74 -0.02 0.00 0.00 0.00 0.00 54.91 54.15 2jow h ALA 74 Cb 0.28 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 2jow h ALA 74 CO 0.02 0.87 0.20 0.82 0.00 0.00 0.00 179.25 181.15 2jow h ILE 75 N 0.18 1.15 -0.34 0.00 2.04 -0.47 -1.54 117.51 118.52 2jow h ILE 75 Ca -0.08 -0.45 0.02 0.00 1.00 0.00 0.00 64.86 65.34 2jow h ILE 75 Cb 1.63 0.61 -0.02 0.00 -0.74 0.00 0.00 36.82 38.30 2jow h ILE 75 CO 0.16 0.18 0.19 0.25 0.00 0.00 0.00 178.15 178.94 2jow h LEU 76 N 0.61 0.31 -1.06 1.44 5.85 -0.59 0.93 115.31 122.79 2jow h LEU 76 Ca 0.15 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.86 2jow h LEU 76 Cb 0.09 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.02 2jow h LEU 76 CO -0.02 0.22 0.41 -0.33 -0.34 0.00 0.00 178.44 178.38 2jow h GLU 77 N 0.39 1.06 -0.50 1.25 5.08 -1.21 -2.05 114.58 118.61 2jow h GLU 77 Ca 0.14 -0.12 -0.09 0.00 -1.00 0.00 0.00 59.36 58.29 2jow h GLU 77 Cb 0.02 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 29.04 2jow h GLU 77 CO -0.07 0.79 -0.04 1.25 -1.00 0.00 0.00 179.01 179.93 2jow h HIS 78 N 1.07 0.94 -0.28 4.33 2.76 -0.74 -3.25 115.15 119.98 2jow h HIS 78 Ca 0.27 -0.16 -0.17 0.00 -2.20 0.00 0.00 60.37 58.12 2jow h HIS 78 Cb 0.04 -0.25 -0.00 0.00 1.55 0.00 0.00 27.41 28.75 2jow h HIS 78 CO 0.01 0.87 -0.47 1.25 -1.30 0.00 0.00 177.93 178.29 2jow h HIS 79 N 0.79 1.01 0.00 5.26 -0.00 -0.57 -3.31 115.15 118.33 2jow h HIS 79 Ca 0.14 -0.35 -0.35 0.00 -0.00 0.00 0.00 60.37 59.81 2jow h HIS 79 Cb 0.54 -0.19 -0.03 0.00 -0.00 0.00 0.00 27.41 27.72 2jow h HIS 79 CO 0.03 1.16 1.15 0.72 -0.00 0.00 0.00 177.93 180.99 2jow n HIS 80 N -4.09 0.84 -0.68 5.26 -0.00 -0.80 -4.96 115.22 110.79 2jow n HIS 80 Ca -0.05 -1.98 -0.31 0.00 -0.00 0.00 0.00 57.72 55.38 2jow n HIS 80 Cb 0.59 -1.85 0.17 0.00 -0.00 0.00 0.00 29.99 28.89 2jow n HIS 80 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 2jow n HIS 81 N 2.94 0.36 0.31 4.41 -0.00 -1.25 -4.94 115.22 117.06 2jow n HIS 81 Ca 0.53 0.34 0.16 0.00 0.46 0.00 0.00 57.72 59.22 2jow n HIS 81 Cb 0.63 -1.95 0.69 0.00 -0.12 0.00 0.00 29.99 29.24 2jow n HIS 81 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 2jow h HIS 82 N -1.90 0.00 0.00 1.57 -0.00 -1.94 -3.53 115.15 109.35 2jow h HIS 82 Ca -0.44 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 59.93 2jow h HIS 82 Cb 1.28 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.69 2jow h HIS 82 CO 0.47 0.00 0.00 1.58 -0.00 0.00 0.00 177.93 179.98