#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 -0.75 0.32 3.17 0.00 -1.26 -5.16 121.76 118.08 2jow s ALA 2 Ca 0.00 -0.17 -0.23 0.00 0.00 0.00 0.00 51.96 51.56 2jow s ALA 2 Cb 0.00 0.61 -0.10 0.00 0.00 0.00 0.00 23.12 23.63 2jow s ALA 2 CO 0.00 -0.59 0.89 0.95 0.00 0.00 0.00 175.76 177.00 2jow s THR 3 N -3.70 4.35 0.26 0.00 -4.23 -1.26 -5.02 115.64 106.04 2jow s THR 3 Ca 0.03 1.59 -0.30 0.00 -1.18 0.00 0.00 61.69 61.83 2jow s THR 3 Cb 0.02 -3.87 -0.10 0.00 1.34 0.00 0.00 72.50 69.89 2jow s THR 3 CO -0.11 0.04 1.45 -2.84 -0.54 0.00 0.00 174.62 172.62 2jow s PRO 4 N -2.32 4.25 0.27 3.99 0.02 -1.26 -4.91 135.00 135.05 2jow s PRO 4 Ca 0.51 2.33 -0.01 0.00 0.02 0.00 0.00 61.00 63.85 2jow s PRO 4 Cb -0.16 -3.10 0.49 0.00 0.02 0.00 0.00 34.50 31.76 2jow s PRO 4 CO 0.21 -0.43 1.84 0.11 -0.33 0.00 0.00 177.00 178.39 2jow h TRP 5 N 4.91 1.08 0.00 6.54 5.08 -1.98 -2.09 115.95 129.49 2jow h TRP 5 Ca -0.46 0.03 0.00 0.00 1.08 0.00 0.00 58.89 59.54 2jow h TRP 5 Cb 1.22 -0.34 0.00 0.00 -3.00 0.00 0.00 29.16 27.04 2jow h TRP 5 CO 0.60 0.45 0.00 0.45 -1.28 0.00 0.00 178.44 178.66 2jow n SER 6 N -4.63 0.00 -0.57 0.11 2.88 -1.26 -0.44 113.62 109.70 2jow n SER 6 Ca 0.17 -0.18 0.05 0.00 -1.33 0.00 0.00 58.87 57.58 2jow n SER 6 Cb 0.31 -0.09 0.09 0.00 -0.75 0.00 0.00 64.21 63.77 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 -0.38 2.81 0.80 0.46 0.00 -0.79 -4.88 105.19 103.21 2jow n GLY 7 Ca 0.07 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.34 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 -0.56 -0.50 -0.25 1.61 9.36 -0.64 -4.94 117.16 121.24 2jow n TYR 8 Ca 0.10 0.00 0.08 0.00 3.32 0.00 0.00 57.90 61.40 2jow n TYR 8 Cb 0.76 0.20 0.34 0.00 -0.63 0.00 0.00 39.34 40.01 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 0.71 -1.85 2.98 7.12 -1.03 -3.04 115.31 120.20 2jow h LEU 9 Ca 0.00 0.02 0.00 0.00 0.13 0.00 0.00 57.88 58.03 2jow h LEU 9 Cb 0.00 -0.13 0.00 0.00 -0.53 0.00 0.00 40.66 40.00 2jow h LEU 9 CO 0.00 0.41 0.00 -2.24 -0.13 0.00 0.00 178.44 176.48 2jow h ASP 10 N 0.78 0.00 0.08 1.25 2.03 -1.90 0.11 116.42 118.78 2jow h ASP 10 Ca 0.39 0.00 -0.37 0.00 -0.73 0.00 0.00 57.03 56.32 2jow h ASP 10 Cb 0.46 0.00 -0.06 0.00 -0.83 0.00 0.00 39.33 38.90 2jow h ASP 10 CO -0.16 0.00 -2.28 -0.67 -1.03 0.00 0.00 179.24 175.10 2jow n ASP 11 N -2.51 1.10 0.10 4.15 2.03 -1.15 -4.09 116.55 116.18 2jow n ASP 11 Ca -0.02 0.03 -0.11 0.00 0.52 0.00 0.00 54.79 55.22 2jow n ASP 11 Cb 0.06 0.11 -0.07 0.00 -0.72 0.00 0.00 41.12 40.50 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 0.01 0.63 0.00 5.18 2.07 -1.29 -3.23 116.25 119.62 2jow h VAL 12 Ca -0.51 -0.91 -0.05 0.00 0.82 0.00 0.00 66.70 66.05 2jow h VAL 12 Cb 2.07 1.03 -0.01 0.00 -1.52 0.00 0.00 31.29 32.85 2jow h VAL 12 CO 0.00 0.15 -0.26 -1.28 0.02 0.00 0.00 177.57 176.21 2jow h SER 13 N -0.91 0.00 0.32 0.57 0.87 -1.11 -2.63 113.55 110.67 2jow h SER 13 Ca -0.03 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.51 2jow h SER 13 Cb 0.50 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.46 2jow h SER 13 CO 0.06 0.26 -0.09 0.00 -0.53 0.00 0.00 176.83 176.52 2jow h ALA 14 N 1.74 1.29 -0.44 6.23 0.00 -1.70 -0.63 119.26 125.75 2jow h ALA 14 Ca -0.00 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 2jow h ALA 14 Cb 0.48 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 2jow h ALA 14 CO 0.03 0.12 0.15 1.57 0.00 0.00 0.00 179.25 181.12 2jow h LYS 15 N 0.00 0.64 -0.03 0.00 2.10 -1.49 -2.31 116.57 115.49 2jow h LYS 15 Ca -0.00 -0.10 -0.01 0.00 -2.00 0.00 0.00 60.65 58.55 2jow h LYS 15 Cb 0.28 -0.11 -0.00 0.00 -0.90 0.00 0.00 32.23 31.49 2jow h LYS 15 CO 0.01 0.55 -0.01 0.74 -2.00 0.00 0.00 179.45 178.74 2jow h PHE 16 N 0.63 0.07 -0.14 0.07 -1.00 -1.29 -3.25 116.94 112.02 2jow h PHE 16 Ca 0.15 -0.02 0.04 0.00 2.81 0.00 0.00 57.97 60.96 2jow h PHE 16 Cb 0.17 -0.02 -0.01 0.00 3.61 0.00 0.00 35.95 39.71 2jow h PHE 16 CO 0.01 0.45 0.18 0.22 -1.61 0.00 0.00 178.31 177.56 2jow h ASP 17 N -0.34 0.00 0.10 2.17 3.58 -0.67 0.98 116.42 122.24 2jow h ASP 17 Ca 0.01 0.00 -0.29 0.00 0.42 0.00 0.00 57.03 57.17 2jow h ASP 17 Cb 0.43 0.00 -0.05 0.00 1.72 0.00 0.00 39.33 41.43 2jow h ASP 17 CO 0.00 0.00 -2.18 1.07 -2.88 0.00 0.00 179.24 175.25 2jow n THR 18 N -3.69 1.17 0.14 2.25 5.66 -1.05 -3.73 114.28 115.02 2jow n THR 18 Ca 0.01 -0.78 -0.23 0.00 -3.05 0.00 0.00 64.05 59.99 2jow n THR 18 Cb 0.29 -0.46 -0.15 0.00 -1.55 0.00 0.00 70.33 68.46 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 3.93 0.60 0.69 1.09 0.00 -1.41 -3.19 103.07 104.79 2jow h GLY 19 Ca -0.40 -1.49 0.11 0.00 0.00 0.00 0.00 47.33 45.55 2jow h GLY 19 CO 0.03 1.30 0.56 -0.24 0.00 0.00 0.00 176.54 178.19 2jow h VAL 20 N 0.16 0.92 0.00 4.60 3.04 -1.05 -2.01 116.25 121.91 2jow h VAL 20 Ca -0.23 -0.26 -0.03 0.00 -1.01 0.00 0.00 66.70 65.16 2jow h VAL 20 Cb 2.11 0.08 -0.00 0.00 -2.01 0.00 0.00 31.29 31.47 2jow h VAL 20 CO 0.26 0.14 -0.16 -0.78 -1.01 0.00 0.00 177.57 176.03 2jow h ASP 21 N 0.77 0.00 0.63 3.17 3.58 -1.63 0.34 116.42 123.28 2jow h ASP 21 Ca 0.41 0.00 -0.07 0.00 0.42 0.00 0.00 57.03 57.79 2jow h ASP 21 Cb 0.52 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.56 2jow h ASP 21 CO -0.17 0.16 -0.34 0.78 -2.88 0.00 0.00 179.24 176.79 2jow h ASN 22 N 0.00 0.00 0.16 2.28 2.35 -1.35 0.16 115.58 119.17 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 0.56 0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.95 2jow h ASN 22 CO 0.02 0.34 -1.05 0.25 -1.65 0.00 0.00 177.43 175.34 2jow h LEU 23 N 0.00 0.51 -0.36 1.61 7.12 -1.22 -3.28 115.31 119.68 2jow h LEU 23 Ca -0.00 -0.93 0.03 0.00 0.13 0.00 0.00 57.88 57.11 2jow h LEU 23 Cb 0.75 -0.17 -0.03 0.00 -0.53 0.00 0.00 40.66 40.68 2jow h LEU 23 CO 0.04 1.50 0.17 -0.61 -0.13 0.00 0.00 178.44 179.41 2jow h GLN 24 N -0.27 0.34 -0.55 1.25 5.75 -0.26 0.65 115.11 122.02 2jow h GLN 24 Ca -0.20 -0.02 0.05 0.00 -0.15 0.00 0.00 58.65 58.34 2jow h GLN 24 Cb 1.76 -0.08 -0.05 0.00 1.07 0.00 0.00 27.48 30.18 2jow h GLN 24 CO 0.15 0.23 0.28 0.00 -2.65 0.00 0.00 178.83 176.84 2jow h THR 25 N 0.36 0.94 0.08 2.39 1.03 -0.86 0.23 112.91 117.07 2jow h THR 25 Ca 0.16 -0.18 0.01 0.00 -0.01 0.00 0.00 66.41 66.38 2jow h THR 25 Cb 0.08 0.36 -0.01 0.00 -1.07 0.00 0.00 68.15 67.51 2jow h THR 25 CO -0.12 0.10 -0.10 1.56 -0.01 0.00 0.00 175.52 176.94 2jow h GLN 26 N 0.53 -0.21 -0.57 0.00 4.20 -1.48 0.60 115.11 118.17 2jow h GLN 26 Ca 0.25 0.01 -0.06 0.00 0.06 0.00 0.00 58.65 58.91 2jow h GLN 26 Cb 0.17 0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.97 2jow h GLN 26 CO -0.18 -0.14 0.10 -0.39 -0.67 0.00 0.00 178.83 177.55 2jow h VAL 27 N -0.22 1.24 0.00 -0.54 -1.51 -0.52 -2.01 116.25 112.69 2jow h VAL 27 Ca 0.01 -0.92 -0.06 0.00 -1.23 0.00 0.00 66.70 64.50 2jow h VAL 27 Cb 0.22 0.70 -0.01 0.00 -2.13 0.00 0.00 31.29 30.07 2jow h VAL 27 CO -0.05 0.34 -0.29 0.74 -1.23 0.00 0.00 177.57 177.09 2jow h THR 28 N 0.86 0.95 0.00 7.19 2.02 -0.31 0.39 112.91 124.02 2jow h THR 28 Ca 0.18 -1.08 -0.17 0.00 0.77 0.00 0.00 66.41 66.11 2jow h THR 28 Cb 0.37 1.63 -0.02 0.00 -1.74 0.00 0.00 68.15 68.38 2jow h THR 28 CO 0.01 0.28 -0.81 -0.33 0.37 0.00 0.00 175.52 175.04 2jow h GLU 29 N 0.00 0.00 -0.61 6.66 5.08 -0.36 0.55 114.58 125.89 2jow h GLU 29 Ca -0.00 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.27 2jow h GLU 29 Cb 0.61 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.83 2jow h GLU 29 CO 0.04 0.81 0.06 0.00 -1.00 0.00 0.00 179.01 178.92 2jow h ALA 30 N 1.19 0.94 0.00 3.43 0.00 -0.83 -2.54 119.26 121.44 2jow h ALA 30 Ca -0.01 -0.28 -0.08 0.00 0.00 0.00 0.00 54.91 54.54 2jow h ALA 30 Cb 1.62 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 19.16 2jow h ALA 30 CO 0.11 0.65 -0.39 1.25 0.00 0.00 0.00 179.25 180.87 2jow h LEU 31 N 0.96 0.00 -1.81 0.00 5.85 -0.82 -0.99 115.31 118.51 2jow h LEU 31 Ca 0.18 0.00 0.05 0.00 0.84 0.00 0.00 57.88 58.95 2jow h LEU 31 Cb 0.48 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.49 2jow h LEU 31 CO 0.02 0.39 0.22 -0.78 -0.34 0.00 0.00 178.44 177.95 2jow h ASP 32 N 0.00 0.21 -0.03 1.25 3.58 0.54 0.55 116.42 122.52 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 0.70 -0.05 0.01 0.00 1.72 0.00 0.00 39.33 41.71 2jow h ASP 32 CO 0.05 0.14 -0.52 0.11 -2.88 0.00 0.00 179.24 176.15 2jow h LYS 33 N 0.24 0.40 0.00 0.28 1.79 -1.27 -3.04 116.57 114.97 2jow h LYS 33 Ca 0.14 -0.39 0.00 0.00 -2.18 0.00 0.00 60.65 58.22 2jow h LYS 33 Cb 0.26 0.10 0.00 0.00 -1.58 0.00 0.00 32.23 31.01 2jow h LYS 33 CO -0.03 1.05 0.00 1.25 -1.08 0.00 0.00 179.45 180.65 2jow h LEU 34 N -0.11 0.00 0.00 2.94 6.46 0.18 0.00 115.31 124.78 2jow h LEU 34 Ca -0.06 0.00 -0.07 0.00 -0.12 0.00 0.00 57.88 57.64 2jow h LEU 34 Cb 1.22 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 41.14 2jow h LEU 34 CO 0.10 0.00 -0.47 0.00 -0.62 0.00 0.00 178.44 177.46 2jow h ALA 35 N 2.02 0.76 0.00 1.25 0.00 -0.07 -3.06 119.26 120.16 2jow h ALA 35 Ca 0.00 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 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 0.39 -0.08 0.00 0.00 0.00 0.00 179.25 179.56 2jow h ALA 36 N 1.70 0.02 -0.91 0.00 0.00 -0.93 -3.43 119.26 115.71 2jow h ALA 36 Ca -0.02 -0.43 -0.34 0.00 0.00 0.00 0.00 54.91 54.12 2jow h ALA 36 Cb 1.24 0.05 -0.39 0.00 0.00 0.00 0.00 17.79 18.69 2jow h ALA 36 CO 0.04 0.05 -1.17 1.17 0.00 0.00 0.00 179.25 179.34 2jow n LYS 37 N -4.64 1.21 0.00 0.00 4.81 -0.42 -5.10 118.16 114.03 2jow n LYS 37 Ca -0.09 -3.24 0.00 0.00 -0.87 0.00 0.00 58.31 54.11 2jow n LYS 37 Cb 0.38 -1.25 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 -0.14 0.00 0.00 1.64 -0.01 -1.15 -1.95 135.00 133.38 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 -4.27 113.62 109.65 2jow n SER 39 Ca 0.00 -1.59 -0.48 0.00 -0.26 0.00 0.00 58.87 56.54 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 -0.47 1.68 0.26 4.04 2.03 -0.82 -4.83 116.55 118.44 2jow n ASP 40 Ca 0.00 0.26 0.13 0.00 0.52 0.00 0.00 54.79 55.70 2jow n ASP 40 Cb 0.01 -1.21 0.71 0.00 -0.72 0.00 0.00 41.12 39.91 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 13.06 0.00 -0.38 -0.67 0.13 -1.90 0.75 132.00 142.99 2jow h PRO 41 Ca -0.21 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.76 2jow h PRO 41 Cb 1.32 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.45 2jow h PRO 41 CO 1.11 0.12 -0.40 0.00 -0.23 0.00 0.00 178.00 178.60 2jow h ALA 42 N 1.88 0.58 0.21 -0.56 0.00 -1.96 0.60 119.26 120.01 2jow h ALA 42 Ca -0.00 -0.46 -0.27 0.00 0.00 0.00 0.00 54.91 54.18 2jow h ALA 42 Cb 0.40 -0.12 0.03 0.00 0.00 0.00 0.00 17.79 18.10 2jow h ALA 42 CO 0.02 0.68 -1.20 1.37 0.00 0.00 0.00 179.25 180.11 2jow h LEU 43 N 0.75 0.68 -0.44 0.00 8.10 -1.83 -3.17 115.31 119.41 2jow h LEU 43 Ca 0.06 -0.94 -0.02 0.00 0.11 0.00 0.00 57.88 57.09 2jow h LEU 43 Cb 0.99 -0.22 -0.02 0.00 -0.44 0.00 0.00 40.66 40.97 2jow h LEU 43 CO 0.10 1.58 0.17 0.25 -4.11 0.00 0.00 178.44 176.43 2jow h LEU 44 N -0.08 0.60 -0.88 0.17 7.12 -0.90 -1.14 115.31 120.19 2jow h LEU 44 Ca -0.21 -0.17 0.00 0.00 0.13 0.00 0.00 57.88 57.63 2jow h LEU 44 Cb 1.94 -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 0.00 178.44 179.14 2jow h ALA 45 N 1.02 1.00 -0.35 1.25 0.00 -1.03 0.15 119.26 121.30 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 0.19 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 2jow h ALA 45 CO -0.01 0.00 -0.27 0.00 0.00 0.00 0.00 179.25 178.97 2jow h ALA 46 N 2.01 0.87 0.13 0.00 0.00 -1.40 0.12 119.26 120.99 2jow h ALA 46 Ca 0.00 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.52 2jow h ALA 46 Cb 0.70 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.35 2jow h ALA 46 CO 0.00 0.63 -0.06 -0.92 0.00 0.00 0.00 179.25 178.90 2jow h TYR 47 N 0.62 -0.16 -0.58 0.00 3.20 0.04 -0.28 116.97 119.81 2jow h TYR 47 Ca 0.08 -0.00 0.15 0.00 3.14 0.00 0.00 58.73 62.09 2jow h TYR 47 Cb 0.77 0.05 -0.03 0.00 1.54 0.00 0.00 36.73 39.07 2jow h TYR 47 CO 0.04 -0.07 0.41 1.96 -1.64 0.00 0.00 178.16 178.86 2jow h GLN 48 N -0.22 0.12 0.01 1.82 1.08 -0.59 0.11 115.11 117.44 2jow h GLN 48 Ca -0.02 -0.01 -0.00 0.00 -1.45 0.00 0.00 58.65 57.17 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 0.03 0.08 -0.00 1.03 -0.95 0.00 0.00 178.83 179.01 2jow h SER 49 N 0.12 -0.01 -0.22 1.46 0.87 -0.36 -3.07 113.55 112.34 2jow h SER 49 Ca 0.28 -0.66 -0.09 0.00 -1.23 0.00 0.00 61.79 60.08 2jow h SER 49 Cb 0.93 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.88 2jow h SER 49 CO -0.03 0.66 -0.17 0.11 -0.53 0.00 0.00 176.83 176.87 2jow h LYS 50 N -0.69 0.65 -0.97 2.24 1.79 -0.13 0.15 116.57 119.61 2jow h LYS 50 Ca -0.00 -0.23 0.17 0.00 -2.18 0.00 0.00 60.65 58.40 2jow h LYS 50 Cb 0.67 -0.05 -0.10 0.00 -1.58 0.00 0.00 32.23 31.17 2jow h LYS 50 CO 0.00 0.79 0.58 1.25 -1.08 0.00 0.00 179.45 180.99 2jow h LEU 51 N 0.59 0.76 0.16 2.94 6.46 -0.94 0.18 115.31 125.46 2jow h LEU 51 Ca 0.09 0.09 -0.28 0.00 -0.12 0.00 0.00 57.88 57.66 2jow h LEU 51 Cb 0.62 -0.05 0.03 0.00 -0.73 0.00 0.00 40.66 40.53 2jow h LEU 51 CO 0.04 0.31 -1.19 0.28 -0.62 0.00 0.00 178.44 177.27 2jow h SER 52 N 0.79 0.78 -0.52 1.25 0.02 -1.19 -3.17 113.55 111.50 2jow h SER 52 Ca 0.54 -0.87 0.03 0.00 -0.84 0.00 0.00 61.79 60.65 2jow h SER 52 Cb 0.76 -0.25 -0.03 0.00 0.14 0.00 0.00 62.40 63.02 2jow h SER 52 CO -0.35 1.58 0.35 -0.33 -1.14 0.00 0.00 176.83 176.93 2jow h GLU 53 N 0.09 0.56 -0.44 3.45 4.39 -0.01 0.61 114.58 123.23 2jow h GLU 53 Ca -0.19 -0.03 -0.12 0.00 0.34 0.00 0.00 59.36 59.36 2jow h GLU 53 Cb 1.90 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 30.41 2jow h GLU 53 CO 0.23 0.37 -0.19 -0.92 -1.16 0.00 0.00 179.01 177.33 2jow h TYR 54 N 0.58 0.97 0.00 4.33 3.20 -0.77 0.24 116.97 125.53 2jow h TYR 54 Ca 0.21 -0.22 -0.06 0.00 3.14 0.00 0.00 58.73 61.80 2jow h TYR 54 Cb 0.12 -0.23 -0.01 0.00 1.54 0.00 0.00 36.73 38.14 2jow h TYR 54 CO -0.00 0.98 -0.29 -0.97 -1.64 0.00 0.00 178.16 176.24 2jow h ASN 55 N 0.75 0.00 -0.12 -2.11 -0.73 -1.27 -1.80 115.58 110.31 2jow h ASN 55 Ca 0.11 0.00 -0.19 0.00 1.87 0.00 0.00 56.30 58.09 2jow h ASN 55 Cb 0.73 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.32 2jow h ASN 55 CO 0.06 0.29 -0.61 -0.07 -0.37 0.00 0.00 177.43 176.72 2jow h LEU 56 N 0.00 0.83 -0.73 0.34 4.07 -0.35 0.27 115.31 119.74 2jow h LEU 56 Ca -0.00 -0.47 0.09 0.00 0.08 0.00 0.00 57.88 57.58 2jow h LEU 56 Cb 0.76 -0.24 -0.07 0.00 1.08 0.00 0.00 40.66 42.18 2jow h LEU 56 CO 0.04 1.24 0.38 0.22 -1.08 0.00 0.00 178.44 179.24 2jow h TYR 57 N 0.54 0.69 -0.32 1.13 5.03 -0.33 0.11 116.97 123.82 2jow h TYR 57 Ca -0.01 0.03 -0.08 0.00 2.58 0.00 0.00 58.73 61.25 2jow h TYR 57 Cb 1.21 -0.20 -0.02 0.00 1.55 0.00 0.00 36.73 39.27 2jow h TYR 57 CO 0.07 0.26 -0.15 -0.09 -1.32 0.00 0.00 178.16 176.92 2jow h ARG 58 N 0.65 0.58 -0.27 1.82 9.65 -1.09 0.42 114.38 126.14 2jow h ARG 58 Ca 0.36 -0.19 -0.07 0.00 -1.10 0.00 0.00 59.98 58.98 2jow h ARG 58 Cb 0.36 -0.05 -0.01 0.00 -1.39 0.00 0.00 29.97 28.88 2jow h ARG 58 CO -0.26 0.71 -0.11 -0.97 2.80 0.00 0.00 179.97 182.14 2jow h ASN 59 N 0.52 0.57 -0.51 -3.80 -1.24 0.31 -1.65 115.58 109.78 2jow h ASN 59 Ca 0.09 -0.40 -0.01 0.00 0.71 0.00 0.00 56.30 56.69 2jow h ASN 59 Cb 0.57 -0.16 -0.02 0.00 0.73 0.00 0.00 38.32 39.44 2jow h ASN 59 CO 0.04 0.84 0.27 0.00 -1.29 0.00 0.00 177.43 177.29 2jow h ALA 60 N 0.75 0.66 -0.09 1.57 0.00 -0.94 -0.33 119.26 120.87 2jow h ALA 60 Ca 0.06 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.82 2jow h ALA 60 Cb 0.62 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 2jow h ALA 60 CO 0.04 0.19 0.07 0.94 0.00 0.00 0.00 179.25 180.48 2jow n GLN 61 N -4.63 1.12 0.00 0.00 -0.06 0.13 -1.56 117.38 112.39 2jow n GLN 61 Ca 0.02 -0.28 0.00 0.00 -2.00 0.00 0.00 57.00 54.75 2jow n GLN 61 Cb 0.10 -1.11 0.00 0.00 -4.06 0.00 0.00 30.24 25.17 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 0.67 0.52 -0.01 1.69 2.88 -0.63 -4.79 113.62 113.94 2jow n SER 62 Ca 0.05 0.00 -0.11 0.00 -1.33 0.00 0.00 58.87 57.48 2jow n SER 62 Cb 0.57 0.08 -0.09 0.00 -0.75 0.00 0.00 64.21 64.02 2jow n SER 62 CO 0.00 0.00 0.00 -1.13 -1.23 0.00 0.00 175.04 172.68 2jow h ASN 63 N 0.00 -0.07 -0.98 -3.46 -1.24 -0.04 -3.24 115.58 106.56 2jow h ASN 63 Ca 0.00 -0.58 0.17 0.00 0.71 0.00 0.00 56.30 56.60 2jow h ASN 63 Cb 0.05 0.02 -0.10 0.00 0.73 0.00 0.00 38.32 39.01 2jow h ASN 63 CO 0.00 0.63 0.58 0.00 -1.29 0.00 0.00 177.43 177.35 2jow h THR 64 N -0.84 0.75 -0.28 -3.57 1.03 -1.66 0.42 112.91 108.75 2jow h THR 64 Ca -0.01 -0.27 0.06 0.00 -0.01 0.00 0.00 66.41 66.19 2jow h THR 64 Cb 0.64 -0.10 -0.01 0.00 -1.07 0.00 0.00 68.15 67.60 2jow h THR 64 CO 0.01 0.14 0.20 0.58 -0.01 0.00 0.00 175.52 176.44 2jow h VAL 65 N 0.79 0.91 -0.70 0.00 2.07 -1.82 0.65 116.25 118.14 2jow h VAL 65 Ca 0.54 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 68.03 2jow h VAL 65 Cb 0.77 0.80 0.00 0.00 -1.52 0.00 0.00 31.29 31.35 2jow h VAL 65 CO -0.36 0.02 0.00 0.29 0.02 0.00 0.00 177.57 177.54 2jow n LYS 66 N -4.47 3.14 -0.03 1.57 4.01 0.07 -4.04 118.16 118.40 2jow n LYS 66 Ca 0.03 -2.75 -0.04 0.00 -0.51 0.00 0.00 58.31 55.04 2jow n LYS 66 Cb 0.29 -1.69 -0.04 0.00 -0.51 0.00 0.00 35.03 33.08 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 1.43 0.38 0.26 -0.18 0.31 -0.08 -4.36 118.33 116.08 2jow n VAL 67 Ca 0.25 -0.19 0.08 0.00 -0.01 0.00 0.00 64.34 64.48 2jow n VAL 67 Cb 0.73 -0.80 0.65 0.00 -0.91 0.00 0.00 33.84 33.51 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 -0.81 3.52 0.04 -1.14 0.17 116.94 118.72 2jow h PHE 68 Ca -0.15 0.00 0.17 0.00 2.80 0.00 0.00 57.97 60.80 2jow h PHE 68 Cb 1.28 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 39.38 2jow h PHE 68 CO 0.00 0.03 0.54 -0.22 -0.60 0.00 0.00 178.31 178.06 2jow h LYS 69 N 0.00 0.36 0.00 1.51 3.11 -1.76 -0.85 116.57 118.94 2jow h LYS 69 Ca -0.00 -0.02 -0.19 0.00 -2.81 0.00 0.00 60.65 57.63 2jow h LYS 69 Cb 0.05 -0.08 -0.03 0.00 -1.00 0.00 0.00 32.23 31.17 2jow h LYS 69 CO 0.00 0.24 -0.90 0.22 -2.81 0.00 0.00 179.45 176.21 2jow h ASP 70 N 0.37 0.00 -0.20 4.20 3.58 -0.85 0.11 116.42 123.62 2jow h ASP 70 Ca 0.40 0.00 -0.10 0.00 0.42 0.00 0.00 57.03 57.75 2jow h ASP 70 Cb 1.02 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 42.07 2jow h ASP 70 CO -0.13 0.90 -0.28 0.40 -2.88 0.00 0.00 179.24 177.25 2jow h ILE 71 N 0.00 1.33 -0.12 2.25 5.03 -1.25 -2.90 117.51 121.85 2jow h ILE 71 Ca -0.01 -1.48 -0.06 0.00 -0.12 0.00 0.00 64.86 63.19 2jow h ILE 71 Cb 1.68 1.81 -0.01 0.00 -3.03 0.00 0.00 36.82 37.26 2jow h ILE 71 CO 0.12 0.46 -0.22 -0.78 -0.68 0.00 0.00 178.15 177.04 2jow h ASP 72 N 0.22 0.19 -0.07 1.72 3.58 -1.09 -0.47 116.42 120.50 2jow h ASP 72 Ca 0.02 -0.05 -0.04 0.00 0.42 0.00 0.00 57.03 57.38 2jow h ASP 72 Cb 0.85 -0.05 -0.01 0.00 1.72 0.00 0.00 39.33 41.84 2jow h ASP 72 CO 0.07 0.42 -0.05 0.00 -2.88 0.00 0.00 179.24 176.79 2jow h ALA 73 N 1.60 1.54 -0.07 -0.78 0.00 -0.78 0.11 119.26 120.88 2jow h ALA 73 Ca 0.03 -0.17 -0.16 0.00 0.00 0.00 0.00 54.91 54.61 2jow h ALA 73 Cb 0.49 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 2jow h ALA 73 CO 0.03 0.33 -0.65 0.00 0.00 0.00 0.00 179.25 178.97 2jow h ALA 74 N 1.66 0.76 -0.62 0.00 0.00 -1.02 -1.34 119.26 118.70 2jow h ALA 74 Ca 0.07 -0.57 -0.05 0.00 0.00 0.00 0.00 54.91 54.35 2jow h ALA 74 Cb 0.29 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.97 2jow h ALA 74 CO 0.01 0.75 0.18 0.82 0.00 0.00 0.00 179.25 181.01 2jow h ILE 75 N 0.20 1.25 -0.07 0.00 2.04 -0.41 0.99 117.51 121.51 2jow h ILE 75 Ca -0.01 -0.87 0.03 0.00 1.00 0.00 0.00 64.86 65.00 2jow h ILE 75 Cb 1.18 0.63 -0.03 0.00 -0.74 0.00 0.00 36.82 37.86 2jow h ILE 75 CO 0.10 0.33 -0.11 -0.07 0.00 0.00 0.00 178.15 178.40 2jow h LEU 76 N 0.90 -0.34 -1.48 1.44 4.07 -0.77 -2.85 115.31 116.28 2jow h LEU 76 Ca 0.20 0.06 -0.03 0.00 0.08 0.00 0.00 57.88 58.19 2jow h LEU 76 Cb 0.32 0.16 -0.01 0.00 1.08 0.00 0.00 40.66 42.20 2jow h LEU 76 CO -0.00 -0.16 0.02 -0.08 -1.08 0.00 0.00 178.44 177.15 2jow h GLU 77 N -0.16 0.36 -0.02 1.13 4.57 -1.03 -2.52 114.58 116.91 2jow h GLU 77 Ca 0.06 -0.06 0.01 0.00 -1.18 0.00 0.00 59.36 58.20 2jow h GLU 77 Cb 0.25 -0.06 -0.00 0.00 -0.16 0.00 0.00 28.75 28.78 2jow h GLU 77 CO -0.16 0.37 0.11 1.25 -1.18 0.00 0.00 179.01 179.40 2jow h HIS 78 N 0.36 0.00 0.00 0.92 2.76 -0.55 -2.16 115.15 116.48 2jow h HIS 78 Ca 0.08 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.25 2jow h HIS 78 Cb 0.20 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.16 2jow h HIS 78 CO 0.00 0.00 0.00 0.72 -1.30 0.00 0.00 177.93 177.35 2jow n HIS 79 N -3.19 0.00 0.00 5.26 8.25 -1.07 -5.06 115.22 119.41 2jow n HIS 79 Ca -0.02 -0.32 0.00 0.00 -0.26 0.00 0.00 57.72 57.12 2jow n HIS 79 Cb 0.18 -0.03 0.00 0.00 1.12 0.00 0.00 29.99 31.26 2jow n HIS 79 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2jow n HIS 80 N -0.32 0.00 -3.74 4.41 -0.00 -0.82 -4.76 115.22 109.98 2jow n HIS 80 Ca 0.00 0.00 -0.09 0.00 -0.00 0.00 0.00 57.72 57.63 2jow n HIS 80 Cb 0.25 0.00 -0.03 0.00 -0.00 0.00 0.00 29.99 30.21 2jow n HIS 80 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 2jow s HIS 81 N 0.00 -0.13 0.69 4.41 2.46 -1.26 -4.85 115.29 116.61 2jow s HIS 81 Ca 0.00 -0.22 -0.17 0.00 0.47 0.00 0.00 55.06 55.15 2jow s HIS 81 Cb 0.00 0.43 0.01 0.00 -0.13 0.00 0.00 32.58 32.90 2jow s HIS 81 CO 0.00 -0.95 1.26 -1.58 -2.47 0.00 0.00 174.74 170.99 2jow s HIS 82 N -3.88 2.04 0.00 3.88 2.46 -1.26 -5.14 115.29 113.39 2jow s HIS 82 Ca 0.09 1.54 0.00 0.00 0.47 0.00 0.00 55.06 57.17 2jow s HIS 82 Cb -0.02 -3.60 0.00 0.00 -0.13 0.00 0.00 32.58 28.83 2jow s HIS 82 CO -0.02 -2.81 0.00 1.58 -2.47 0.00 0.00 174.74 171.03