#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 -0.36 0.53 3.17 0.00 -1.26 -5.16 121.76 118.69 2jow s ALA 2 Ca 0.00 -0.52 -0.18 0.00 0.00 0.00 0.00 51.96 51.26 2jow s ALA 2 Cb 0.00 0.55 -0.07 0.00 0.00 0.00 0.00 23.12 23.61 2jow s ALA 2 CO 0.00 -0.55 1.03 0.95 0.00 0.00 0.00 175.76 177.19 2jow s THR 3 N -3.86 4.00 0.59 0.00 -4.23 -1.26 -4.96 115.64 105.93 2jow s THR 3 Ca 0.05 1.06 0.41 0.00 -1.18 0.00 0.00 61.69 62.04 2jow s THR 3 Cb 0.04 -3.49 0.42 0.00 1.34 0.00 0.00 72.50 70.81 2jow s THR 3 CO -0.10 -0.45 2.31 -0.65 -0.54 0.00 0.00 174.62 175.19 2jow h PRO 4 N 1.00 0.00 -3.44 3.99 0.11 -2.09 -3.40 132.00 128.17 2jow h PRO 4 Ca -0.48 0.00 -0.28 0.00 0.11 0.00 0.00 66.00 65.35 2jow h PRO 4 Cb 1.21 0.00 -0.33 0.00 0.11 0.00 0.00 31.00 31.99 2jow h PRO 4 CO 0.59 0.01 -0.69 -1.58 -0.21 0.00 0.00 178.00 176.12 2jow s TRP 5 N -4.17 -0.03 0.00 0.65 0.51 -1.26 -5.01 118.94 109.63 2jow s TRP 5 Ca -0.04 0.24 0.00 0.00 -2.12 0.00 0.00 56.10 54.17 2jow s TRP 5 Cb 0.13 -0.19 0.00 0.00 -0.81 0.00 0.00 33.47 32.60 2jow s TRP 5 CO 0.45 -0.11 0.00 0.45 -0.51 0.00 0.00 176.95 177.23 2jow n SER 6 N 4.17 0.00 -1.53 2.95 2.88 -1.26 -4.83 113.62 116.00 2jow n SER 6 Ca -0.27 0.00 -0.06 0.00 -1.33 0.00 0.00 58.87 57.20 2jow n SER 6 Cb 0.51 0.00 0.23 0.00 -0.75 0.00 0.00 64.21 64.20 2jow n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2jow n GLY 7 N -0.25 4.37 2.05 0.46 0.00 -1.26 -4.28 105.19 106.28 2jow n GLY 7 Ca 0.00 -1.11 0.00 0.00 0.00 0.00 0.00 46.02 44.91 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 -0.79 -2.54 0.00 1.61 9.36 -1.26 -4.90 117.16 118.63 2jow n TYR 8 Ca 0.38 0.59 0.11 0.00 3.32 0.00 0.00 57.90 62.30 2jow n TYR 8 Cb 1.23 1.34 0.53 0.00 -0.63 0.00 0.00 39.34 41.81 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 0.28 0.00 2.98 7.12 -1.88 -3.09 115.31 120.73 2jow h LEU 9 Ca 0.00 0.00 0.00 0.00 0.13 0.00 0.00 57.88 58.01 2jow h LEU 9 Cb 0.00 -0.06 0.00 0.00 -0.53 0.00 0.00 40.66 40.07 2jow h LEU 9 CO 0.00 0.18 0.00 -0.67 -0.13 0.00 0.00 178.44 177.82 2jow n ASP 10 N -4.47 0.00 0.00 1.25 2.03 -1.26 -0.85 116.55 113.25 2jow n ASP 10 Ca 0.06 -0.51 0.00 0.00 0.52 0.00 0.00 54.79 54.87 2jow n ASP 10 Cb 0.29 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.69 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 -0.84 1.02 -0.06 1.67 2.03 -1.17 -4.27 116.55 114.93 2jow n ASP 11 Ca 0.06 -1.17 -0.12 0.00 0.52 0.00 0.00 54.79 54.08 2jow n ASP 11 Cb 0.03 0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 40.39 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 -0.09 0.62 -0.01 5.18 0.31 -0.16 -4.05 118.33 120.13 2jow n VAL 12 Ca 0.00 -0.16 -0.16 0.00 -0.01 0.00 0.00 64.34 64.01 2jow n VAL 12 Cb 0.09 -1.61 -0.05 0.00 -0.91 0.00 0.00 33.84 31.36 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 -0.38 0.88 0.53 4.52 0.87 -1.31 -3.27 113.55 115.39 2jow h SER 13 Ca -0.29 -0.57 -0.07 0.00 -1.23 0.00 0.00 61.79 59.64 2jow h SER 13 Cb 1.26 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 62.95 2jow h SER 13 CO -0.17 1.36 -0.32 0.00 -0.53 0.00 0.00 176.83 177.17 2jow h ALA 14 N 0.62 1.23 -0.56 6.23 0.00 -1.74 0.07 119.26 125.11 2jow h ALA 14 Ca -0.05 -0.29 0.07 0.00 0.00 0.00 0.00 54.91 54.65 2jow h ALA 14 Cb 1.38 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 19.05 2jow h ALA 14 CO 0.15 0.40 0.22 -0.22 0.00 0.00 0.00 179.25 179.81 2jow h LYS 15 N 0.00 0.41 0.09 0.00 3.64 -1.70 -1.51 116.57 117.50 2jow h LYS 15 Ca -0.00 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.35 2jow h LYS 15 Cb 0.67 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.40 2jow h LYS 15 CO 0.04 0.27 -0.04 0.35 -2.27 0.00 0.00 179.45 177.80 2jow h PHE 16 N 0.42 -0.11 0.00 1.91 3.57 -1.45 -3.12 116.94 118.17 2jow h PHE 16 Ca 0.27 -0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.76 2jow h PHE 16 Cb 0.28 0.04 -0.00 0.00 2.79 0.00 0.00 35.95 39.06 2jow h PHE 16 CO -0.15 0.08 -0.02 0.22 -2.23 0.00 0.00 178.31 176.22 2jow h ASP 17 N -0.28 0.00 0.31 0.41 3.58 -0.22 0.86 116.42 121.08 2jow h ASP 17 Ca -0.01 0.00 -0.23 0.00 0.42 0.00 0.00 57.03 57.20 2jow h ASP 17 Cb 0.24 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 41.25 2jow h ASP 17 CO 0.02 0.02 -1.90 1.07 -2.88 0.00 0.00 179.24 175.57 2jow n THR 18 N -3.81 1.15 0.14 2.25 5.66 -0.64 -3.59 114.28 115.44 2jow n THR 18 Ca -0.03 -0.74 -0.25 0.00 -3.05 0.00 0.00 64.05 59.99 2jow n THR 18 Cb 0.11 -0.58 -0.16 0.00 -1.55 0.00 0.00 70.33 68.15 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 3.83 0.62 0.67 1.09 0.00 -1.31 -3.15 103.07 104.82 2jow h GLY 19 Ca -0.30 -1.56 0.10 0.00 0.00 0.00 0.00 47.33 45.57 2jow h GLY 19 CO 0.04 1.37 0.59 -0.24 0.00 0.00 0.00 176.54 178.30 2jow h VAL 20 N 0.12 0.96 0.00 4.60 3.04 -1.06 -1.93 116.25 121.98 2jow h VAL 20 Ca -0.25 -0.31 -0.02 0.00 -1.01 0.00 0.00 66.70 65.10 2jow h VAL 20 Cb 2.14 -0.03 -0.00 0.00 -2.01 0.00 0.00 31.29 31.38 2jow h VAL 20 CO 0.27 0.17 -0.11 -0.78 -1.01 0.00 0.00 177.57 176.11 2jow h ASP 21 N 0.92 0.00 0.63 3.17 3.58 -1.61 0.38 116.42 123.49 2jow h ASP 21 Ca 0.43 0.00 -0.08 0.00 0.42 0.00 0.00 57.03 57.80 2jow h ASP 21 Cb 0.42 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.46 2jow h ASP 21 CO -0.19 0.11 -0.40 0.78 -2.88 0.00 0.00 179.24 176.66 2jow h ASN 22 N 0.00 0.00 0.13 2.28 -0.26 -1.31 0.16 115.58 116.58 2jow h ASN 22 Ca -0.00 0.00 -0.19 0.00 -0.56 0.00 0.00 56.30 55.55 2jow h ASN 22 Cb 0.46 0.00 0.02 0.00 -1.06 0.00 0.00 38.32 37.74 2jow h ASN 22 CO 0.01 0.40 -0.84 0.25 -1.06 0.00 0.00 177.43 176.20 2jow h LEU 23 N 0.00 0.43 -0.46 1.61 7.12 -1.17 -3.29 115.31 119.55 2jow h LEU 23 Ca -0.00 -0.94 0.05 0.00 0.13 0.00 0.00 57.88 57.11 2jow h LEU 23 Cb 0.82 -0.14 -0.04 0.00 -0.53 0.00 0.00 40.66 40.77 2jow h LEU 23 CO 0.05 1.40 0.21 -0.61 -0.13 0.00 0.00 178.44 179.35 2jow h GLN 24 N -0.41 0.40 -0.48 1.25 5.75 -0.24 0.11 115.11 121.50 2jow h GLN 24 Ca -0.15 -0.02 0.04 0.00 -0.15 0.00 0.00 58.65 58.36 2jow h GLN 24 Cb 1.61 -0.09 -0.04 0.00 1.07 0.00 0.00 27.48 30.04 2jow h GLN 24 CO 0.13 0.26 0.24 0.00 -2.65 0.00 0.00 178.83 176.82 2jow h THR 25 N 0.41 0.97 0.04 2.39 1.03 -0.86 0.24 112.91 117.15 2jow h THR 25 Ca 0.21 -0.17 0.01 0.00 -0.01 0.00 0.00 66.41 66.45 2jow h THR 25 Cb 0.15 0.45 -0.01 0.00 -1.07 0.00 0.00 68.15 67.67 2jow h THR 25 CO -0.17 0.09 -0.07 1.56 -0.01 0.00 0.00 175.52 176.92 2jow h GLN 26 N 0.48 -0.14 -0.62 0.00 4.20 -1.47 0.67 115.11 118.23 2jow h GLN 26 Ca 0.21 0.01 -0.06 0.00 0.06 0.00 0.00 58.65 58.86 2jow h GLN 26 Cb 0.10 0.03 -0.03 0.00 0.30 0.00 0.00 27.48 27.89 2jow h GLN 26 CO -0.14 -0.09 0.14 -0.39 -0.67 0.00 0.00 178.83 177.68 2jow h VAL 27 N -0.15 1.25 0.00 -0.54 -1.51 -0.49 -2.11 116.25 112.70 2jow h VAL 27 Ca 0.01 -0.92 -0.07 0.00 -1.23 0.00 0.00 66.70 64.50 2jow h VAL 27 Cb 0.16 0.62 -0.01 0.00 -2.13 0.00 0.00 31.29 29.93 2jow h VAL 27 CO -0.04 0.35 -0.32 0.74 -1.23 0.00 0.00 177.57 177.06 2jow h THR 28 N 0.94 0.99 0.00 7.19 2.02 -0.24 0.71 112.91 124.52 2jow h THR 28 Ca 0.20 -1.21 -0.20 0.00 0.77 0.00 0.00 66.41 65.97 2jow h THR 28 Cb 0.35 1.70 -0.03 0.00 -1.74 0.00 0.00 68.15 68.43 2jow h THR 28 CO 0.00 0.31 -0.95 -0.33 0.37 0.00 0.00 175.52 174.93 2jow h GLU 29 N 0.00 0.01 -0.75 6.66 5.08 -0.46 0.57 114.58 125.69 2jow h GLU 29 Ca -0.00 -0.01 -0.06 0.00 -1.00 0.00 0.00 59.36 58.28 2jow h GLU 29 Cb 0.67 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.90 2jow h GLU 29 CO 0.04 0.95 0.24 0.00 -1.00 0.00 0.00 179.01 179.24 2jow h ALA 30 N 1.04 0.98 -0.01 3.43 0.00 -0.88 -2.50 119.26 121.33 2jow h ALA 30 Ca -0.01 -0.23 -0.08 0.00 0.00 0.00 0.00 54.91 54.59 2jow h ALA 30 Cb 1.67 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 19.16 2jow h ALA 30 CO 0.12 0.66 -0.35 1.25 0.00 0.00 0.00 179.25 180.93 2jow h LEU 31 N 1.11 0.03 -1.83 0.00 5.85 -0.74 -0.68 115.31 119.05 2jow h LEU 31 Ca 0.24 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.97 2jow h LEU 31 Cb 0.30 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 2jow h LEU 31 CO -0.01 0.38 0.14 -0.78 -0.34 0.00 0.00 178.44 177.83 2jow h ASP 32 N 0.02 0.20 -0.00 1.25 3.58 0.61 0.52 116.42 122.60 2jow h ASP 32 Ca 0.00 -0.00 -0.16 0.00 0.42 0.00 0.00 57.03 57.29 2jow h ASP 32 Cb 0.64 -0.05 0.01 0.00 1.72 0.00 0.00 39.33 41.65 2jow h ASP 32 CO 0.05 0.14 -0.62 0.11 -2.88 0.00 0.00 179.24 176.04 2jow h LYS 33 N 0.24 0.42 0.00 0.28 1.79 -1.24 -3.21 116.57 114.85 2jow h LYS 33 Ca 0.08 -0.45 0.00 0.00 -2.18 0.00 0.00 60.65 58.10 2jow h LYS 33 Cb 0.05 0.13 0.00 0.00 -1.58 0.00 0.00 32.23 30.83 2jow h LYS 33 CO -0.02 1.11 0.00 1.25 -1.08 0.00 0.00 179.45 180.71 2jow h LEU 34 N -0.08 0.00 0.00 2.94 6.46 0.38 0.11 115.31 125.12 2jow h LEU 34 Ca -0.08 0.00 -0.00 0.00 -0.12 0.00 0.00 57.88 57.68 2jow h LEU 34 Cb 1.33 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 41.26 2jow h LEU 34 CO 0.12 0.00 -0.07 0.00 -0.62 0.00 0.00 178.44 177.88 2jow h ALA 35 N 2.02 0.97 0.00 1.25 0.00 -0.16 -2.82 119.26 120.52 2jow h ALA 35 Ca 0.00 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 2jow h ALA 35 Cb 0.67 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 2jow h ALA 35 CO 0.00 0.02 -0.27 0.00 0.00 0.00 0.00 179.25 178.99 2jow h ALA 36 N 1.99 0.05 -0.83 0.00 0.00 -1.03 -3.44 119.26 116.00 2jow h ALA 36 Ca -0.00 -0.49 -0.33 0.00 0.00 0.00 0.00 54.91 54.09 2jow h ALA 36 Cb 1.01 0.18 -0.38 0.00 0.00 0.00 0.00 17.79 18.60 2jow h ALA 36 CO 0.00 0.17 -1.13 1.17 0.00 0.00 0.00 179.25 179.47 2jow n LYS 37 N -4.62 1.25 0.00 0.00 4.81 -0.45 -5.11 118.16 114.04 2jow n LYS 37 Ca -0.11 -3.19 0.00 0.00 -0.87 0.00 0.00 58.31 54.14 2jow n LYS 37 Cb 0.37 -1.22 0.00 0.00 0.02 0.00 0.00 35.03 34.20 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 -0.21 0.00 0.00 1.64 -0.01 -1.06 -1.80 135.00 133.56 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 1.71 -4.56 2.55 3.41 -1.26 -4.14 113.62 111.34 2jow n SER 39 Ca 0.00 -1.51 -0.27 0.00 -0.26 0.00 0.00 58.87 56.83 2jow n SER 39 Cb 0.00 -0.38 -0.05 0.00 -0.26 0.00 0.00 64.21 63.52 2jow n SER 39 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2jow s ASP 40 N 0.55 4.84 0.00 4.04 -1.08 -0.75 -4.83 116.67 119.44 2jow s ASP 40 Ca 0.00 -0.18 0.11 0.00 -0.52 0.00 0.00 52.55 51.96 2jow s ASP 40 Cb 0.00 -2.55 0.55 0.00 -1.46 0.00 0.00 42.92 39.46 2jow s ASP 40 CO 0.00 -2.92 1.22 -0.81 0.52 0.00 0.00 175.17 173.18 2jow n PRO 41 N 8.93 0.17 -0.06 4.34 -0.04 -1.26 -0.54 135.00 146.53 2jow n PRO 41 Ca 0.37 0.17 -0.11 0.00 -0.04 0.00 0.00 63.50 63.89 2jow n PRO 41 Cb 0.48 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.33 2jow n PRO 41 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2jow h ALA 42 N 2.52 -0.00 -0.44 0.55 0.00 -1.92 0.15 119.26 120.12 2jow h ALA 42 Ca 0.00 -0.40 -0.11 0.00 0.00 0.00 0.00 54.91 54.39 2jow h ALA 42 Cb 0.09 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 2jow h ALA 42 CO 0.00 -0.01 -0.17 1.37 0.00 0.00 0.00 179.25 180.44 2jow h LEU 43 N -0.99 0.91 -0.38 0.00 8.10 -1.82 -3.01 115.31 118.12 2jow h LEU 43 Ca -0.00 -0.39 0.00 0.00 0.11 0.00 0.00 57.88 57.60 2jow h LEU 43 Cb 0.81 -0.25 -0.02 0.00 -0.44 0.00 0.00 40.66 40.76 2jow h LEU 43 CO 0.00 1.09 0.25 0.25 -4.11 0.00 0.00 178.44 175.92 2jow h LEU 44 N 0.73 0.45 -0.36 0.17 6.46 -0.94 -2.57 115.31 119.24 2jow h LEU 44 Ca 0.10 -0.02 0.00 0.00 -0.12 0.00 0.00 57.88 57.84 2jow h LEU 44 Cb 0.73 -0.11 0.00 0.00 -0.73 0.00 0.00 40.66 40.55 2jow h LEU 44 CO 0.06 0.33 0.00 0.00 -0.62 0.00 0.00 178.44 178.21 2jow h ALA 45 N 1.13 1.00 -0.52 1.25 0.00 -0.63 0.26 119.26 121.75 2jow h ALA 45 Ca 0.14 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 2jow h ALA 45 Cb -0.04 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 2jow h ALA 45 CO -0.03 0.00 0.18 0.00 0.00 0.00 0.00 179.25 179.41 2jow h ALA 46 N 2.10 1.34 0.34 0.00 0.00 -1.38 0.39 119.26 122.06 2jow h ALA 46 Ca 0.00 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 2jow h ALA 46 Cb 0.81 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.39 2jow h ALA 46 CO 0.00 0.48 -0.16 -0.92 0.00 0.00 0.00 179.25 178.65 2jow h TYR 47 N 0.75 -0.43 -0.30 0.00 3.20 -0.25 0.29 116.97 120.23 2jow h TYR 47 Ca 0.18 -0.01 0.09 0.00 3.14 0.00 0.00 58.73 62.12 2jow h TYR 47 Cb 0.19 0.14 -0.01 0.00 1.54 0.00 0.00 36.73 38.59 2jow h TYR 47 CO 0.01 -0.13 0.31 1.96 -1.64 0.00 0.00 178.16 178.67 2jow h GLN 48 N -0.69 0.00 0.05 1.82 1.08 -0.35 0.20 115.11 117.22 2jow h GLN 48 Ca -0.05 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.15 2jow h GLN 48 Cb 0.48 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.91 2jow h GLN 48 CO 0.08 0.00 -0.02 0.77 -0.95 0.00 0.00 178.83 178.70 2jow h SER 49 N 0.00 -0.06 -0.35 1.46 0.02 -0.14 -3.25 113.55 111.24 2jow h SER 49 Ca 0.14 -0.51 -0.04 0.00 -0.84 0.00 0.00 61.79 60.54 2jow h SER 49 Cb 0.76 0.01 -0.02 0.00 0.14 0.00 0.00 62.40 63.29 2jow h SER 49 CO -0.00 0.66 0.09 0.11 -1.14 0.00 0.00 176.83 176.55 2jow h LYS 50 N -0.95 0.64 -0.83 3.45 1.79 0.55 0.20 116.57 121.42 2jow h LYS 50 Ca -0.01 -0.12 0.14 0.00 -2.18 0.00 0.00 60.65 58.48 2jow h LYS 50 Cb 0.57 -0.10 -0.09 0.00 -1.58 0.00 0.00 32.23 31.02 2jow h LYS 50 CO 0.01 0.60 0.42 1.25 -1.08 0.00 0.00 179.45 180.65 2jow h LEU 51 N 0.62 0.51 0.06 2.94 6.46 -0.85 0.20 115.31 125.26 2jow h LEU 51 Ca 0.14 0.09 -0.23 0.00 -0.12 0.00 0.00 57.88 57.76 2jow h LEU 51 Cb 0.26 0.01 0.02 0.00 -0.73 0.00 0.00 40.66 40.22 2jow h LEU 51 CO -0.00 0.23 -0.94 0.28 -0.62 0.00 0.00 178.44 177.39 2jow h SER 52 N 0.62 0.72 -0.23 1.25 0.02 -1.24 -3.19 113.55 111.50 2jow h SER 52 Ca 0.45 -0.80 0.02 0.00 -0.84 0.00 0.00 61.79 60.61 2jow h SER 52 Cb 0.61 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.92 2jow h SER 52 CO -0.35 1.44 0.16 -0.33 -1.14 0.00 0.00 176.83 176.61 2jow h GLU 53 N 0.09 0.23 -0.31 3.45 4.39 -0.03 0.18 114.58 122.57 2jow h GLU 53 Ca -0.13 -0.01 -0.14 0.00 0.34 0.00 0.00 59.36 59.41 2jow h GLU 53 Cb 1.64 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 30.23 2jow h GLU 53 CO 0.18 0.15 -0.38 -0.92 -1.16 0.00 0.00 179.01 176.88 2jow h TYR 54 N 0.23 0.87 0.00 4.33 3.20 -0.70 0.29 116.97 125.19 2jow h TYR 54 Ca 0.09 -0.25 -0.07 0.00 3.14 0.00 0.00 58.73 61.64 2jow h TYR 54 Cb 0.09 -0.19 -0.01 0.00 1.54 0.00 0.00 36.73 38.17 2jow h TYR 54 CO -0.00 1.00 -0.33 -0.97 -1.64 0.00 0.00 178.16 176.22 2jow h ASN 55 N 0.60 0.00 0.13 -2.11 -1.24 -1.21 -1.51 115.58 110.24 2jow h ASN 55 Ca 0.05 0.00 -0.17 0.00 0.71 0.00 0.00 56.30 56.90 2jow h ASN 55 Cb 0.92 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.97 2jow h ASN 55 CO 0.08 0.33 -0.61 -0.07 -1.29 0.00 0.00 177.43 175.87 2jow h LEU 56 N 0.00 0.54 -0.63 0.34 4.07 -0.52 0.67 115.31 119.78 2jow h LEU 56 Ca -0.00 -0.31 0.06 0.00 0.08 0.00 0.00 57.88 57.71 2jow h LEU 56 Cb 0.72 -0.16 -0.05 0.00 1.08 0.00 0.00 40.66 42.25 2jow h LEU 56 CO 0.04 1.02 0.34 0.22 -1.08 0.00 0.00 178.44 178.98 2jow h TYR 57 N 0.36 0.62 -0.73 1.13 5.03 -0.03 0.17 116.97 123.51 2jow h TYR 57 Ca -0.01 0.02 0.02 0.00 2.58 0.00 0.00 58.73 61.35 2jow h TYR 57 Cb 1.15 -0.18 -0.04 0.00 1.55 0.00 0.00 36.73 39.21 2jow h TYR 57 CO 0.04 0.29 0.47 -0.09 -1.32 0.00 0.00 178.16 177.55 2jow h ARG 58 N 0.63 0.91 -0.26 1.82 9.65 -1.06 0.62 114.38 126.69 2jow h ARG 58 Ca 0.29 -0.05 -0.04 0.00 -1.10 0.00 0.00 59.98 59.07 2jow h ARG 58 Cb 0.19 -0.20 -0.01 0.00 -1.39 0.00 0.00 29.97 28.56 2jow h ARG 58 CO -0.19 0.60 0.01 -0.97 2.80 0.00 0.00 179.97 182.22 2jow h ASN 59 N 0.93 0.44 -0.86 -3.80 -1.24 -0.31 -2.93 115.58 107.81 2jow h ASN 59 Ca 0.28 -0.30 -0.01 0.00 0.71 0.00 0.00 56.30 56.98 2jow h ASN 59 Cb -0.04 -0.12 -0.04 0.00 0.73 0.00 0.00 38.32 38.85 2jow h ASN 59 CO -0.09 0.62 0.48 0.00 -1.29 0.00 0.00 177.43 177.16 2jow h ALA 60 N 0.83 1.23 0.00 1.57 0.00 -0.47 -1.42 119.26 120.99 2jow h ALA 60 Ca 0.07 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2jow h ALA 60 Cb 0.40 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.84 2jow h ALA 60 CO 0.01 0.63 0.00 0.94 0.00 0.00 0.00 179.25 180.83 2jow n GLN 61 N -4.34 0.78 -0.11 0.00 -0.06 0.19 -0.77 117.38 113.07 2jow n GLN 61 Ca 0.09 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.09 2jow n GLN 61 Cb 0.09 -1.28 0.00 0.00 -4.06 0.00 0.00 30.24 24.99 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 0.31 0.00 0.00 1.69 2.88 -0.56 -4.78 113.62 113.16 2jow n SER 62 Ca 0.00 -1.21 0.00 0.00 -1.33 0.00 0.00 58.87 56.33 2jow n SER 62 Cb 0.27 -0.04 0.00 0.00 -0.75 0.00 0.00 64.21 63.69 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 0.33 -0.31 -3.46 2.85 -0.15 -4.61 115.26 109.91 2jow n ASN 63 Ca 0.00 0.00 0.12 0.00 -0.11 0.00 0.00 54.58 54.59 2jow n ASN 63 Cb 0.54 0.00 0.30 0.00 1.24 0.00 0.00 39.78 41.86 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 0.56 -0.28 -0.44 1.03 -1.25 0.15 112.91 112.68 2jow h THR 64 Ca 0.00 -0.18 0.08 0.00 -0.01 0.00 0.00 66.41 66.31 2jow h THR 64 Cb 0.90 0.01 -0.01 0.00 -1.07 0.00 0.00 68.15 67.97 2jow h THR 64 CO 0.00 0.09 0.32 0.58 -0.01 0.00 0.00 175.52 176.51 2jow h VAL 65 N 0.51 0.40 -0.01 0.00 2.07 -1.84 0.28 116.25 117.67 2jow h VAL 65 Ca 0.55 0.00 0.00 0.00 0.82 0.00 0.00 66.70 68.07 2jow h VAL 65 Cb 0.98 0.74 0.00 0.00 -1.52 0.00 0.00 31.29 31.49 2jow h VAL 65 CO -0.47 0.00 0.00 0.29 0.02 0.00 0.00 177.57 177.41 2jow n LYS 66 N -3.71 2.65 -0.04 1.57 4.01 0.35 -4.48 118.16 118.52 2jow n LYS 66 Ca 0.04 -1.73 -0.03 0.00 -0.51 0.00 0.00 58.31 56.08 2jow n LYS 66 Cb 0.47 -1.11 -0.08 0.00 -0.51 0.00 0.00 35.03 33.80 2jow n LYS 66 CO 0.00 0.00 0.00 0.28 -1.11 0.00 0.00 177.40 176.57 2jow n VAL 67 N -0.67 0.55 -0.38 -0.18 0.31 -0.25 -3.98 118.33 113.73 2jow n VAL 67 Ca 0.04 -0.39 0.00 0.00 -0.01 0.00 0.00 64.34 63.97 2jow n VAL 67 Cb 0.33 -0.53 0.00 0.00 -0.91 0.00 0.00 33.84 32.73 2jow n VAL 67 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 2jow n PHE 68 N -2.27 0.00 0.00 3.52 3.72 -0.07 -0.44 117.46 121.91 2jow n PHE 68 Ca -0.14 -0.92 0.00 0.00 -0.05 0.00 0.00 57.45 56.35 2jow n PHE 68 Cb 0.72 -0.47 0.00 0.00 -0.94 0.00 0.00 39.48 38.79 2jow n PHE 68 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 2jow n LYS 69 N 1.46 0.00 0.22 -1.08 0.00 -1.26 -4.73 118.16 112.77 2jow n LYS 69 Ca 0.00 0.00 0.07 0.00 0.00 0.00 0.00 58.31 58.38 2jow n LYS 69 Cb 0.47 -0.02 0.49 0.00 0.00 0.00 0.00 35.03 35.97 2jow n LYS 69 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.40 177.62 2jow h ASP 70 N 0.00 0.00 -0.66 3.14 3.58 -1.30 -1.61 116.42 119.57 2jow h ASP 70 Ca 0.00 0.00 0.02 0.00 0.42 0.00 0.00 57.03 57.47 2jow h ASP 70 Cb 0.00 0.00 -0.04 0.00 1.72 0.00 0.00 39.33 41.01 2jow h ASP 70 CO 0.00 0.27 0.43 -0.29 -2.88 0.00 0.00 179.24 176.77 2jow h ILE 71 N 0.00 1.13 -0.12 2.25 -0.00 -1.05 -0.16 117.51 119.57 2jow h ILE 71 Ca -0.00 -0.29 -0.16 0.00 -0.00 0.00 0.00 64.86 64.40 2jow h ILE 71 Cb 0.58 0.20 -0.01 0.00 -0.00 0.00 0.00 36.82 37.59 2jow h ILE 71 CO 0.03 0.16 -0.62 -0.78 -0.00 0.00 0.00 178.15 176.94 2jow h ASP 72 N 0.86 0.48 -0.05 2.19 3.58 -1.68 -0.29 116.42 121.51 2jow h ASP 72 Ca 0.25 -0.28 -0.02 0.00 0.42 0.00 0.00 57.03 57.40 2jow h ASP 72 Cb -0.05 -0.14 -0.01 0.00 1.72 0.00 0.00 39.33 40.85 2jow h ASP 72 CO -0.08 0.98 -0.01 0.00 -2.88 0.00 0.00 179.24 177.26 2jow h ALA 73 N 1.02 1.75 -0.24 -0.78 0.00 -1.06 0.32 119.26 120.27 2jow h ALA 73 Ca -0.01 -0.09 -0.18 0.00 0.00 0.00 0.00 54.91 54.63 2jow h ALA 73 Cb 1.17 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.89 2jow h ALA 73 CO 0.11 0.19 -0.57 0.00 0.00 0.00 0.00 179.25 178.98 2jow h ALA 74 N 1.82 0.54 -0.76 0.00 0.00 -0.40 -2.02 119.26 118.44 2jow h ALA 74 Ca 0.04 -0.52 0.04 0.00 0.00 0.00 0.00 54.91 54.47 2jow h ALA 74 Cb 0.15 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.81 2jow h ALA 74 CO 0.00 0.69 0.47 0.82 0.00 0.00 0.00 179.25 181.23 2jow h ILE 75 N 0.57 1.08 -0.01 0.00 2.04 -0.31 0.74 117.51 121.62 2jow h ILE 75 Ca 0.01 -0.31 0.03 0.00 1.00 0.00 0.00 64.86 65.58 2jow h ILE 75 Cb 1.16 0.10 -0.04 0.00 -0.74 0.00 0.00 36.82 37.30 2jow h ILE 75 CO 0.12 0.17 -0.19 -0.07 0.00 0.00 0.00 178.15 178.17 2jow h LEU 76 N 0.91 -0.56 -1.84 1.44 4.07 -0.93 -2.71 115.31 115.68 2jow h LEU 76 Ca 0.31 0.08 -0.01 0.00 0.08 0.00 0.00 57.88 58.35 2jow h LEU 76 Cb 0.05 0.24 -0.00 0.00 1.08 0.00 0.00 40.66 42.03 2jow h LEU 76 CO -0.13 -0.26 -0.03 -0.33 -1.08 0.00 0.00 178.44 176.62 2jow h GLU 77 N -0.30 0.00 0.00 1.13 4.39 -0.93 -3.16 114.58 115.70 2jow h GLU 77 Ca 0.06 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.76 2jow h GLU 77 Cb 0.38 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.03 2jow h GLU 77 CO -0.19 0.03 0.00 1.58 -1.16 0.00 0.00 179.01 179.27 2jow n HIS 78 N -3.17 0.00 -1.68 4.33 -0.00 0.21 -4.82 115.22 110.09 2jow n HIS 78 Ca -0.01 0.00 -0.44 0.00 0.46 0.00 0.00 57.72 57.73 2jow n HIS 78 Cb 0.25 -0.06 -0.03 0.00 -0.12 0.00 0.00 29.99 30.04 2jow n HIS 78 CO 0.00 0.00 0.00 -2.39 0.46 0.00 0.00 176.34 174.41 2jow n HIS 79 N -1.06 2.32 -3.84 1.57 1.44 -1.20 -5.01 115.22 109.44 2jow n HIS 79 Ca 0.11 0.35 -0.10 0.00 -2.01 0.00 0.00 57.72 56.08 2jow n HIS 79 Cb 0.07 -2.51 -0.06 0.00 0.12 0.00 0.00 29.99 27.61 2jow n HIS 79 CO 0.00 0.00 0.00 -1.01 -2.81 0.00 0.00 176.34 172.52 2jow s HIS 80 N 0.21 0.14 0.45 -1.40 3.76 -1.26 -5.05 115.29 112.14 2jow s HIS 80 Ca 0.70 -0.51 0.13 0.00 -0.15 0.00 0.00 55.06 55.24 2jow s HIS 80 Cb -0.63 0.10 1.02 0.00 1.11 0.00 0.00 32.58 34.18 2jow s HIS 80 CO 0.46 -0.73 2.03 1.25 -0.85 0.00 0.00 174.74 176.90 2jow h HIS 81 N 2.47 0.11 -2.90 1.40 2.76 -2.03 -3.43 115.15 113.53 2jow h HIS 81 Ca -0.32 -0.00 -0.14 0.00 -2.20 0.00 0.00 60.37 57.71 2jow h HIS 81 Cb 1.24 -0.03 -0.25 0.00 1.55 0.00 0.00 27.41 29.91 2jow h HIS 81 CO 0.38 0.18 -0.32 -1.58 -1.30 0.00 0.00 177.93 175.29 2jow s HIS 82 N -4.88 -0.39 -2.00 5.26 5.65 -1.26 -5.37 115.29 112.30 2jow s HIS 82 Ca -0.05 0.93 0.10 0.00 0.25 0.00 0.00 55.06 56.29 2jow s HIS 82 Cb 0.16 0.13 0.59 0.00 -1.18 0.00 0.00 32.58 32.29 2jow s HIS 82 CO 0.70 -0.19 1.03 -2.39 -0.65 0.00 0.00 174.74 173.24