#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 -0.60 0.43 3.04 0.00 -1.26 -4.83 121.76 118.53 2jow s ALA 2 Ca 0.00 -0.10 -0.21 0.00 0.00 0.00 0.00 51.96 51.64 2jow s ALA 2 Cb 0.00 0.36 -0.10 0.00 0.00 0.00 0.00 23.12 23.37 2jow s ALA 2 CO 0.00 -0.43 0.97 0.95 0.00 0.00 0.00 175.76 177.25 2jow s THR 3 N -2.77 4.22 -0.31 0.00 -4.23 -1.26 -5.00 115.64 106.30 2jow s THR 3 Ca -0.03 1.44 -0.28 0.00 -1.18 0.00 0.00 61.69 61.63 2jow s THR 3 Cb -0.00 -3.61 -0.02 0.00 1.34 0.00 0.00 72.50 70.21 2jow s THR 3 CO -0.05 -0.25 1.78 -2.84 -0.54 0.00 0.00 174.62 172.73 2jow s PRO 4 N -3.05 3.42 0.21 3.99 0.02 -1.26 -4.90 135.00 133.42 2jow s PRO 4 Ca 0.62 1.49 -0.14 0.00 0.02 0.00 0.00 61.00 62.99 2jow s PRO 4 Cb -0.12 -4.17 0.23 0.00 0.02 0.00 0.00 34.50 30.46 2jow s PRO 4 CO 0.16 -1.76 1.63 0.11 -0.33 0.00 0.00 177.00 176.81 2jow h TRP 5 N 12.54 -0.34 0.00 6.54 5.08 -1.97 -1.99 115.95 135.81 2jow h TRP 5 Ca -0.34 0.06 0.00 0.00 1.08 0.00 0.00 58.89 59.69 2jow h TRP 5 Cb 1.17 0.25 0.00 0.00 -3.00 0.00 0.00 29.16 27.58 2jow h TRP 5 CO 0.95 -0.27 0.00 -1.13 -1.28 0.00 0.00 178.44 176.71 2jow n SER 6 N -5.43 0.00 -0.04 0.11 3.41 -1.26 -0.31 113.62 110.10 2jow n SER 6 Ca 0.07 0.12 0.04 0.00 -0.26 0.00 0.00 58.87 58.85 2jow n SER 6 Cb 0.33 -0.27 0.05 0.00 -0.26 0.00 0.00 64.21 64.06 2jow n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2jow n GLY 7 N -0.45 3.46 0.00 5.00 0.00 -0.75 -4.86 105.19 107.59 2jow n GLY 7 Ca 0.05 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 45.64 2jow n GLY 7 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 2jow n TYR 8 N -0.82 0.00 -0.36 1.61 9.36 -0.58 -4.94 117.16 121.43 2jow n TYR 8 Ca 0.06 0.00 0.09 0.00 3.32 0.00 0.00 57.90 61.37 2jow n TYR 8 Cb 0.41 0.00 0.26 0.00 -0.63 0.00 0.00 39.34 39.38 2jow n TYR 8 CO 0.00 0.00 0.00 1.25 0.22 0.00 0.00 176.86 178.33 2jow h LEU 9 N 0.00 0.89 -0.79 2.98 7.12 -0.92 -2.57 115.31 122.02 2jow h LEU 9 Ca 0.00 0.06 0.00 0.00 0.13 0.00 0.00 57.88 58.07 2jow h LEU 9 Cb 0.00 -0.11 0.00 0.00 -0.53 0.00 0.00 40.66 40.02 2jow h LEU 9 CO 0.00 0.43 0.00 -0.67 -0.13 0.00 0.00 178.44 178.07 2jow n ASP 10 N -4.66 0.34 -0.00 1.25 2.03 -1.26 -0.57 116.55 113.67 2jow n ASP 10 Ca 0.20 0.65 0.07 0.00 0.52 0.00 0.00 54.79 56.23 2jow n ASP 10 Cb 0.41 -0.70 -0.09 0.00 -0.72 0.00 0.00 41.12 40.03 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 -1.95 1.02 -0.13 1.67 2.03 -0.97 -4.12 116.55 114.11 2jow n ASP 11 Ca -0.00 -0.55 -0.26 0.00 0.52 0.00 0.00 54.79 54.51 2jow n ASP 11 Cb 0.05 1.22 -0.09 0.00 -0.72 0.00 0.00 41.12 41.58 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 -1.55 1.52 -0.18 5.18 0.31 -0.01 -2.83 118.33 120.77 2jow n VAL 12 Ca 0.01 -0.25 -0.07 0.00 -0.01 0.00 0.00 64.34 64.02 2jow n VAL 12 Cb 0.27 -1.98 0.08 0.00 -0.91 0.00 0.00 33.84 31.30 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 -1.00 0.95 1.05 4.52 0.87 -1.13 -2.64 113.55 116.18 2jow h SER 13 Ca -0.55 -0.25 -0.02 0.00 -1.23 0.00 0.00 61.79 59.74 2jow h SER 13 Cb 1.46 -0.25 -0.00 0.00 -0.44 0.00 0.00 62.40 63.16 2jow h SER 13 CO -0.33 1.00 -0.10 0.00 -0.53 0.00 0.00 176.83 176.87 2jow h ALA 14 N 1.11 1.01 -0.51 6.23 0.00 -1.72 -2.94 119.26 122.44 2jow h ALA 14 Ca 0.17 -0.09 0.05 0.00 0.00 0.00 0.00 54.91 55.04 2jow h ALA 14 Cb 0.50 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 18.22 2jow h ALA 14 CO 0.02 0.12 0.24 -0.22 0.00 0.00 0.00 179.25 179.42 2jow h LYS 15 N 0.00 0.45 0.00 0.00 3.64 -1.31 0.30 116.57 119.65 2jow h LYS 15 Ca -0.00 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 2jow h LYS 15 Cb 0.65 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.37 2jow h LYS 15 CO 0.01 0.30 0.00 0.34 -2.27 0.00 0.00 179.45 177.83 2jow n PHE 16 N -4.92 0.00 -0.03 1.91 -0.00 -1.11 -0.27 117.46 113.05 2jow n PHE 16 Ca 0.05 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.50 2jow n PHE 16 Cb 0.15 -0.28 0.00 0.00 -0.00 0.00 0.00 39.48 39.35 2jow n PHE 16 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.76 173.29 2jow n ASP 17 N -1.28 0.44 0.00 -2.13 2.03 -0.06 -4.61 116.55 110.94 2jow n ASP 17 Ca 0.01 -0.72 0.00 0.00 0.52 0.00 0.00 54.79 54.60 2jow n ASP 17 Cb 0.01 0.50 0.00 0.00 -0.72 0.00 0.00 41.12 40.91 2jow n ASP 17 CO 0.00 0.00 0.00 1.07 -1.92 0.00 0.00 177.20 176.35 2jow n THR 18 N -0.50 0.00 0.08 5.18 5.66 -0.31 -4.65 114.28 119.75 2jow n THR 18 Ca 0.00 0.00 -0.08 0.00 -3.05 0.00 0.00 64.05 60.92 2jow n THR 18 Cb 0.01 -0.05 -0.05 0.00 -1.55 0.00 0.00 70.33 68.69 2jow n THR 18 CO 0.00 0.00 0.00 1.23 -3.05 0.00 0.00 175.07 173.25 2jow h GLY 19 N 0.00 0.09 0.15 1.09 0.00 -0.84 -3.10 103.07 100.45 2jow h GLY 19 Ca 0.00 -0.19 0.22 0.00 0.00 0.00 0.00 47.33 47.36 2jow h GLY 19 CO 0.00 0.16 0.62 -0.24 0.00 0.00 0.00 176.54 177.09 2jow h VAL 20 N 0.04 0.65 0.00 4.60 3.04 -1.78 -0.94 116.25 121.85 2jow h VAL 20 Ca -0.03 -0.17 0.00 0.00 -1.01 0.00 0.00 66.70 65.49 2jow h VAL 20 Cb 1.62 0.11 0.00 0.00 -2.01 0.00 0.00 31.29 31.01 2jow h VAL 20 CO 0.13 0.09 0.00 -0.78 -1.01 0.00 0.00 177.57 176.00 2jow h ASP 21 N 0.49 0.00 0.62 3.17 3.58 -1.80 0.31 116.42 122.79 2jow h ASP 21 Ca 0.53 0.00 -0.10 0.00 0.42 0.00 0.00 57.03 57.88 2jow h ASP 21 Cb 1.20 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.23 2jow h ASP 21 CO -0.25 0.00 -0.47 0.78 -2.88 0.00 0.00 179.24 176.41 2jow h ASN 22 N 0.00 0.00 0.13 2.28 2.35 -1.31 0.17 115.58 119.21 2jow h ASN 22 Ca 0.00 0.00 -0.19 0.00 -0.55 0.00 0.00 56.30 55.56 2jow h ASN 22 Cb 0.40 0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.79 2jow h ASN 22 CO 0.00 0.47 -0.88 0.25 -1.65 0.00 0.00 177.43 175.63 2jow h LEU 23 N 0.00 0.44 -0.57 1.61 7.12 -1.19 -3.26 115.31 119.45 2jow h LEU 23 Ca -0.00 -0.94 0.05 0.00 0.13 0.00 0.00 57.88 57.12 2jow h LEU 23 Cb 0.91 -0.14 -0.05 0.00 -0.53 0.00 0.00 40.66 40.85 2jow h LEU 23 CO 0.06 1.41 0.29 -0.61 -0.13 0.00 0.00 178.44 179.46 2jow h GLN 24 N -0.39 0.53 -0.53 1.25 5.75 -0.41 0.69 115.11 122.00 2jow h GLN 24 Ca -0.16 -0.03 0.02 0.00 -0.15 0.00 0.00 58.65 58.33 2jow h GLN 24 Cb 1.63 -0.12 -0.03 0.00 1.07 0.00 0.00 27.48 30.03 2jow h GLN 24 CO 0.13 0.35 0.32 0.00 -2.65 0.00 0.00 178.83 176.98 2jow h THR 25 N 0.55 1.07 0.04 2.39 1.03 -0.83 0.23 112.91 117.39 2jow h THR 25 Ca 0.26 -0.22 0.02 0.00 -0.01 0.00 0.00 66.41 66.45 2jow h THR 25 Cb 0.18 0.37 -0.02 0.00 -1.07 0.00 0.00 68.15 67.61 2jow h THR 25 CO -0.18 0.12 -0.13 1.56 -0.01 0.00 0.00 175.52 176.87 2jow h GLN 26 N 0.64 -0.24 -0.51 0.00 7.50 -1.44 0.11 115.11 121.17 2jow h GLN 26 Ca 0.21 0.02 -0.07 0.00 0.50 0.00 0.00 58.65 59.30 2jow h GLN 26 Cb 0.01 0.05 -0.02 0.00 0.05 0.00 0.00 27.48 27.57 2jow h GLN 26 CO -0.09 -0.16 0.02 -0.39 -1.50 0.00 0.00 178.83 176.71 2jow h VAL 27 N -0.25 1.25 0.00 -0.54 -1.51 -0.57 -1.81 116.25 112.82 2jow h VAL 27 Ca 0.03 -1.01 -0.07 0.00 -1.23 0.00 0.00 66.70 64.42 2jow h VAL 27 Cb 0.28 0.83 -0.01 0.00 -2.13 0.00 0.00 31.29 30.26 2jow h VAL 27 CO -0.10 0.36 -0.35 0.74 -1.23 0.00 0.00 177.57 177.00 2jow h THR 28 N 0.80 1.02 0.00 7.19 2.02 -0.33 0.50 112.91 124.11 2jow h THR 28 Ca 0.16 -1.29 -0.18 0.00 0.77 0.00 0.00 66.41 65.87 2jow h THR 28 Cb 0.45 1.74 -0.03 0.00 -1.74 0.00 0.00 68.15 68.58 2jow h THR 28 CO 0.02 0.34 -0.84 -0.33 0.37 0.00 0.00 175.52 175.08 2jow h GLU 29 N 0.00 0.00 -0.61 6.66 5.08 -0.33 0.59 114.58 125.97 2jow h GLU 29 Ca -0.00 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 58.28 2jow h GLU 29 Cb 0.71 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.94 2jow h GLU 29 CO 0.04 0.84 0.09 0.00 -1.00 0.00 0.00 179.01 178.99 2jow h ALA 30 N 1.16 1.01 0.00 3.43 0.00 -0.86 -2.47 119.26 121.53 2jow h ALA 30 Ca -0.01 -0.26 -0.09 0.00 0.00 0.00 0.00 54.91 54.56 2jow h ALA 30 Cb 1.61 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 19.15 2jow h ALA 30 CO 0.11 0.63 -0.42 1.25 0.00 0.00 0.00 179.25 180.82 2jow h LEU 31 N 0.94 0.00 -1.86 0.00 5.85 -0.78 -0.82 115.31 118.64 2jow h LEU 31 Ca 0.19 0.00 0.04 0.00 0.84 0.00 0.00 57.88 58.94 2jow h LEU 31 Cb 0.41 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.43 2jow h LEU 31 CO 0.01 0.42 0.17 -0.78 -0.34 0.00 0.00 178.44 177.92 2jow h ASP 32 N 0.00 0.16 0.00 1.25 3.58 0.67 0.57 116.42 122.65 2jow h ASP 32 Ca -0.00 -0.00 -0.15 0.00 0.42 0.00 0.00 57.03 57.29 2jow h ASP 32 Cb 0.77 -0.04 0.01 0.00 1.72 0.00 0.00 39.33 41.80 2jow h ASP 32 CO 0.05 0.11 -0.59 0.11 -2.88 0.00 0.00 179.24 176.05 2jow h LYS 33 N 0.18 0.40 0.00 0.28 1.79 -1.23 -3.03 116.57 114.96 2jow h LYS 33 Ca 0.11 -0.43 0.00 0.00 -2.18 0.00 0.00 60.65 58.15 2jow h LYS 33 Cb 0.20 0.12 0.00 0.00 -1.58 0.00 0.00 32.23 30.97 2jow h LYS 33 CO -0.02 1.10 0.00 1.25 -1.08 0.00 0.00 179.45 180.70 2jow h LEU 34 N -0.13 0.00 0.00 2.94 6.46 0.20 -0.06 115.31 124.73 2jow h LEU 34 Ca -0.07 0.00 -0.07 0.00 -0.12 0.00 0.00 57.88 57.61 2jow h LEU 34 Cb 1.30 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 41.22 2jow h LEU 34 CO 0.12 0.00 -0.55 0.00 -0.62 0.00 0.00 178.44 177.39 2jow h ALA 35 N 2.02 0.74 0.00 1.25 0.00 -0.03 -3.06 119.26 120.18 2jow h ALA 35 Ca 0.00 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 2jow h ALA 35 Cb 0.59 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 2jow h ALA 35 CO 0.00 0.42 -0.08 0.00 0.00 0.00 0.00 179.25 179.58 2jow h ALA 36 N 1.69 0.02 -0.82 0.00 0.00 -0.94 -3.43 119.26 115.77 2jow h ALA 36 Ca -0.02 -0.46 -0.32 0.00 0.00 0.00 0.00 54.91 54.10 2jow h ALA 36 Cb 1.26 0.05 -0.39 0.00 0.00 0.00 0.00 17.79 18.71 2jow h ALA 36 CO 0.04 0.05 -1.15 1.17 0.00 0.00 0.00 179.25 179.36 2jow n LYS 37 N -4.63 1.29 0.00 0.00 4.81 -0.37 -5.10 118.16 114.17 2jow n LYS 37 Ca -0.10 -3.25 0.00 0.00 -0.87 0.00 0.00 58.31 54.09 2jow n LYS 37 Cb 0.41 -1.28 0.00 0.00 0.02 0.00 0.00 35.03 34.18 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 -0.22 0.00 0.00 1.64 -0.01 -1.16 -1.94 135.00 133.31 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 0.05 -4.45 2.55 3.41 -1.26 -4.28 113.62 109.64 2jow n SER 39 Ca 0.00 -1.55 -0.48 0.00 -0.26 0.00 0.00 58.87 56.59 2jow n SER 39 Cb 0.00 -0.02 -0.08 0.00 -0.26 0.00 0.00 64.21 63.84 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 -0.46 1.72 0.25 4.04 2.03 -0.82 -4.83 116.55 118.48 2jow n ASP 40 Ca 0.00 0.26 0.12 0.00 0.52 0.00 0.00 54.79 55.69 2jow n ASP 40 Cb 0.01 -1.22 0.64 0.00 -0.72 0.00 0.00 41.12 39.83 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 13.10 0.00 -0.49 -0.67 0.13 -1.90 0.65 132.00 142.82 2jow h PRO 41 Ca -0.21 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 64.87 2jow h PRO 41 Cb 1.32 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.43 2jow h PRO 41 CO 1.11 0.16 0.14 0.00 -0.23 0.00 0.00 178.00 179.18 2jow h ALA 42 N 1.84 0.65 0.18 -0.56 0.00 -1.96 0.69 119.26 120.10 2jow h ALA 42 Ca -0.00 -0.20 -0.24 0.00 0.00 0.00 0.00 54.91 54.47 2jow h ALA 42 Cb 0.47 -0.19 0.03 0.00 0.00 0.00 0.00 17.79 18.10 2jow h ALA 42 CO 0.02 0.32 -1.08 1.37 0.00 0.00 0.00 179.25 179.88 2jow h LEU 43 N 0.67 0.59 -1.19 0.00 8.10 -1.83 -3.20 115.31 118.46 2jow h LEU 43 Ca 0.16 -0.94 -0.05 0.00 0.11 0.00 0.00 57.88 57.16 2jow h LEU 43 Cb 0.30 -0.19 -0.02 0.00 -0.44 0.00 0.00 40.66 40.31 2jow h LEU 43 CO -0.00 1.52 -0.01 0.25 -4.11 0.00 0.00 178.44 176.08 2jow h LEU 44 N -0.20 0.51 -0.37 0.17 7.12 -0.91 -0.11 115.31 121.53 2jow h LEU 44 Ca -0.19 -0.10 -0.16 0.00 0.13 0.00 0.00 57.88 57.56 2jow h LEU 44 Cb 1.83 -0.13 -0.02 0.00 -0.53 0.00 0.00 40.66 41.80 2jow h LEU 44 CO 0.19 0.59 -0.75 0.00 -0.13 0.00 0.00 178.44 178.33 2jow h ALA 45 N 1.48 0.67 -0.37 1.25 0.00 -1.00 0.47 119.26 121.75 2jow h ALA 45 Ca 0.11 -0.68 -0.08 0.00 0.00 0.00 0.00 54.91 54.25 2jow h ALA 45 Cb 0.35 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 2jow h ALA 45 CO 0.01 0.94 -0.11 0.00 0.00 0.00 0.00 179.25 180.09 2jow h ALA 46 N 1.25 1.11 0.50 0.00 0.00 -1.41 0.29 119.26 120.99 2jow h ALA 46 Ca -0.01 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.58 2jow h ALA 46 Cb 1.40 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 19.04 2jow h ALA 46 CO 0.10 0.56 -0.24 -0.92 0.00 0.00 0.00 179.25 178.74 2jow h TYR 47 N 0.60 -0.62 0.00 0.00 3.20 -0.76 -0.62 116.97 118.77 2jow h TYR 47 Ca 0.11 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.95 2jow h TYR 47 Cb 0.54 0.21 -0.00 0.00 1.54 0.00 0.00 36.73 39.02 2jow h TYR 47 CO 0.02 -0.36 -0.05 -0.56 -1.64 0.00 0.00 178.16 175.57 2jow h GLN 48 N -0.72 0.00 0.15 1.82 -0.00 -0.80 0.12 115.11 115.68 2jow h GLN 48 Ca -0.07 0.00 -0.01 0.00 -0.00 0.00 0.00 58.65 58.57 2jow h GLN 48 Cb 0.54 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.02 2jow h GLN 48 CO 0.11 0.05 -0.07 0.77 -0.00 0.00 0.00 178.83 179.69 2jow h SER 49 N 0.00 -0.17 -0.45 0.06 0.02 -0.81 -3.12 113.55 109.08 2jow h SER 49 Ca -0.00 -0.33 -0.07 0.00 -0.84 0.00 0.00 61.79 60.56 2jow h SER 49 Cb 0.36 0.05 -0.02 0.00 0.14 0.00 0.00 62.40 62.92 2jow h SER 49 CO 0.01 0.27 0.04 0.11 -1.14 0.00 0.00 176.83 176.12 2jow h LYS 50 N -0.67 0.83 -0.95 3.45 1.79 0.14 0.88 116.57 122.04 2jow h LYS 50 Ca -0.02 -0.21 0.17 0.00 -2.18 0.00 0.00 60.65 58.41 2jow h LYS 50 Cb 0.49 -0.10 -0.08 0.00 -1.58 0.00 0.00 32.23 30.95 2jow h LYS 50 CO 0.03 0.80 0.60 1.25 -1.08 0.00 0.00 179.45 181.06 2jow h LEU 51 N 0.78 0.70 0.23 2.94 6.46 -0.94 0.19 115.31 125.66 2jow h LEU 51 Ca 0.16 0.06 -0.30 0.00 -0.12 0.00 0.00 57.88 57.68 2jow h LEU 51 Cb 0.41 -0.07 0.03 0.00 -0.73 0.00 0.00 40.66 40.30 2jow h LEU 51 CO 0.01 0.31 -1.31 0.28 -0.62 0.00 0.00 178.44 177.11 2jow h SER 52 N 0.71 0.75 -0.46 1.25 0.02 -1.23 -3.24 113.55 111.35 2jow h SER 52 Ca 0.51 -0.93 0.07 0.00 -0.84 0.00 0.00 61.79 60.60 2jow h SER 52 Cb 0.83 -0.24 -0.03 0.00 0.14 0.00 0.00 62.40 63.10 2jow h SER 52 CO -0.27 1.63 0.31 -0.33 -1.14 0.00 0.00 176.83 177.04 2jow h GLU 53 N 0.01 0.30 -0.31 3.45 4.39 0.04 0.21 114.58 122.67 2jow h GLU 53 Ca -0.23 -0.02 -0.15 0.00 0.34 0.00 0.00 59.36 59.30 2jow h GLU 53 Cb 2.03 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 30.61 2jow h GLU 53 CO 0.24 0.20 -0.40 -0.92 -1.16 0.00 0.00 179.01 176.97 2jow h TYR 54 N 0.31 0.90 0.00 4.33 3.20 -0.77 0.31 116.97 125.26 2jow h TYR 54 Ca 0.21 -0.27 -0.09 0.00 3.14 0.00 0.00 58.73 61.72 2jow h TYR 54 Cb 0.41 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 38.48 2jow h TYR 54 CO -0.00 1.03 -0.42 -0.97 -1.64 0.00 0.00 178.16 176.17 2jow h ASN 55 N 0.62 0.00 -0.02 -2.11 -1.24 -1.30 -1.85 115.58 109.68 2jow h ASN 55 Ca 0.05 0.00 -0.16 0.00 0.71 0.00 0.00 56.30 56.90 2jow h ASN 55 Cb 0.96 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 40.00 2jow h ASN 55 CO 0.09 0.42 -0.52 -0.07 -1.29 0.00 0.00 177.43 176.06 2jow h LEU 56 N 0.00 0.65 -0.68 0.34 4.07 -0.64 0.11 115.31 119.15 2jow h LEU 56 Ca -0.00 -0.33 0.06 0.00 0.08 0.00 0.00 57.88 57.68 2jow h LEU 56 Cb 0.84 -0.19 -0.06 0.00 1.08 0.00 0.00 40.66 42.34 2jow h LEU 56 CO 0.05 1.05 0.38 0.22 -1.08 0.00 0.00 178.44 179.06 2jow h TYR 57 N 0.46 0.70 -0.75 1.13 3.20 -0.14 0.10 116.97 121.67 2jow h TYR 57 Ca 0.02 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.90 2jow h TYR 57 Cb 1.06 -0.21 -0.04 0.00 1.54 0.00 0.00 36.73 39.08 2jow h TYR 57 CO 0.05 0.33 0.42 -0.09 -1.64 0.00 0.00 178.16 177.23 2jow h ARG 58 N 0.70 1.03 -0.18 1.82 9.65 -1.05 0.15 114.38 126.50 2jow h ARG 58 Ca 0.31 -0.10 -0.07 0.00 -1.10 0.00 0.00 59.98 59.01 2jow h ARG 58 Cb 0.19 -0.21 -0.00 0.00 -1.39 0.00 0.00 29.97 28.56 2jow h ARG 58 CO -0.19 0.74 -0.15 -0.97 2.80 0.00 0.00 179.97 182.21 2jow h ASN 59 N 1.04 0.45 -0.63 -3.80 -1.24 -0.10 -2.94 115.58 108.36 2jow h ASN 59 Ca 0.27 -0.46 -0.02 0.00 0.71 0.00 0.00 56.30 56.80 2jow h ASN 59 Cb 0.00 -0.13 -0.03 0.00 0.73 0.00 0.00 38.32 38.89 2jow h ASN 59 CO -0.05 0.81 0.34 0.00 -1.29 0.00 0.00 177.43 177.25 2jow h ALA 60 N 0.65 1.37 0.00 1.57 0.00 -0.67 -1.84 119.26 120.34 2jow h ALA 60 Ca 0.03 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2jow h ALA 60 Cb 0.68 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.20 2jow h ALA 60 CO 0.04 0.50 0.00 0.94 0.00 0.00 0.00 179.25 180.73 2jow n GLN 61 N -4.36 0.92 -0.41 0.00 -0.06 0.52 -0.89 117.38 113.09 2jow n GLN 61 Ca 0.06 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.06 2jow n GLN 61 Cb 0.11 -1.04 0.00 0.00 -4.06 0.00 0.00 30.24 25.25 2jow n GLN 61 CO 0.00 0.00 0.00 0.45 -0.20 0.00 0.00 177.06 177.31 2jow n SER 62 N 0.59 0.00 0.00 1.69 2.88 -0.70 -4.79 113.62 113.29 2jow n SER 62 Ca 0.00 -1.60 0.00 0.00 -1.33 0.00 0.00 58.87 55.94 2jow n SER 62 Cb 0.46 -0.12 0.00 0.00 -0.75 0.00 0.00 64.21 63.80 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 0.52 -0.27 -3.46 2.85 -0.07 -4.77 115.26 110.07 2jow n ASN 63 Ca 0.00 0.00 0.11 0.00 -0.11 0.00 0.00 54.58 54.58 2jow n ASN 63 Cb 0.62 0.00 0.36 0.00 1.24 0.00 0.00 39.78 42.00 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 0.87 -0.53 -0.44 1.03 -1.45 -0.20 112.91 112.20 2jow h THR 64 Ca 0.00 -0.25 0.15 0.00 -0.01 0.00 0.00 66.41 66.30 2jow h THR 64 Cb 0.48 0.07 -0.02 0.00 -1.07 0.00 0.00 68.15 67.61 2jow h THR 64 CO 0.00 0.13 0.57 0.58 -0.01 0.00 0.00 175.52 176.79 2jow h VAL 65 N 0.74 0.32 -0.00 0.00 2.07 -1.86 0.21 116.25 117.72 2jow h VAL 65 Ca 0.43 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.95 2jow h VAL 65 Cb 0.62 0.55 0.00 0.00 -1.52 0.00 0.00 31.29 30.94 2jow h VAL 65 CO -0.19 0.00 0.00 0.29 0.02 0.00 0.00 177.57 177.69 2jow n LYS 66 N -3.66 2.63 -0.03 1.57 5.02 -0.14 -4.37 118.16 119.18 2jow n LYS 66 Ca 0.10 -1.73 -0.04 0.00 -2.02 0.00 0.00 58.31 54.62 2jow n LYS 66 Cb 0.77 -1.11 -0.05 0.00 -0.02 0.00 0.00 35.03 34.62 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 -0.70 0.47 0.13 -0.18 0.31 -0.15 -4.40 118.33 113.81 2jow n VAL 67 Ca 0.03 -0.28 0.17 0.00 -0.01 0.00 0.00 64.34 64.25 2jow n VAL 67 Cb 0.33 -0.82 0.73 0.00 -0.91 0.00 0.00 33.84 33.18 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 -0.68 3.52 0.04 -0.88 0.27 116.94 119.20 2jow h PHE 68 Ca -0.19 0.00 0.14 0.00 2.80 0.00 0.00 57.97 60.73 2jow h PHE 68 Cb 1.41 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 39.51 2jow h PHE 68 CO 0.00 0.00 0.46 -0.22 -0.60 0.00 0.00 178.31 177.96 2jow h LYS 69 N 0.00 0.31 0.02 1.51 3.11 -1.77 0.90 116.57 120.65 2jow h LYS 69 Ca 0.14 -0.02 -0.26 0.00 -2.81 0.00 0.00 60.65 57.70 2jow h LYS 69 Cb 0.62 -0.07 -0.04 0.00 -1.00 0.00 0.00 32.23 31.74 2jow h LYS 69 CO -0.00 0.20 -1.37 0.22 -2.81 0.00 0.00 179.45 175.70 2jow h ASP 70 N 0.32 0.05 -0.59 4.20 3.58 -0.72 -2.33 116.42 120.93 2jow h ASP 70 Ca 0.33 -0.07 -0.08 0.00 0.42 0.00 0.00 57.03 57.63 2jow h ASP 70 Cb 0.85 -0.02 -0.02 0.00 1.72 0.00 0.00 39.33 41.86 2jow h ASP 70 CO -0.09 1.06 0.05 0.40 -2.88 0.00 0.00 179.24 177.79 2jow h ILE 71 N 0.01 1.26 -0.58 2.25 5.03 -1.02 -2.80 117.51 121.66 2jow h ILE 71 Ca -0.16 -1.06 -0.04 0.00 -0.12 0.00 0.00 64.86 63.49 2jow h ILE 71 Cb 1.90 0.79 -0.03 0.00 -3.03 0.00 0.00 36.82 36.46 2jow h ILE 71 CO 0.11 0.39 0.21 -0.78 -0.68 0.00 0.00 178.15 177.40 2jow h ASP 72 N 0.90 0.79 0.21 1.72 3.58 -0.90 0.86 116.42 123.58 2jow h ASP 72 Ca 0.17 -0.11 0.00 0.00 0.42 0.00 0.00 57.03 57.51 2jow h ASP 72 Cb 0.48 -0.20 0.00 0.00 1.72 0.00 0.00 39.33 41.33 2jow h ASP 72 CO 0.02 0.72 0.00 0.00 -2.88 0.00 0.00 179.24 177.10 2jow n ALA 73 N -2.45 1.27 -0.10 -0.78 0.00 -0.88 -0.77 120.51 116.80 2jow n ALA 73 Ca 0.05 -0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.36 2jow n ALA 73 Cb 0.18 -1.12 -0.15 0.00 0.00 0.00 0.00 19.45 18.37 2jow n ALA 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jow n ALA 74 N -1.53 1.46 -0.17 0.00 0.00 -0.09 -4.26 120.51 115.92 2jow n ALA 74 Ca 0.01 -1.20 0.03 0.00 0.00 0.00 0.00 53.44 52.28 2jow n ALA 74 Cb 0.07 -0.24 0.31 0.00 0.00 0.00 0.00 19.45 19.59 2jow n ALA 74 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2jow h ILE 75 N 0.00 1.13 0.00 0.00 2.04 0.02 -0.45 117.51 120.25 2jow h ILE 75 Ca -0.53 -0.30 0.00 0.00 1.00 0.00 0.00 64.86 65.03 2jow h ILE 75 Cb 2.12 0.19 0.00 0.00 -0.74 0.00 0.00 36.82 38.39 2jow h ILE 75 CO 0.00 0.16 0.22 0.18 0.00 0.00 0.00 178.15 178.71 2jow n LEU 76 N -4.45 0.36 -0.06 1.44 7.99 0.05 -0.68 117.00 121.64 2jow n LEU 76 Ca 0.08 0.59 0.04 0.00 -0.01 0.00 0.00 56.01 56.71 2jow n LEU 76 Cb 0.09 -0.56 0.06 0.00 -0.11 0.00 0.00 43.42 42.90 2jow n LEU 76 CO 0.35 -0.71 0.50 -0.62 -1.51 0.00 0.00 177.39 175.40 2jow n GLU 77 N -2.03 1.85 0.00 3.23 -0.58 -0.20 -4.77 120.64 118.14 2jow n GLU 77 Ca -0.01 -1.89 0.00 0.00 -0.42 0.00 0.00 57.16 54.84 2jow n GLU 77 Cb 0.24 -1.16 0.00 0.00 -0.57 0.00 0.00 31.44 29.95 2jow n GLU 77 CO 0.00 0.00 0.00 1.58 -0.48 0.00 0.00 177.13 178.23 2jow n HIS 78 N -0.86 0.00 1.07 -0.32 -0.00 -0.00 -4.84 115.22 110.27 2jow n HIS 78 Ca 0.07 0.00 0.11 0.00 0.46 0.00 0.00 57.72 58.36 2jow n HIS 78 Cb 0.47 0.00 0.57 0.00 -0.12 0.00 0.00 29.99 30.91 2jow n HIS 78 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38 2jow n HIS 79 N -0.95 0.00 -4.30 1.57 -0.00 0.14 -4.85 115.22 106.83 2jow n HIS 79 Ca 0.00 0.00 -0.19 0.00 -0.00 0.00 0.00 57.72 57.53 2jow n HIS 79 Cb 0.14 -0.29 -0.13 0.00 -0.00 0.00 0.00 29.99 29.71 2jow n HIS 79 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 2jow s HIS 80 N -2.58 1.15 0.19 1.57 4.02 -1.26 -5.13 115.29 113.25 2jow s HIS 80 Ca 0.21 -0.37 -0.21 0.00 1.02 0.00 0.00 55.06 55.72 2jow s HIS 80 Cb 0.15 -0.68 0.05 0.00 -1.02 0.00 0.00 32.58 31.08 2jow s HIS 80 CO 0.35 0.03 0.58 -3.38 1.02 0.00 0.00 174.74 173.34 2jow s HIS 81 N -0.92 -0.34 -0.05 1.40 -3.43 -1.26 -5.04 115.29 105.66 2jow s HIS 81 Ca 0.00 0.04 -0.09 0.00 -0.80 0.00 0.00 55.06 54.21 2jow s HIS 81 Cb -0.08 0.52 0.02 0.00 -1.43 0.00 0.00 32.58 31.60 2jow s HIS 81 CO 0.01 -0.93 0.21 -1.58 -2.00 0.00 0.00 174.74 170.46 2jow s HIS 82 N -3.82 -0.16 0.00 0.38 5.04 -1.26 -5.27 115.29 110.21 2jow s HIS 82 Ca 0.05 0.35 0.00 0.00 -1.54 0.00 0.00 55.06 53.92 2jow s HIS 82 Cb -0.02 0.05 0.00 0.00 0.04 0.00 0.00 32.58 32.65 2jow s HIS 82 CO -0.07 -0.21 0.00 0.72 -2.34 0.00 0.00 174.74 172.85