#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wiv s SER 2 N 0.00 -0.21 -0.09 1.61 0.01 -1.26 -5.09 113.70 108.67 1wiv s SER 2 Ca 0.00 -0.43 -0.11 0.00 1.31 0.00 0.00 55.95 56.72 1wiv s SER 2 Cb 0.00 0.54 -0.04 0.00 0.21 0.00 0.00 66.02 66.73 1wiv s SER 2 CO 0.00 -0.99 -0.22 -0.24 0.41 0.00 0.00 173.24 172.20 1wiv n SER 3 N -0.46 1.58 0.00 2.44 2.88 -1.26 -5.13 113.62 113.67 1wiv n SER 3 Ca -0.06 0.25 0.00 0.00 -1.33 0.00 0.00 58.87 57.73 1wiv n SER 3 Cb 0.60 -0.58 0.00 0.00 -0.75 0.00 0.00 64.21 63.48 1wiv n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wiv n GLY 4 N 2.17 -1.70 3.33 0.46 0.00 -1.26 -4.94 105.19 103.24 1wiv n GLY 4 Ca -0.13 -1.59 -0.33 0.00 0.00 0.00 0.00 46.02 43.97 1wiv n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1wiv n SER 5 N 0.09 -2.46 0.06 1.61 3.41 -1.26 -4.88 113.62 110.20 1wiv n SER 5 Ca 0.00 0.14 0.00 0.00 -0.26 0.00 0.00 58.87 58.75 1wiv n SER 5 Cb 0.00 -1.06 0.00 0.00 -0.26 0.00 0.00 64.21 62.89 1wiv n SER 5 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 1wiv n SER 6 N -1.02 -1.15 -4.08 4.04 2.88 -1.26 -5.10 113.62 107.92 1wiv n SER 6 Ca 0.04 0.58 -0.58 0.00 -1.33 0.00 0.00 58.87 57.58 1wiv n SER 6 Cb 0.58 1.41 -0.11 0.00 -0.75 0.00 0.00 64.21 65.34 1wiv n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wiv n GLY 7 N -1.14 -0.09 3.37 0.46 0.00 -1.26 -4.88 105.19 101.65 1wiv n GLY 7 Ca 0.00 1.04 -0.37 0.00 0.00 0.00 0.00 46.02 46.69 1wiv n GLY 7 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1wiv s LEU 8 N 5.25 3.80 0.03 0.99 2.34 -1.26 -5.08 118.68 124.76 1wiv s LEU 8 Ca 1.11 -0.60 0.02 0.00 0.06 0.00 0.00 54.13 54.72 1wiv s LEU 8 Cb -1.42 -1.90 -0.02 0.00 -0.56 0.00 0.00 46.19 42.29 1wiv s LEU 8 CO 0.65 -0.17 -0.07 -0.76 -1.06 0.00 0.00 176.35 174.94 1wiv s LEU 9 N 1.53 2.22 0.24 1.48 1.02 -1.26 -5.16 118.68 118.75 1wiv s LEU 9 Ca 0.03 -0.48 0.08 0.00 0.02 0.00 0.00 54.13 53.79 1wiv s LEU 9 Cb -0.17 -0.15 -0.04 0.00 0.02 0.00 0.00 46.19 45.85 1wiv s LEU 9 CO 0.03 -0.17 0.05 -0.44 0.02 0.00 0.00 176.35 175.84 1wiv s SER 10 N -1.35 4.87 -0.09 2.29 0.01 -1.26 -5.07 113.70 113.10 1wiv s SER 10 Ca -0.09 -0.48 -0.03 0.00 1.31 0.00 0.00 55.95 56.66 1wiv s SER 10 Cb -0.09 -1.04 -0.01 0.00 0.21 0.00 0.00 66.02 65.10 1wiv s SER 10 CO 0.00 0.01 -0.05 0.45 0.41 0.00 0.00 173.24 174.06 1wiv h HIS 11 N 1.93 0.00 -0.36 2.43 3.86 -2.06 -3.47 115.15 117.49 1wiv h HIS 11 Ca -0.46 0.00 0.02 0.00 -1.16 0.00 0.00 60.37 58.77 1wiv h HIS 11 Cb 1.24 0.00 -0.16 0.00 1.06 0.00 0.00 27.41 29.54 1wiv h HIS 11 CO 0.64 0.00 -0.19 1.41 0.86 0.00 0.00 177.93 180.65 1wiv s MET 12 N -1.66 0.35 0.46 2.45 1.75 -1.26 -5.15 119.30 116.25 1wiv s MET 12 Ca -0.04 -0.27 0.00 0.00 -1.25 0.00 0.00 55.69 54.13 1wiv s MET 12 Cb 0.01 0.00 0.00 0.00 2.84 0.00 0.00 34.83 37.68 1wiv s MET 12 CO 0.06 -0.45 0.00 -0.25 -0.65 0.00 0.00 175.02 173.73 1wiv n ASP 13 N 3.11 -7.44 -4.75 1.11 8.00 -1.26 -4.76 116.55 110.57 1wiv n ASP 13 Ca 0.10 1.00 -0.38 0.00 0.71 0.00 0.00 54.79 56.23 1wiv n ASP 13 Cb 0.63 -4.39 -0.06 0.00 -0.02 0.00 0.00 41.12 37.28 1wiv n ASP 13 CO 0.00 0.00 0.00 1.51 -0.39 0.00 0.00 177.20 178.32 1wiv s ASP 14 N -6.76 6.71 0.18 -2.24 -4.77 -1.26 -4.95 116.67 103.58 1wiv s ASP 14 Ca 0.00 0.85 0.24 0.00 -3.30 0.00 0.00 52.55 50.34 1wiv s ASP 14 Cb 0.00 -2.28 0.91 0.00 -1.09 0.00 0.00 42.92 40.46 1wiv s ASP 14 CO 0.00 0.09 1.73 -0.81 0.70 0.00 0.00 175.17 176.88 1wiv n PRO 15 N 3.18 0.17 0.00 2.11 -0.04 -1.26 -4.85 135.00 134.31 1wiv n PRO 15 Ca -0.09 0.27 0.00 0.00 -0.04 0.00 0.00 63.50 63.64 1wiv n PRO 15 Cb 0.52 -1.76 0.00 0.00 -0.04 0.00 0.00 33.50 32.22 1wiv n PRO 15 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1wiv n ASP 16 N -2.07 0.00 0.00 3.54 9.92 -1.26 -5.18 116.55 121.50 1wiv n ASP 16 Ca 0.04 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.30 1wiv n ASP 16 Cb 0.31 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.79 1wiv n ASP 16 CO 0.00 0.00 0.00 -0.38 0.13 0.00 0.00 177.20 176.95 1wiv n ILE 17 N 0.00 0.00 -2.69 0.53 5.41 -1.26 -5.03 119.36 116.32 1wiv n ILE 17 Ca 0.00 0.00 -0.39 0.00 1.00 0.00 0.00 62.75 63.36 1wiv n ILE 17 Cb 0.00 0.00 0.01 0.00 -0.71 0.00 0.00 39.64 38.94 1wiv n ILE 17 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 1wiv n ASP 18 N 0.00 6.86 -3.00 4.38 -0.08 -1.26 -4.77 116.55 118.68 1wiv n ASP 18 Ca 0.00 -3.69 0.02 0.00 -1.51 0.00 0.00 54.79 49.61 1wiv n ASP 18 Cb 0.00 -1.06 -0.00 0.00 2.34 0.00 0.00 41.12 42.40 1wiv n ASP 18 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1wiv s ALA 19 N -4.19 -3.47 -0.46 -1.67 0.00 -1.26 -5.04 121.76 105.68 1wiv s ALA 19 Ca 0.41 0.87 -0.06 0.00 0.00 0.00 0.00 51.96 53.18 1wiv s ALA 19 Cb 0.21 -2.86 -0.15 0.00 0.00 0.00 0.00 23.12 20.32 1wiv s ALA 19 CO -0.13 -2.30 2.71 -0.35 0.00 0.00 0.00 175.76 175.68 1wiv n PRO 20 N 4.25 1.98 -1.63 0.00 -0.04 -1.26 -4.79 135.00 133.50 1wiv n PRO 20 Ca 0.08 -1.13 0.00 0.00 -0.04 0.00 0.00 63.50 62.40 1wiv n PRO 20 Cb 0.60 -2.15 0.00 0.00 -0.04 0.00 0.00 33.50 31.91 1wiv n PRO 20 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 1wiv n ILE 21 N 3.12 -5.26 -3.99 0.52 5.41 -1.26 -4.97 119.36 112.93 1wiv n ILE 21 Ca 0.42 2.37 -0.31 0.00 1.00 0.00 0.00 62.75 66.23 1wiv n ILE 21 Cb 0.49 -3.22 -0.05 0.00 -0.71 0.00 0.00 39.64 36.15 1wiv n ILE 21 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 176.55 176.11 1wiv s SER 22 N -2.50 5.97 -0.30 4.38 0.01 -1.26 -5.10 113.70 114.91 1wiv s SER 22 Ca 0.00 0.16 -0.16 0.00 1.31 0.00 0.00 55.95 57.26 1wiv s SER 22 Cb 0.00 -1.75 0.17 0.00 0.21 0.00 0.00 66.02 64.65 1wiv s SER 22 CO 0.00 0.19 1.05 -2.28 0.41 0.00 0.00 173.24 172.61 1wiv s HIS 23 N -1.41 -0.50 0.06 2.43 5.04 -1.26 -5.06 115.29 114.58 1wiv s HIS 23 Ca 0.31 0.93 -0.27 0.00 -1.54 0.00 0.00 55.06 54.49 1wiv s HIS 23 Cb -0.13 0.30 0.09 0.00 0.04 0.00 0.00 32.58 32.89 1wiv s HIS 23 CO 0.23 -0.25 1.19 1.14 -2.34 0.00 0.00 174.74 174.71 1wiv s GLN 24 N 1.84 0.72 0.25 2.88 1.03 -1.26 -5.13 119.66 119.99 1wiv s GLN 24 Ca -0.05 -0.44 0.10 0.00 0.04 0.00 0.00 55.36 55.00 1wiv s GLN 24 Cb -0.04 0.22 -0.04 0.00 0.03 0.00 0.00 33.01 33.17 1wiv s GLN 24 CO -0.15 -0.33 -0.05 0.99 -2.54 0.00 0.00 175.29 173.20 1wiv s THR 25 N -2.33 3.27 0.00 3.63 2.01 -1.26 -4.23 115.64 116.73 1wiv s THR 25 Ca 0.21 -1.91 0.00 0.00 0.31 0.00 0.00 61.69 60.30 1wiv s THR 25 Cb 0.01 -2.72 0.00 0.00 0.01 0.00 0.00 72.50 69.80 1wiv s THR 25 CO 0.00 -0.31 0.00 -1.20 -0.69 0.00 0.00 174.62 172.42 1wiv n SER 26 N -0.63 -4.97 -1.26 3.53 7.64 -1.26 -4.82 113.62 111.85 1wiv n SER 26 Ca -0.07 0.00 -0.15 0.00 1.01 0.00 0.00 58.87 59.66 1wiv n SER 26 Cb 0.58 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.72 1wiv n SER 26 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1wiv n ASP 27 N -2.44 -4.84 -4.40 6.43 8.00 -1.26 -4.76 116.55 113.28 1wiv n ASP 27 Ca 0.00 0.37 -0.50 0.00 0.71 0.00 0.00 54.79 55.37 1wiv n ASP 27 Cb 0.00 -4.07 -0.11 0.00 -0.02 0.00 0.00 41.12 36.92 1wiv n ASP 27 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 1wiv n ILE 28 N -2.12 0.04 -1.44 0.53 5.41 -1.26 -4.77 119.36 115.74 1wiv n ILE 28 Ca -0.15 -0.13 -0.41 0.00 1.00 0.00 0.00 62.75 63.06 1wiv n ILE 28 Cb 0.57 -0.96 0.01 0.00 -0.71 0.00 0.00 39.64 38.55 1wiv n ILE 28 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 1wiv n ASP 29 N 9.67 -1.08 0.14 4.38 8.00 -1.26 -4.86 116.55 131.54 1wiv n ASP 29 Ca 0.54 0.89 0.07 0.00 0.71 0.00 0.00 54.79 57.00 1wiv n ASP 29 Cb 0.09 -1.09 0.05 0.00 -0.02 0.00 0.00 41.12 40.15 1wiv n ASP 29 CO 0.00 0.00 0.00 -0.61 -0.39 0.00 0.00 177.20 176.20 1wiv h GLN 30 N 0.73 0.00 -0.00 -1.24 5.75 -2.00 -3.05 115.11 115.30 1wiv h GLN 30 Ca -0.40 0.00 -0.22 0.00 -0.15 0.00 0.00 58.65 57.88 1wiv h GLN 30 Cb 1.40 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.95 1wiv h GLN 30 CO 0.51 0.22 -0.93 1.03 -2.65 0.00 0.00 178.83 177.01 1wiv h SER 31 N 0.00 0.52 0.24 -0.69 0.87 -1.99 -3.01 113.55 109.48 1wiv h SER 31 Ca -0.03 -0.41 -0.01 0.00 -1.23 0.00 0.00 61.79 60.11 1wiv h SER 31 Cb 1.22 -0.16 0.00 0.00 -0.44 0.00 0.00 62.40 63.02 1wiv h SER 31 CO 0.03 1.21 -0.11 0.28 -0.53 0.00 0.00 176.83 177.70 1wiv h SER 32 N 0.23 -0.27 -1.07 6.23 0.02 -1.93 0.59 113.55 117.34 1wiv h SER 32 Ca -0.07 -0.25 0.29 0.00 -0.84 0.00 0.00 61.79 60.92 1wiv h SER 32 Cb 1.56 0.07 -0.11 0.00 0.14 0.00 0.00 62.40 64.06 1wiv h SER 32 CO 0.16 0.16 0.66 0.58 -1.14 0.00 0.00 176.83 177.25 1wiv h VAL 33 N -0.77 0.44 0.01 2.27 2.07 -1.62 1.33 116.25 119.97 1wiv h VAL 33 Ca -0.03 -0.13 -0.21 0.00 0.82 0.00 0.00 66.70 67.14 1wiv h VAL 33 Cb 0.50 0.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.29 1wiv h VAL 33 CO 0.05 0.07 -0.93 -0.78 0.02 0.00 0.00 177.57 176.01 1wiv h ASP 34 N 0.38 0.36 -0.02 0.57 3.58 -1.39 -2.58 116.42 117.32 1wiv h ASP 34 Ca 0.66 -0.30 0.01 0.00 0.42 0.00 0.00 57.03 57.81 1wiv h ASP 34 Cb 1.62 -0.11 -0.00 0.00 1.72 0.00 0.00 39.33 42.56 1wiv h ASP 34 CO -0.40 1.11 0.03 0.74 -2.88 0.00 0.00 179.24 177.84 1wiv h THR 35 N 0.15 0.41 0.00 2.25 2.02 0.41 0.24 112.91 118.39 1wiv h THR 35 Ca -0.06 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.12 1wiv h THR 35 Cb 1.57 0.98 0.00 0.00 -1.74 0.00 0.00 68.15 68.95 1wiv h THR 35 CO 0.15 0.00 -1.32 0.18 0.37 0.00 0.00 175.52 174.90 1wiv n LEU 36 N -3.68 0.50 -0.12 2.58 4.77 -0.43 -3.60 117.00 117.01 1wiv n LEU 36 Ca -0.03 -0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.84 1wiv n LEU 36 Cb 0.11 -0.05 -0.03 0.00 -2.33 0.00 0.00 43.42 41.12 1wiv n LEU 36 CO 0.26 0.01 0.73 -0.07 -1.33 0.00 0.00 177.39 176.99 1wiv h LEU 37 N 0.00 0.67 -0.06 2.23 3.38 -0.13 -1.86 115.31 119.53 1wiv h LEU 37 Ca 0.00 -0.35 -0.03 0.00 0.09 0.00 0.00 57.88 57.58 1wiv h LEU 37 Cb 0.83 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.40 1wiv h LEU 37 CO 0.00 0.86 -0.10 0.28 0.09 0.00 0.00 178.44 179.58 1wiv h SER 38 N 0.46 0.19 -0.89 -0.43 0.02 -1.60 -3.27 113.55 108.02 1wiv h SER 38 Ca 0.09 -0.54 0.13 0.00 -0.84 0.00 0.00 61.79 60.64 1wiv h SER 38 Cb 0.56 -0.05 -0.14 0.00 0.14 0.00 0.00 62.40 62.90 1wiv h SER 38 CO 0.03 0.69 -0.40 -0.26 -1.14 0.00 0.00 176.83 175.75 1wiv h PHE 39 N -0.30 -1.16 0.00 3.45 -1.00 -1.61 -3.44 116.94 112.88 1wiv h PHE 39 Ca 0.01 0.10 0.00 0.00 2.81 0.00 0.00 57.97 60.89 1wiv h PHE 39 Cb 0.65 0.64 0.00 0.00 3.61 0.00 0.00 35.95 40.85 1wiv h PHE 39 CO 0.11 -0.40 0.00 0.41 -1.61 0.00 0.00 178.31 176.82 1wiv n GLY 40 N -1.44 -0.09 3.05 -1.45 0.00 -1.07 -5.12 105.19 99.08 1wiv n GLY 40 Ca 0.08 -0.02 -0.08 0.00 0.00 0.00 0.00 46.02 46.00 1wiv n GLY 40 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1wiv s PHE 41 N 0.00 0.36 0.50 1.61 0.08 -0.72 -5.05 117.98 114.76 1wiv s PHE 41 Ca 0.00 -0.76 -0.20 0.00 0.12 0.00 0.00 56.93 56.10 1wiv s PHE 41 Cb 0.00 -0.27 -0.08 0.00 -0.57 0.00 0.00 43.02 42.10 1wiv s PHE 41 CO 0.00 -0.30 1.04 0.00 -0.10 0.00 0.00 175.22 175.86 1wiv s ALA 42 N -2.72 2.85 0.44 5.36 0.00 -1.26 -4.24 121.76 122.19 1wiv s ALA 42 Ca -0.04 0.59 0.12 0.00 0.00 0.00 0.00 51.96 52.63 1wiv s ALA 42 Cb -0.01 -3.25 1.01 0.00 0.00 0.00 0.00 23.12 20.87 1wiv s ALA 42 CO -0.06 -0.38 2.01 1.49 0.00 0.00 0.00 175.76 178.82 1wiv h GLU 43 N 1.41 0.40 0.22 0.00 4.81 -1.94 1.29 114.58 120.76 1wiv h GLU 43 Ca -0.49 -0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 58.70 1wiv h GLU 43 Cb 1.22 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.51 1wiv h GLU 43 CO 0.59 0.26 -0.10 0.22 -0.73 0.00 0.00 179.01 179.25 1wiv h ASP 44 N 0.41 -0.25 -0.10 1.04 3.58 -1.97 -2.42 116.42 116.72 1wiv h ASP 44 Ca 0.22 -0.20 -0.10 0.00 0.42 0.00 0.00 57.03 57.38 1wiv h ASP 44 Cb 0.36 0.06 -0.01 0.00 1.72 0.00 0.00 39.33 41.46 1wiv h ASP 44 CO -0.06 0.08 -0.23 0.58 -2.88 0.00 0.00 179.24 176.73 1wiv h VAL 45 N -0.59 1.26 -0.61 2.25 2.07 -1.74 -0.35 116.25 118.54 1wiv h VAL 45 Ca -0.03 -1.25 0.15 0.00 0.82 0.00 0.00 66.70 66.39 1wiv h VAL 45 Cb 0.43 1.30 -0.03 0.00 -1.52 0.00 0.00 31.29 31.48 1wiv h VAL 45 CO 0.05 0.40 0.43 0.00 0.02 0.00 0.00 177.57 178.47 1wiv h ALA 46 N 1.29 2.33 0.11 1.67 0.00 0.18 0.24 119.26 125.07 1wiv h ALA 46 Ca 0.07 -0.01 -0.30 0.00 0.00 0.00 0.00 54.91 54.67 1wiv h ALA 46 Cb 0.66 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 1wiv h ALA 46 CO 0.05 -0.50 -1.59 0.00 0.00 0.00 0.00 179.25 177.22 1wiv h ARG 47 N 0.18 0.23 -0.41 0.00 3.08 -0.88 -3.11 114.38 113.47 1wiv h ARG 47 Ca 0.29 -0.39 0.08 0.00 0.07 0.00 0.00 59.98 60.04 1wiv h ARG 47 Cb 0.92 0.14 -0.07 0.00 0.08 0.00 0.00 29.97 31.04 1wiv h ARG 47 CO -0.05 1.18 -0.04 0.87 -1.07 0.00 0.00 179.97 180.86 1wiv h LYS 48 N -0.27 0.06 -0.21 0.04 1.57 -0.06 1.26 116.57 118.96 1wiv h LYS 48 Ca -0.35 -0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.38 1wiv h LYS 48 Cb 1.80 -0.01 -0.01 0.00 0.08 0.00 0.00 32.23 34.08 1wiv h LYS 48 CO 0.04 0.04 -0.09 0.00 -0.57 0.00 0.00 179.45 178.87 1wiv h ALA 49 N 1.38 1.46 -0.08 3.86 0.00 -0.73 0.96 119.26 126.11 1wiv h ALA 49 Ca 0.20 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1wiv h ALA 49 Cb 0.30 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1wiv h ALA 49 CO -0.38 0.38 0.00 1.28 0.00 0.00 0.00 179.25 180.53 1wiv n LEU 50 N -4.28 1.12 -0.10 0.00 4.77 0.74 -1.35 117.00 117.90 1wiv n LEU 50 Ca -0.00 -0.44 -0.22 0.00 -0.03 0.00 0.00 56.01 55.32 1wiv n LEU 50 Cb 0.26 -0.05 -0.12 0.00 -2.33 0.00 0.00 43.42 41.18 1wiv n LEU 50 CO 0.38 0.22 -1.18 1.17 -1.33 0.00 0.00 177.39 176.66 1wiv n LYS 51 N -0.07 0.65 0.06 3.23 4.81 0.40 -2.99 118.16 124.26 1wiv n LYS 51 Ca 0.17 0.24 -0.22 0.00 -0.87 0.00 0.00 58.31 57.63 1wiv n LYS 51 Cb 0.26 -1.58 -0.15 0.00 0.02 0.00 0.00 35.03 33.58 1wiv n LYS 51 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1wiv h ALA 52 N -0.24 0.22 -0.27 3.14 0.00 -1.39 -3.35 119.26 117.35 1wiv h ALA 52 Ca -0.55 -1.17 -0.11 0.00 0.00 0.00 0.00 54.91 53.07 1wiv h ALA 52 Cb 1.82 0.46 -0.00 0.00 0.00 0.00 0.00 17.79 20.06 1wiv h ALA 52 CO -0.13 1.09 -0.27 0.77 0.00 0.00 0.00 179.25 180.70 1wiv h SER 53 N 0.10 0.71 -2.27 0.00 0.02 -1.44 -3.49 113.55 107.17 1wiv h SER 53 Ca -0.34 -0.47 0.00 0.00 -0.84 0.00 0.00 61.79 60.14 1wiv h SER 53 Cb 2.08 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 64.42 1wiv h SER 53 CO 0.16 1.04 0.00 0.61 -1.14 0.00 0.00 176.83 177.50 1wiv n GLY 54 N 0.17 -2.19 4.12 -3.77 0.00 -1.18 -4.55 105.19 97.79 1wiv n GLY 54 Ca -0.04 -0.39 -0.29 0.00 0.00 0.00 0.00 46.02 45.30 1wiv n GLY 54 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wiv n GLY 55 N 0.03 -0.16 2.62 -0.02 0.00 -1.16 -4.66 105.19 101.84 1wiv n GLY 55 Ca 0.00 0.17 -0.27 0.00 0.00 0.00 0.00 46.02 45.92 1wiv n GLY 55 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1wiv s ASP 56 N -4.19 2.64 -0.00 1.61 1.01 -1.26 -5.02 116.67 111.45 1wiv s ASP 56 Ca 0.04 -0.77 -0.25 0.00 0.71 0.00 0.00 52.55 52.28 1wiv s ASP 56 Cb -0.02 -0.32 -0.18 0.00 1.01 0.00 0.00 42.92 43.40 1wiv s ASP 56 CO 0.89 -0.36 1.26 0.40 0.21 0.00 0.00 175.17 177.58 1wiv h ILE 57 N 6.43 1.06 -0.80 0.77 1.08 -1.94 0.94 117.51 125.06 1wiv h ILE 57 Ca -0.16 -0.85 0.16 0.00 -0.39 0.00 0.00 64.86 63.62 1wiv h ILE 57 Cb 1.12 1.59 -0.10 0.00 -3.07 0.00 0.00 36.82 36.36 1wiv h ILE 57 CO 0.32 0.20 0.33 -0.33 -0.69 0.00 0.00 178.15 177.98 1wiv h GLU 58 N -0.57 0.44 -0.01 2.37 5.08 -1.98 1.48 114.58 121.39 1wiv h GLU 58 Ca -0.02 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.29 1wiv h GLU 58 Cb 0.45 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.60 1wiv h GLU 58 CO 0.03 0.29 -0.09 0.87 -1.00 0.00 0.00 179.01 179.11 1wiv h LYS 59 N 0.46 0.08 -0.64 2.33 1.57 -1.93 -3.19 116.57 115.25 1wiv h LYS 59 Ca 0.45 -0.07 0.10 0.00 -1.87 0.00 0.00 60.65 59.26 1wiv h LYS 59 Cb 0.71 0.02 -0.08 0.00 0.08 0.00 0.00 32.23 32.96 1wiv h LYS 59 CO -0.43 0.78 0.23 0.00 -0.57 0.00 0.00 179.45 179.46 1wiv h ALA 60 N 0.30 0.83 -0.11 3.86 0.00 0.19 0.64 119.26 124.97 1wiv h ALA 60 Ca -0.01 0.09 0.03 0.00 0.00 0.00 0.00 54.91 55.03 1wiv h ALA 60 Cb 0.80 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.66 1wiv h ALA 60 CO 0.02 -0.20 0.27 1.15 0.00 0.00 0.00 179.25 180.48 1wiv h THR 61 N 0.40 0.17 0.00 0.00 2.02 0.20 -0.85 112.91 114.86 1wiv h THR 61 Ca 0.33 0.00 -0.20 0.00 0.77 0.00 0.00 66.41 67.31 1wiv h THR 61 Cb 0.43 0.76 -0.03 0.00 -1.74 0.00 0.00 68.15 67.57 1wiv h THR 61 CO -0.34 0.00 -1.08 -0.78 0.37 0.00 0.00 175.52 173.69 1wiv h ASP 62 N 0.00 0.01 -0.76 4.18 3.58 0.18 -3.36 116.42 120.25 1wiv h ASP 62 Ca 0.05 -0.60 0.16 0.00 0.42 0.00 0.00 57.03 57.07 1wiv h ASP 62 Cb 0.59 -0.00 -0.14 0.00 1.72 0.00 0.00 39.33 41.49 1wiv h ASP 62 CO -0.00 1.42 -0.15 -0.25 -2.88 0.00 0.00 179.24 177.38 1wiv h TRP 63 N -0.97 -0.34 -1.02 0.28 7.01 0.41 1.82 115.95 123.14 1wiv h TRP 63 Ca -0.30 0.07 0.34 0.00 2.11 0.00 0.00 58.89 61.11 1wiv h TRP 63 Cb 1.28 0.27 -0.15 0.00 -2.10 0.00 0.00 29.16 28.45 1wiv h TRP 63 CO 0.13 -0.31 0.58 0.28 -2.79 0.00 0.00 178.44 176.32 1wiv h VAL 64 N 0.02 0.26 0.00 2.65 2.07 -1.37 0.58 116.25 120.45 1wiv h VAL 64 Ca 0.38 -0.09 -0.07 0.00 0.82 0.00 0.00 66.70 67.73 1wiv h VAL 64 Cb 0.60 -0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.32 1wiv h VAL 64 CO -0.76 0.05 -0.69 -0.26 0.02 0.00 0.00 177.57 175.93 1wiv h PHE 65 N 0.28 0.00 -0.98 1.57 0.04 0.18 -3.38 116.94 114.65 1wiv h PHE 65 Ca 0.75 0.00 0.18 0.00 2.80 0.00 0.00 57.97 61.70 1wiv h PHE 65 Cb 1.78 0.00 -0.18 0.00 2.20 0.00 0.00 35.95 39.76 1wiv h PHE 65 CO -0.01 0.46 -0.29 -0.91 -0.60 0.00 0.00 178.31 176.95 1wiv h ASN 66 N -1.00 -1.09 -3.57 2.17 2.35 0.27 -3.21 115.58 111.50 1wiv h ASN 66 Ca -0.10 0.30 -0.70 0.00 -0.55 0.00 0.00 56.30 55.24 1wiv h ASN 66 Cb 0.72 0.65 -0.30 0.00 0.05 0.00 0.00 38.32 39.45 1wiv h ASN 66 CO -0.06 -0.31 -0.55 0.20 -1.65 0.00 0.00 177.43 175.05 1wiv s ASN 67 N -5.29 5.39 -0.08 5.81 0.01 0.20 -5.04 114.94 115.95 1wiv s ASN 67 Ca -0.15 -1.43 -0.09 0.00 -0.71 0.00 0.00 52.86 50.49 1wiv s ASN 67 Cb 0.24 -1.89 0.02 0.00 0.41 0.00 0.00 41.25 40.03 1wiv s ASN 67 CO 0.76 -0.43 0.25 -0.55 -1.51 0.00 0.00 177.10 175.61 1wiv s SER 68 N 1.73 -0.23 0.48 -1.22 0.15 -1.22 -4.50 113.70 108.90 1wiv s SER 68 Ca 0.01 0.39 0.03 0.00 0.70 0.00 0.00 55.95 57.09 1wiv s SER 68 Cb -0.21 0.47 0.08 0.00 -1.71 0.00 0.00 66.02 64.64 1wiv s SER 68 CO 0.01 -0.15 0.57 0.61 1.20 0.00 0.00 173.24 175.48 1wiv n GLY 69 N 2.62 1.41 3.78 9.45 0.00 -1.26 -5.08 105.19 116.10 1wiv n GLY 69 Ca -0.15 -2.11 -0.37 0.00 0.00 0.00 0.00 46.02 43.39 1wiv n GLY 69 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wiv s PRO 70 N -3.88 4.25 -0.26 1.61 0.04 -1.26 -5.04 135.00 130.45 1wiv s PRO 70 Ca 0.41 1.57 0.02 0.00 0.04 0.00 0.00 61.00 63.03 1wiv s PRO 70 Cb -0.03 -2.67 0.07 0.00 0.04 0.00 0.00 34.50 31.92 1wiv s PRO 70 CO 0.26 -0.08 -0.03 0.45 0.04 0.00 0.00 177.00 177.64 1wiv s SER 71 N -1.43 4.13 -0.13 6.66 0.15 -1.26 -4.93 113.70 116.89 1wiv s SER 71 Ca 0.55 -1.42 -0.09 0.00 0.70 0.00 0.00 55.95 55.69 1wiv s SER 71 Cb -0.24 -1.29 0.04 0.00 -1.71 0.00 0.00 66.02 62.81 1wiv s SER 71 CO 0.30 -0.27 0.18 -0.24 1.20 0.00 0.00 173.24 174.42 1wiv n SER 72 N 4.57 -1.05 0.00 5.45 2.88 -1.26 -5.36 113.62 118.86 1wiv n SER 72 Ca -0.09 1.03 0.00 0.00 -1.33 0.00 0.00 58.87 58.49 1wiv n SER 72 Cb 0.43 -4.21 0.00 0.00 -0.75 0.00 0.00 64.21 59.68 1wiv n SER 72 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42