#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 -1.46 0.68 3.17 0.00 -1.26 -5.13 121.76 117.77 2jow s ALA 2 Ca 0.00 0.27 -0.09 0.00 0.00 0.00 0.00 51.96 52.14 2jow s ALA 2 Cb 0.00 0.87 0.03 0.00 0.00 0.00 0.00 23.12 24.02 2jow s ALA 2 CO 0.00 -0.82 1.03 0.95 0.00 0.00 0.00 175.76 176.92 2jow s THR 3 N -3.79 3.04 -1.11 0.00 -4.23 -1.26 -4.95 115.64 103.34 2jow s THR 3 Ca 0.04 0.09 0.00 0.00 -1.18 0.00 0.00 61.69 60.63 2jow s THR 3 Cb -0.02 -3.29 0.00 0.00 1.34 0.00 0.00 72.50 70.53 2jow s THR 3 CO -0.08 -0.34 0.45 -2.65 -0.54 0.00 0.00 174.62 171.46 2jow n PRO 4 N -2.90 0.00 0.30 3.99 -0.02 -1.26 -2.68 135.00 132.42 2jow n PRO 4 Ca 0.07 0.09 0.19 0.00 -2.02 0.00 0.00 63.50 61.82 2jow n PRO 4 Cb 0.59 -1.55 0.98 0.00 -0.02 0.00 0.00 33.50 33.50 2jow n PRO 4 CO 0.00 0.00 0.00 0.11 1.98 0.00 0.00 175.50 177.59 2jow h TRP 5 N 0.00 0.00 -0.08 6.00 5.08 -1.97 -1.82 115.95 123.15 2jow h TRP 5 Ca 0.00 0.00 0.02 0.00 1.08 0.00 0.00 58.89 59.99 2jow h TRP 5 Cb 0.10 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 26.25 2jow h TRP 5 CO 0.00 0.00 0.17 0.66 -1.28 0.00 0.00 178.44 177.99 2jow h SER 6 N 0.00 0.00 0.16 0.11 4.64 -1.88 0.31 113.55 116.89 2jow h SER 6 Ca 0.03 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.35 2jow h SER 6 Cb 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 2jow h SER 6 CO -0.00 0.00 -0.15 0.61 -0.87 0.00 0.00 176.83 176.42 2jow n GLY 7 N -1.26 -0.44 0.00 -0.77 0.00 -0.68 -4.23 105.19 97.80 2jow n GLY 7 Ca -0.01 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.61 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 -0.40 0.00 -0.14 1.61 4.01 -0.54 -4.96 117.16 116.74 2jow n TYR 8 Ca 0.15 -0.04 -0.03 0.00 -0.16 0.00 0.00 57.90 57.82 2jow n TYR 8 Cb 0.34 -0.00 0.05 0.00 -0.31 0.00 0.00 39.34 39.41 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 -0.09 -0.98 7.72 5.85 -1.16 -1.31 115.31 125.35 2jow h LEU 9 Ca 0.00 0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.81 2jow h LEU 9 Cb 0.80 0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.98 2jow h LEU 9 CO 0.00 -0.01 0.00 -0.90 -0.34 0.00 0.00 178.44 177.19 2jow n ASP 10 N -5.16 0.80 0.00 1.25 5.75 -1.26 -0.71 116.55 117.22 2jow n ASP 10 Ca 0.04 -1.63 0.00 0.00 -0.01 0.00 0.00 54.79 53.19 2jow n ASP 10 Cb 0.23 -0.40 0.00 0.00 -1.03 0.00 0.00 41.12 39.92 2jow n ASP 10 CO 0.00 0.00 0.00 -0.67 -0.11 0.00 0.00 177.20 176.42 2jow n ASP 11 N 0.08 0.91 -0.04 -1.12 2.03 -0.76 -4.54 116.55 113.12 2jow n ASP 11 Ca 0.00 0.00 -0.14 0.00 0.52 0.00 0.00 54.79 55.17 2jow n ASP 11 Cb 0.20 0.00 -0.11 0.00 -0.72 0.00 0.00 41.12 40.49 2jow n ASP 11 CO 0.00 0.00 0.00 0.58 -1.92 0.00 0.00 177.20 175.86 2jow h VAL 12 N 0.00 1.55 -0.02 5.18 2.07 -1.06 -2.91 116.25 121.06 2jow h VAL 12 Ca 0.00 -1.75 -0.04 0.00 0.82 0.00 0.00 66.70 65.73 2jow h VAL 12 Cb 0.47 2.68 0.00 0.00 -1.52 0.00 0.00 31.29 32.92 2jow h VAL 12 CO 0.00 0.46 -0.15 -1.28 0.02 0.00 0.00 177.57 176.62 2jow h SER 13 N -0.60 0.17 -0.09 0.57 0.87 -1.14 -3.36 113.55 109.96 2jow h SER 13 Ca -0.01 -0.69 0.03 0.00 -1.23 0.00 0.00 61.79 59.89 2jow h SER 13 Cb 0.81 -0.05 -0.00 0.00 -0.44 0.00 0.00 62.40 62.71 2jow h SER 13 CO 0.02 0.83 0.26 0.00 -0.53 0.00 0.00 176.83 177.41 2jow h ALA 14 N 0.34 1.47 -0.75 6.23 0.00 -1.58 0.73 119.26 125.70 2jow h ALA 14 Ca -0.01 -0.00 0.22 0.00 0.00 0.00 0.00 54.91 55.11 2jow h ALA 14 Cb 0.83 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 2jow h ALA 14 CO 0.03 -0.31 0.65 1.57 0.00 0.00 0.00 179.25 181.19 2jow h LYS 15 N 0.00 0.00 0.00 0.00 2.10 -1.66 -2.50 116.57 114.50 2jow h LYS 15 Ca 0.04 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.69 2jow h LYS 15 Cb 0.57 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.90 2jow h LYS 15 CO -0.00 0.00 0.00 0.27 -2.00 0.00 0.00 179.45 177.72 2jow h PHE 16 N 0.00 0.00 -1.46 0.07 -0.00 -1.12 -3.42 116.94 111.01 2jow h PHE 16 Ca 0.35 0.00 0.42 0.00 -0.00 0.00 0.00 57.97 58.75 2jow h PHE 16 Cb 1.65 0.00 -0.06 0.00 -0.00 0.00 0.00 35.95 37.54 2jow h PHE 16 CO 0.00 0.00 1.14 0.22 -0.00 0.00 0.00 178.31 179.67 2jow h ASP 17 N 0.00 0.00 0.00 -0.68 3.58 -1.66 0.70 116.42 118.35 2jow h ASP 17 Ca 0.00 0.00 -0.07 0.00 0.42 0.00 0.00 57.03 57.38 2jow h ASP 17 Cb 0.51 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.55 2jow h ASP 17 CO 0.00 0.00 -2.01 1.07 -2.88 0.00 0.00 179.24 175.42 2jow n THR 18 N -3.89 0.25 0.02 2.25 5.66 -1.26 -3.55 114.28 113.76 2jow n THR 18 Ca 0.32 -0.54 -0.21 0.00 -3.05 0.00 0.00 64.05 60.58 2jow n THR 18 Cb 1.59 -0.07 -0.14 0.00 -1.55 0.00 0.00 70.33 70.16 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 3.75 0.31 0.59 1.09 0.00 -1.59 -3.32 103.07 103.91 2jow h GLY 19 Ca -0.10 -0.80 0.13 0.00 0.00 0.00 0.00 47.33 46.55 2jow h GLY 19 CO 0.01 0.70 0.57 -0.24 0.00 0.00 0.00 176.54 177.58 2jow h VAL 20 N 0.07 0.88 0.00 4.60 3.04 -1.13 -1.90 116.25 121.81 2jow h VAL 20 Ca -0.40 -0.26 -0.02 0.00 -1.01 0.00 0.00 66.70 65.01 2jow h VAL 20 Cb 2.04 0.06 -0.00 0.00 -2.01 0.00 0.00 31.29 31.38 2jow h VAL 20 CO 0.10 0.14 -0.11 -0.78 -1.01 0.00 0.00 177.57 175.92 2jow h ASP 21 N 0.76 0.00 0.69 3.17 3.58 -1.66 0.39 116.42 123.34 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 0.61 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.65 2jow h ASP 21 CO -0.20 0.11 -0.37 0.78 -2.88 0.00 0.00 179.24 176.68 2jow h ASN 22 N 0.00 0.00 0.14 2.28 2.35 -1.44 0.16 115.58 119.07 2jow h ASN 22 Ca -0.00 0.00 -0.23 0.00 -0.55 0.00 0.00 56.30 55.52 2jow h ASN 22 Cb 0.44 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.83 2jow h ASN 22 CO 0.01 0.37 -1.07 0.25 -1.65 0.00 0.00 177.43 175.35 2jow h LEU 23 N 0.00 0.46 -0.43 1.61 7.12 -1.15 -3.30 115.31 119.62 2jow h LEU 23 Ca -0.00 -0.91 0.04 0.00 0.13 0.00 0.00 57.88 57.13 2jow h LEU 23 Cb 0.82 -0.15 -0.04 0.00 -0.53 0.00 0.00 40.66 40.76 2jow h LEU 23 CO 0.05 1.49 0.21 -0.61 -0.13 0.00 0.00 178.44 179.45 2jow h GLN 24 N -0.32 0.41 -0.52 1.25 5.75 -0.22 0.88 115.11 122.34 2jow h GLN 24 Ca -0.21 -0.02 0.05 0.00 -0.15 0.00 0.00 58.65 58.32 2jow h GLN 24 Cb 1.72 -0.09 -0.05 0.00 1.07 0.00 0.00 27.48 30.12 2jow h GLN 24 CO 0.12 0.27 0.24 0.00 -2.65 0.00 0.00 178.83 176.82 2jow h THR 25 N 0.42 0.92 0.12 2.39 1.03 -0.85 0.23 112.91 117.17 2jow h THR 25 Ca 0.19 -0.16 0.00 0.00 -0.01 0.00 0.00 66.41 66.43 2jow h THR 25 Cb 0.10 0.41 -0.01 0.00 -1.07 0.00 0.00 68.15 67.59 2jow h THR 25 CO -0.14 0.09 -0.10 1.56 -0.01 0.00 0.00 175.52 176.92 2jow h GLN 26 N 0.47 -0.23 -0.58 0.00 4.20 -1.48 0.77 115.11 118.27 2jow h GLN 26 Ca 0.23 0.02 -0.06 0.00 0.06 0.00 0.00 58.65 58.90 2jow h GLN 26 Cb 0.17 0.05 -0.03 0.00 0.30 0.00 0.00 27.48 27.98 2jow h GLN 26 CO -0.18 -0.15 0.11 -0.39 -0.67 0.00 0.00 178.83 177.55 2jow h VAL 27 N -0.24 1.24 0.00 -0.54 -1.51 -0.53 -1.85 116.25 112.83 2jow h VAL 27 Ca -0.00 -0.90 -0.07 0.00 -1.23 0.00 0.00 66.70 64.50 2jow h VAL 27 Cb 0.22 0.68 -0.01 0.00 -2.13 0.00 0.00 31.29 30.05 2jow h VAL 27 CO -0.02 0.33 -0.31 0.74 -1.23 0.00 0.00 177.57 177.09 2jow h THR 28 N 0.86 0.96 0.00 7.19 2.02 -0.32 0.42 112.91 124.05 2jow h THR 28 Ca 0.18 -1.18 -0.19 0.00 0.77 0.00 0.00 66.41 65.99 2jow h THR 28 Cb 0.35 1.69 -0.03 0.00 -1.74 0.00 0.00 68.15 68.42 2jow h THR 28 CO 0.00 0.31 -0.90 -0.33 0.37 0.00 0.00 175.52 174.97 2jow h GLU 29 N 0.00 0.00 -0.73 6.66 5.08 -0.33 0.57 114.58 125.83 2jow h GLU 29 Ca -0.00 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.29 2jow h GLU 29 Cb 0.66 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.88 2jow h GLU 29 CO 0.04 0.90 0.21 0.00 -1.00 0.00 0.00 179.01 179.17 2jow h ALA 30 N 1.10 0.99 0.00 3.43 0.00 -0.86 -2.34 119.26 121.58 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 1.68 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 19.17 2jow h ALA 30 CO 0.12 0.67 -0.39 1.25 0.00 0.00 0.00 179.25 180.89 2jow h LEU 31 N 1.09 0.00 -1.81 0.00 5.85 -0.82 -0.96 115.31 118.67 2jow h LEU 31 Ca 0.23 0.00 0.03 0.00 0.84 0.00 0.00 57.88 58.98 2jow h LEU 31 Cb 0.33 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.34 2jow h LEU 31 CO -0.00 0.39 0.18 -0.78 -0.34 0.00 0.00 178.44 177.88 2jow h ASP 32 N 0.00 0.21 -0.04 1.25 3.58 0.70 0.56 116.42 122.68 2jow h ASP 32 Ca -0.00 -0.00 -0.13 0.00 0.42 0.00 0.00 57.03 57.31 2jow h ASP 32 Cb 0.70 -0.05 0.01 0.00 1.72 0.00 0.00 39.33 41.71 2jow h ASP 32 CO 0.05 0.15 -0.50 0.11 -2.88 0.00 0.00 179.24 176.17 2jow h LYS 33 N 0.25 0.41 0.00 0.28 1.79 -1.20 -3.04 116.57 115.05 2jow h LYS 33 Ca 0.11 -0.39 0.00 0.00 -2.18 0.00 0.00 60.65 58.19 2jow h LYS 33 Cb 0.13 0.10 0.00 0.00 -1.58 0.00 0.00 32.23 30.87 2jow h LYS 33 CO -0.02 1.04 0.00 1.25 -1.08 0.00 0.00 179.45 180.64 2jow h LEU 34 N -0.08 0.00 0.00 2.94 6.46 0.20 0.05 115.31 124.89 2jow h LEU 34 Ca -0.05 0.00 -0.06 0.00 -0.12 0.00 0.00 57.88 57.65 2jow h LEU 34 Cb 1.19 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 41.11 2jow h LEU 34 CO 0.10 0.00 -0.44 0.00 -0.62 0.00 0.00 178.44 177.48 2jow h ALA 35 N 2.02 0.78 0.00 1.25 0.00 -0.06 -3.05 119.26 120.20 2jow h ALA 35 Ca 0.00 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 2jow h ALA 35 Cb 0.60 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 2jow h ALA 35 CO 0.00 0.34 -0.09 0.00 0.00 0.00 0.00 179.25 179.50 2jow h ALA 36 N 1.74 0.02 -0.90 0.00 0.00 -0.92 -3.43 119.26 115.76 2jow h ALA 36 Ca -0.02 -0.41 -0.34 0.00 0.00 0.00 0.00 54.91 54.14 2jow h ALA 36 Cb 1.21 0.06 -0.40 0.00 0.00 0.00 0.00 17.79 18.66 2jow h ALA 36 CO 0.03 0.06 -1.18 1.17 0.00 0.00 0.00 179.25 179.32 2jow n LYS 37 N -4.64 1.24 0.00 0.00 4.81 -0.41 -5.10 118.16 114.06 2jow n LYS 37 Ca -0.09 -3.29 0.00 0.00 -0.87 0.00 0.00 58.31 54.06 2jow n LYS 37 Cb 0.36 -1.30 0.00 0.00 0.02 0.00 0.00 35.03 34.11 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 -1.96 135.00 133.36 2jow n PRO 38 Ca 0.09 0.00 0.00 0.00 -0.01 0.00 0.00 63.50 63.58 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 0.03 -4.43 2.55 3.41 -1.26 -4.26 113.62 109.65 2jow n SER 39 Ca 0.00 -1.58 -0.49 0.00 -0.26 0.00 0.00 58.87 56.54 2jow n SER 39 Cb 0.00 -0.01 -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 -0.48 1.68 0.27 4.04 -0.08 -0.83 -4.83 116.55 116.32 2jow n ASP 40 Ca 0.00 0.31 0.14 0.00 -1.51 0.00 0.00 54.79 53.73 2jow n ASP 40 Cb 0.01 -1.20 0.71 0.00 2.34 0.00 0.00 41.12 42.98 2jow n ASP 40 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 2jow h PRO 41 N 12.66 0.00 -0.34 -0.67 0.13 -1.90 0.98 132.00 142.85 2jow h PRO 41 Ca -0.21 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 64.75 2jow h PRO 41 Cb 1.33 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.46 2jow h PRO 41 CO 1.10 0.10 -0.44 0.00 -0.23 0.00 0.00 178.00 178.53 2jow h ALA 42 N 1.90 0.52 0.21 -0.56 0.00 -1.96 0.57 119.26 119.93 2jow h ALA 42 Ca -0.00 -0.48 -0.27 0.00 0.00 0.00 0.00 54.91 54.16 2jow h ALA 42 Cb 0.44 -0.10 0.03 0.00 0.00 0.00 0.00 17.79 18.16 2jow h ALA 42 CO 0.01 0.66 -1.21 1.37 0.00 0.00 0.00 179.25 180.09 2jow h LEU 43 N 0.71 0.69 -0.45 0.00 8.10 -1.84 -3.15 115.31 119.38 2jow h LEU 43 Ca 0.04 -0.93 -0.02 0.00 0.11 0.00 0.00 57.88 57.07 2jow h LEU 43 Cb 1.05 -0.22 -0.02 0.00 -0.44 0.00 0.00 40.66 41.02 2jow h LEU 43 CO 0.10 1.58 0.19 0.25 -4.11 0.00 0.00 178.44 176.46 2jow h LEU 44 N -0.08 0.61 -0.88 0.17 7.12 -0.87 -1.07 115.31 120.31 2jow h LEU 44 Ca -0.21 -0.16 0.00 0.00 0.13 0.00 0.00 57.88 57.64 2jow h LEU 44 Cb 1.95 -0.16 0.00 0.00 -0.53 0.00 0.00 40.66 41.92 2jow h LEU 44 CO 0.22 0.60 0.00 0.00 -0.13 0.00 0.00 178.44 179.13 2jow h ALA 45 N 1.03 1.00 -0.33 1.25 0.00 -1.03 0.16 119.26 121.34 2jow h ALA 45 Ca 0.15 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.94 2jow h ALA 45 Cb 0.17 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2jow h ALA 45 CO -0.01 0.00 -0.29 0.00 0.00 0.00 0.00 179.25 178.95 2jow h ALA 46 N 2.01 0.88 0.10 0.00 0.00 -1.38 0.13 119.26 121.00 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 0.58 -0.12 -0.56 0.00 3.20 0.08 -0.22 116.97 119.94 2jow h TYR 47 Ca 0.07 -0.00 0.14 0.00 3.14 0.00 0.00 58.73 62.07 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 -0.02 0.39 1.96 -1.64 0.00 0.00 178.16 178.89 2jow h GLN 48 N -0.20 0.14 0.03 1.82 1.08 -0.58 0.11 115.11 117.52 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 0.16 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.56 2jow h GLN 48 CO 0.02 0.09 -0.02 1.03 -0.95 0.00 0.00 178.83 179.01 2jow h SER 49 N 0.15 -0.04 -0.24 1.46 0.87 -0.36 -3.06 113.55 112.32 2jow h SER 49 Ca 0.26 -0.58 -0.08 0.00 -1.23 0.00 0.00 61.79 60.17 2jow h SER 49 Cb 0.85 0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 62.80 2jow h SER 49 CO -0.04 0.58 -0.10 0.11 -0.53 0.00 0.00 176.83 176.86 2jow h LYS 50 N -0.68 0.62 -0.92 2.24 1.79 -0.12 0.17 116.57 119.67 2jow h LYS 50 Ca -0.00 -0.19 0.14 0.00 -2.18 0.00 0.00 60.65 58.42 2jow h LYS 50 Cb 0.62 -0.06 -0.08 0.00 -1.58 0.00 0.00 32.23 31.13 2jow h LYS 50 CO 0.01 0.72 0.59 1.25 -1.08 0.00 0.00 179.45 180.93 2jow h LEU 51 N 0.58 0.74 0.23 2.94 6.46 -0.95 0.19 115.31 125.49 2jow h LEU 51 Ca 0.11 0.04 -0.30 0.00 -0.12 0.00 0.00 57.88 57.61 2jow h LEU 51 Cb 0.51 -0.10 0.04 0.00 -0.73 0.00 0.00 40.66 40.38 2jow h LEU 51 CO 0.03 0.38 -1.33 0.28 -0.62 0.00 0.00 178.44 177.18 2jow h SER 52 N 0.78 0.76 -0.40 1.25 0.02 -1.12 -3.24 113.55 111.61 2jow h SER 52 Ca 0.46 -0.93 0.03 0.00 -0.84 0.00 0.00 61.79 60.52 2jow h SER 52 Cb 0.65 -0.25 -0.02 0.00 0.14 0.00 0.00 62.40 62.92 2jow h SER 52 CO -0.23 1.64 0.27 -0.33 -1.14 0.00 0.00 176.83 177.04 2jow h GLU 53 N 0.02 0.41 -0.22 3.45 4.39 -0.01 0.10 114.58 122.72 2jow h GLU 53 Ca -0.23 -0.02 -0.12 0.00 0.34 0.00 0.00 59.36 59.33 2jow h GLU 53 Cb 2.05 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 30.59 2jow h GLU 53 CO 0.25 0.27 -0.36 -0.92 -1.16 0.00 0.00 179.01 177.08 2jow h TYR 54 N 0.42 0.57 0.00 4.33 3.20 -0.76 0.25 116.97 124.98 2jow h TYR 54 Ca 0.16 -0.15 -0.07 0.00 3.14 0.00 0.00 58.73 61.82 2jow h TYR 54 Cb 0.13 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.26 2jow h TYR 54 CO -0.00 0.78 -0.32 -0.97 -1.64 0.00 0.00 178.16 176.02 2jow h ASN 55 N 0.41 0.00 0.24 -2.11 -1.24 -1.24 -2.28 115.58 109.35 2jow h ASN 55 Ca 0.04 0.00 -0.17 0.00 0.71 0.00 0.00 56.30 56.89 2jow h ASN 55 Cb 0.83 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.87 2jow h ASN 55 CO 0.07 0.32 -0.64 -0.07 -1.29 0.00 0.00 177.43 175.81 2jow h LEU 56 N 0.00 0.44 -0.71 0.34 4.07 -0.32 0.77 115.31 119.90 2jow h LEU 56 Ca -0.00 -0.27 0.05 0.00 0.08 0.00 0.00 57.88 57.74 2jow h LEU 56 Cb 0.90 -0.13 -0.05 0.00 1.08 0.00 0.00 40.66 42.45 2jow h LEU 56 CO 0.04 0.97 0.42 0.22 -1.08 0.00 0.00 178.44 179.01 2jow h TYR 57 N 0.28 0.77 -0.90 1.13 5.03 -0.30 0.16 116.97 123.14 2jow h TYR 57 Ca -0.01 0.02 -0.02 0.00 2.58 0.00 0.00 58.73 61.30 2jow h TYR 57 Cb 1.19 -0.24 -0.04 0.00 1.55 0.00 0.00 36.73 39.18 2jow h TYR 57 CO 0.04 0.39 0.49 -0.09 -1.32 0.00 0.00 178.16 177.67 2jow h ARG 58 N 0.78 1.26 -0.36 1.82 9.65 -1.20 -0.18 114.38 126.15 2jow h ARG 58 Ca 0.31 -0.15 -0.09 0.00 -1.10 0.00 0.00 59.98 58.95 2jow h ARG 58 Cb 0.15 -0.25 -0.01 0.00 -1.39 0.00 0.00 29.97 28.47 2jow h ARG 58 CO -0.16 0.92 -0.13 -0.97 2.80 0.00 0.00 179.97 182.43 2jow h ASN 59 N 1.26 0.73 -0.74 -3.80 -1.24 -0.28 -2.81 115.58 108.70 2jow h ASN 59 Ca 0.32 -0.39 -0.00 0.00 0.71 0.00 0.00 56.30 56.94 2jow h ASN 59 Cb 0.03 -0.20 -0.04 0.00 0.73 0.00 0.00 38.32 38.84 2jow h ASN 59 CO -0.05 0.95 0.46 0.00 -1.29 0.00 0.00 177.43 177.50 2jow h ALA 60 N 0.80 1.40 0.00 1.57 0.00 -0.51 -1.39 119.26 121.13 2jow h ALA 60 Ca 0.08 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2jow h ALA 60 Cb 0.66 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.15 2jow h ALA 60 CO 0.04 0.53 0.00 0.94 0.00 0.00 0.00 179.25 180.76 2jow n GLN 61 N -4.39 0.81 -0.15 0.00 7.27 -0.10 -0.86 117.38 119.96 2jow n GLN 61 Ca 0.08 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.15 2jow n GLN 61 Cb 0.06 -1.18 0.00 0.00 2.41 0.00 0.00 30.24 31.53 2jow n GLN 61 CO 0.00 0.00 0.00 0.45 0.07 0.00 0.00 177.06 177.58 2jow n SER 62 N 0.45 0.00 0.01 1.69 2.88 -0.54 -4.81 113.62 113.30 2jow n SER 62 Ca 0.00 -1.22 0.00 0.00 -1.33 0.00 0.00 58.87 56.32 2jow n SER 62 Cb 0.35 -0.04 0.00 0.00 -0.75 0.00 0.00 64.21 63.76 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 0.11 -0.28 -3.46 2.85 -0.04 -4.58 115.26 109.86 2jow n ASN 63 Ca 0.00 0.02 0.08 0.00 -0.11 0.00 0.00 54.58 54.57 2jow n ASN 63 Cb 0.54 -0.03 0.24 0.00 1.24 0.00 0.00 39.78 41.77 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 0.61 -0.67 -0.44 1.03 -1.39 0.12 112.91 112.17 2jow h THR 64 Ca 0.00 -0.16 0.20 0.00 -0.01 0.00 0.00 66.41 66.43 2jow h THR 64 Cb 0.83 0.10 -0.03 0.00 -1.07 0.00 0.00 68.15 67.98 2jow h THR 64 CO 0.00 0.09 0.54 0.58 -0.01 0.00 0.00 175.52 176.72 2jow h VAL 65 N 0.47 0.52 -0.21 0.00 2.07 -1.84 0.50 116.25 117.76 2jow h VAL 65 Ca 0.48 0.00 0.00 0.00 0.82 0.00 0.00 66.70 68.00 2jow h VAL 65 Cb 0.78 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 31.16 2jow h VAL 65 CO -0.44 0.00 0.00 0.29 0.02 0.00 0.00 177.57 177.44 2jow n LYS 66 N -4.10 2.78 -0.03 1.57 4.01 0.31 -4.37 118.16 118.33 2jow n LYS 66 Ca 0.13 -2.10 -0.04 0.00 -0.51 0.00 0.00 58.31 55.80 2jow n LYS 66 Cb 0.79 -1.32 -0.04 0.00 -0.51 0.00 0.00 35.03 33.95 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 -0.10 0.38 0.10 -0.18 0.31 -0.15 -4.30 118.33 114.40 2jow n VAL 67 Ca 0.11 -0.20 0.09 0.00 -0.01 0.00 0.00 64.34 64.32 2jow n VAL 67 Cb 0.48 -0.81 0.55 0.00 -0.91 0.00 0.00 33.84 33.16 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 0.23 -0.72 3.52 0.04 -1.21 0.22 116.94 119.03 2jow h PHE 68 Ca -0.15 0.01 0.15 0.00 2.80 0.00 0.00 57.97 60.77 2jow h PHE 68 Cb 1.30 -0.08 -0.05 0.00 2.20 0.00 0.00 35.95 39.32 2jow h PHE 68 CO 0.00 0.14 0.48 -0.22 -0.60 0.00 0.00 178.31 178.11 2jow h LYS 69 N 0.24 0.36 0.06 1.51 3.11 -1.76 -1.19 116.57 118.90 2jow h LYS 69 Ca 0.12 -0.02 -0.24 0.00 -2.81 0.00 0.00 60.65 57.70 2jow h LYS 69 Cb 0.17 -0.08 -0.01 0.00 -1.00 0.00 0.00 32.23 31.30 2jow h LYS 69 CO -0.02 0.24 -1.10 0.22 -2.81 0.00 0.00 179.45 175.97 2jow h ASP 70 N 0.37 0.19 -0.35 4.20 3.58 -0.75 0.14 116.42 123.80 2jow h ASP 70 Ca 0.35 -0.20 -0.06 0.00 0.42 0.00 0.00 57.03 57.54 2jow h ASP 70 Cb 0.85 -0.06 -0.01 0.00 1.72 0.00 0.00 39.33 41.82 2jow h ASP 70 CO -0.10 1.16 -0.02 0.40 -2.88 0.00 0.00 179.24 177.80 2jow h ILE 71 N 0.03 1.26 -0.28 2.25 5.03 -1.09 -2.21 117.51 122.50 2jow h ILE 71 Ca -0.06 -1.01 -0.07 0.00 -0.12 0.00 0.00 64.86 63.59 2jow h ILE 71 Cb 1.85 1.23 -0.02 0.00 -3.03 0.00 0.00 36.82 36.86 2jow h ILE 71 CO 0.16 0.33 -0.14 -0.78 -0.68 0.00 0.00 178.15 177.05 2jow h ASP 72 N 0.43 0.46 0.15 1.72 3.58 -1.19 -1.24 116.42 120.32 2jow h ASP 72 Ca 0.10 -0.12 -0.04 0.00 0.42 0.00 0.00 57.03 57.38 2jow h ASP 72 Cb 0.48 -0.12 -0.01 0.00 1.72 0.00 0.00 39.33 41.40 2jow h ASP 72 CO 0.02 0.63 -0.17 0.00 -2.88 0.00 0.00 179.24 176.83 2jow h ALA 73 N 1.42 1.65 -0.20 -0.78 0.00 -0.62 0.05 119.26 120.78 2jow h ALA 73 Ca 0.08 -0.18 -0.13 0.00 0.00 0.00 0.00 54.91 54.68 2jow h ALA 73 Cb 0.50 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2jow h ALA 73 CO 0.03 0.26 -0.42 0.00 0.00 0.00 0.00 179.25 179.13 2jow h ALA 74 N 1.78 0.91 -0.79 0.00 0.00 -0.62 -0.34 119.26 120.19 2jow h ALA 74 Ca 0.01 -0.44 -0.04 0.00 0.00 0.00 0.00 54.91 54.44 2jow h ALA 74 Cb 0.34 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.99 2jow h ALA 74 CO 0.02 0.64 0.34 0.82 0.00 0.00 0.00 179.25 181.07 2jow h ILE 75 N 0.39 1.25 0.02 0.00 2.04 -0.43 -0.68 117.51 120.11 2jow h ILE 75 Ca 0.03 -0.77 0.00 0.00 1.00 0.00 0.00 64.86 65.12 2jow h ILE 75 Cb 0.90 0.29 -0.00 0.00 -0.74 0.00 0.00 36.82 37.26 2jow h ILE 75 CO 0.08 0.32 -0.02 -0.07 0.00 0.00 0.00 178.15 178.46 2jow h LEU 76 N 1.14 -0.05 -1.42 1.44 4.07 -0.79 -2.70 115.31 116.99 2jow h LEU 76 Ca 0.27 0.01 0.12 0.00 0.08 0.00 0.00 57.88 58.35 2jow h LEU 76 Cb 0.18 0.02 -0.06 0.00 1.08 0.00 0.00 40.66 41.88 2jow h LEU 76 CO -0.03 -0.03 0.52 -0.33 -1.08 0.00 0.00 178.44 177.49 2jow h GLU 77 N -0.05 0.59 0.00 1.13 5.08 -0.77 0.75 114.58 121.31 2jow h GLU 77 Ca 0.00 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 2jow h GLU 77 Cb 0.05 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.16 2jow h GLU 77 CO -0.01 0.39 0.00 1.58 -1.00 0.00 0.00 179.01 179.97 2jow n HIS 78 N -4.51 0.00 0.00 4.33 -0.00 -0.29 -2.29 115.22 112.46 2jow n HIS 78 Ca 0.14 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.32 2jow n HIS 78 Cb 0.42 -0.49 0.00 0.00 -0.12 0.00 0.00 29.99 29.79 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 -1.49 0.00 0.28 1.57 1.44 -0.55 -4.72 115.22 111.74 2jow n HIS 79 Ca 0.01 0.00 0.13 0.00 -2.01 0.00 0.00 57.72 55.84 2jow n HIS 79 Cb 0.03 0.00 0.60 0.00 0.12 0.00 0.00 29.99 30.75 2jow n HIS 79 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 2jow h HIS 80 N 0.00 0.00 -0.13 -1.40 -0.00 -0.82 -3.01 115.15 109.79 2jow h HIS 80 Ca 0.00 0.00 0.04 0.00 -0.00 0.00 0.00 60.37 60.41 2jow h HIS 80 Cb 0.37 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 27.77 2jow h HIS 80 CO 0.00 0.00 0.40 1.25 -0.00 0.00 0.00 177.93 179.58 2jow h HIS 81 N 0.00 0.00 0.00 2.45 2.76 -1.71 -1.48 115.15 117.16 2jow h HIS 81 Ca 0.00 0.00 -0.02 0.00 -2.20 0.00 0.00 60.37 58.15 2jow h HIS 81 Cb 0.19 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 29.15 2jow h HIS 81 CO 0.00 0.00 -0.07 1.25 -1.30 0.00 0.00 177.93 177.81 2jow h HIS 82 N 0.00 0.00 0.00 5.26 -0.00 -1.86 -3.53 115.15 115.02 2jow h HIS 82 Ca 0.06 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.43 2jow h HIS 82 Cb 0.86 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.27 2jow h HIS 82 CO 0.00 0.07 0.00 1.58 -0.00 0.00 0.00 177.93 179.58