#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cwj n PRO 5 N 0.00 1.53 -4.04 0.00 -0.02 -1.26 -4.72 135.00 126.48 2cwj n PRO 5 Ca 0.00 0.54 -0.31 0.00 -2.02 0.00 0.00 63.50 61.71 2cwj n PRO 5 Cb 0.00 -2.12 -0.15 0.00 -0.02 0.00 0.00 33.50 31.21 2cwj n PRO 5 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2cwj s LYS 6 N -0.32 1.77 0.17 -0.52 1.02 -1.26 -5.09 119.74 115.51 2cwj s LYS 6 Ca 0.72 -1.67 -0.27 0.00 0.02 0.00 0.00 55.97 54.77 2cwj s LYS 6 Cb -0.77 -3.08 -0.16 0.00 -0.52 0.00 0.00 37.83 33.30 2cwj s LYS 6 CO 0.51 -0.80 0.53 -0.35 -0.92 0.00 0.00 175.35 174.32 2cwj n PRO 7 N 4.32 0.00 -3.95 -1.68 -0.04 -1.26 -4.94 135.00 127.45 2cwj n PRO 7 Ca -0.03 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.12 2cwj n PRO 7 Cb 0.42 -0.97 -0.15 0.00 -0.04 0.00 0.00 33.50 32.75 2cwj n PRO 7 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2cwj s VAL 8 N -0.87 1.62 0.00 0.52 0.11 -1.26 -5.01 120.40 115.51 2cwj s VAL 8 Ca 0.62 -1.37 0.00 0.00 -2.93 0.00 0.00 61.98 58.30 2cwj s VAL 8 Cb -0.90 -1.91 0.00 0.00 -1.53 0.00 0.00 36.38 32.04 2cwj s VAL 8 CO 0.53 -0.17 0.00 0.61 -3.33 0.00 0.00 175.10 172.73 2cwj n GLY 9 N 4.62 0.28 2.33 6.54 0.00 -1.26 -4.78 105.19 112.92 2cwj n GLY 9 Ca -0.10 -1.28 -0.30 0.00 0.00 0.00 0.00 46.02 44.34 2cwj n GLY 9 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2cwj n PRO 10 N 0.00 3.21 -3.99 1.61 -0.05 -1.26 -5.04 135.00 129.48 2cwj n PRO 10 Ca 0.00 -3.92 -0.09 0.00 -0.05 0.00 0.00 63.50 59.45 2cwj n PRO 10 Cb 0.00 -2.27 -0.08 0.00 -0.05 0.00 0.00 33.50 31.09 2cwj n PRO 10 CO 0.00 0.00 0.00 1.52 -0.05 0.00 0.00 175.50 176.97 2cwj s TYR 11 N -3.72 0.41 -0.13 0.54 -0.85 -1.26 -5.14 117.35 107.20 2cwj s TYR 11 Ca 0.54 -0.85 -0.03 0.00 -0.52 0.00 0.00 57.07 56.21 2cwj s TYR 11 Cb 0.44 -0.21 -0.03 0.00 0.38 0.00 0.00 41.96 42.54 2cwj s TYR 11 CO -0.09 -0.54 -0.02 -1.12 -1.52 0.00 0.00 175.55 172.26 2cwj s SER 12 N -2.93 4.98 0.00 -0.18 0.01 -1.26 -4.73 113.70 109.60 2cwj s SER 12 Ca 0.11 -0.03 0.00 0.00 1.31 0.00 0.00 55.95 57.35 2cwj s SER 12 Cb 0.06 -1.66 0.00 0.00 0.21 0.00 0.00 66.02 64.63 2cwj s SER 12 CO -0.06 0.24 0.43 0.00 0.41 0.00 0.00 173.24 174.26 2cwj n GLN 13 N 3.05 0.76 0.00 12.44 6.02 -1.26 -3.83 117.38 134.56 2cwj n GLN 13 Ca -0.18 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.81 2cwj n GLN 13 Cb 0.53 -1.35 0.00 0.00 1.02 0.00 0.00 30.24 30.44 2cwj n GLN 13 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2cwj n ALA 14 N 0.18 0.00 -3.72 -1.58 0.00 -1.23 -3.98 120.51 110.18 2cwj n ALA 14 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.29 2cwj n ALA 14 Cb 0.21 0.00 -0.15 0.00 0.00 0.00 0.00 19.45 19.52 2cwj n ALA 14 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2cwj s VAL 15 N -1.57 -0.12 -1.32 0.00 -7.23 -0.35 -4.96 120.40 104.86 2cwj s VAL 15 Ca 0.00 0.23 -0.13 0.00 -1.81 0.00 0.00 61.98 60.27 2cwj s VAL 15 Cb 0.00 -0.26 0.11 0.00 0.56 0.00 0.00 36.38 36.79 2cwj s VAL 15 CO 0.00 0.10 1.85 1.21 -0.31 0.00 0.00 175.10 177.95 2cwj n GLU 16 N 4.56 3.26 -4.92 4.82 4.07 -1.26 -2.99 120.64 128.18 2cwj n GLU 16 Ca -0.20 -3.28 -0.33 0.00 -0.06 0.00 0.00 57.16 53.30 2cwj n GLU 16 Cb 0.51 -3.18 -0.16 0.00 -0.06 0.00 0.00 31.44 28.56 2cwj n GLU 16 CO 0.00 0.00 0.00 0.45 -0.06 0.00 0.00 177.13 177.52 2cwj s SER 17 N 2.67 3.58 0.76 4.31 0.15 -1.22 -5.02 113.70 118.92 2cwj s SER 17 Ca 0.46 -0.44 0.00 0.00 0.70 0.00 0.00 55.95 56.66 2cwj s SER 17 Cb 0.07 -1.52 0.00 0.00 -1.71 0.00 0.00 66.02 62.86 2cwj s SER 17 CO -0.01 0.15 0.00 0.61 1.20 0.00 0.00 173.24 175.20 2cwj n GLY 18 N 3.60 0.04 1.28 9.45 0.00 -1.26 -2.99 105.19 115.31 2cwj n GLY 18 Ca -0.19 -0.98 -0.05 0.00 0.00 0.00 0.00 46.02 44.80 2cwj n GLY 18 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cwj s PHE 20 N -0.77 1.24 -0.24 0.00 0.08 -1.16 -0.12 117.98 117.00 2cwj s PHE 20 Ca 0.13 -0.77 -0.01 0.00 0.12 0.00 0.00 56.93 56.41 2cwj s PHE 20 Cb 0.11 -0.63 0.07 0.00 -0.57 0.00 0.00 43.02 42.00 2cwj s PHE 20 CO 0.03 0.07 0.01 -1.64 -0.10 0.00 0.00 175.22 173.58 2cwj s MET 21 N -3.75 1.14 -0.07 0.44 -1.94 0.74 -3.40 119.30 112.46 2cwj s MET 21 Ca 0.16 -0.87 -0.23 0.00 -1.71 0.00 0.00 55.69 53.04 2cwj s MET 21 Cb 0.03 -2.36 -0.04 0.00 2.01 0.00 0.00 34.83 34.47 2cwj s MET 21 CO 0.00 -0.70 0.69 -0.06 -0.01 0.00 0.00 175.02 174.94 2cwj s PHE 22 N 1.56 3.58 -0.16 -0.03 0.08 -1.16 -3.35 117.98 118.49 2cwj s PHE 22 Ca -0.01 1.23 0.02 0.00 0.12 0.00 0.00 56.93 58.29 2cwj s PHE 22 Cb -0.18 -2.79 0.02 0.00 -0.57 0.00 0.00 43.02 39.50 2cwj s PHE 22 CO -0.10 0.10 -0.21 0.08 -0.10 0.00 0.00 175.22 174.99 2cwj s VAL 23 N 0.76 2.07 0.40 -0.44 1.01 -1.08 -1.21 120.40 121.91 2cwj s VAL 23 Ca 0.37 -0.96 -0.27 0.00 0.00 0.00 0.00 61.98 61.12 2cwj s VAL 23 Cb -0.18 -1.85 -0.10 0.00 0.00 0.00 0.00 36.38 34.26 2cwj s VAL 23 CO 0.18 0.54 1.47 -0.44 0.00 0.00 0.00 175.10 176.85 2cwj s SER 24 N 1.07 6.18 -0.22 3.32 0.01 -1.25 -3.58 113.70 119.22 2cwj s SER 24 Ca -0.01 3.01 -0.37 0.00 1.31 0.00 0.00 55.95 59.90 2cwj s SER 24 Cb -0.14 -2.66 -0.13 0.00 0.21 0.00 0.00 66.02 63.29 2cwj s SER 24 CO -0.08 -0.98 1.88 0.61 0.41 0.00 0.00 173.24 175.08 2cwj n GLY 25 N 0.49 1.04 3.80 3.44 0.00 -1.25 -4.67 105.19 108.04 2cwj n GLY 25 Ca 0.02 0.91 -0.32 0.00 0.00 0.00 0.00 46.02 46.63 2cwj n GLY 25 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2cwj s GLN 26 N 4.24 2.98 0.02 1.61 -1.52 0.17 -4.53 119.66 122.63 2cwj s GLN 26 Ca 0.98 1.17 0.09 0.00 -1.95 0.00 0.00 55.36 55.65 2cwj s GLN 26 Cb -0.88 -1.99 -0.03 0.00 -0.22 0.00 0.00 33.01 29.89 2cwj s GLN 26 CO 0.57 -1.08 -0.26 0.42 -0.25 0.00 0.00 175.29 174.70 2cwj s ILE 27 N -2.64 2.13 0.00 1.08 -1.09 -1.26 -2.78 121.20 116.64 2cwj s ILE 27 Ca 0.62 -1.29 -0.02 0.00 -2.23 0.00 0.00 60.65 57.73 2cwj s ILE 27 Cb -0.16 -1.80 -0.10 0.00 -1.58 0.00 0.00 42.46 38.82 2cwj s ILE 27 CO 0.45 0.44 1.80 -0.81 -1.23 0.00 0.00 174.94 175.59 2cwj n PRO 28 N 1.99 0.88 -3.50 2.79 -0.04 -1.26 -4.70 135.00 131.16 2cwj n PRO 28 Ca -0.17 -0.36 -0.37 0.00 -0.04 0.00 0.00 63.50 62.56 2cwj n PRO 28 Cb 0.52 -1.60 -0.07 0.00 -0.04 0.00 0.00 33.50 32.30 2cwj n PRO 28 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 2cwj s ILE 29 N 1.65 5.28 -0.61 0.52 -4.36 -1.26 -1.42 121.20 121.00 2cwj s ILE 29 Ca 0.24 0.56 -0.26 0.00 -0.26 0.00 0.00 60.65 60.93 2cwj s ILE 29 Cb 0.12 -3.65 -0.10 0.00 1.25 0.00 0.00 42.46 40.07 2cwj s ILE 29 CO 0.00 0.34 2.44 -3.20 0.24 0.00 0.00 174.94 174.76 2cwj n ASN 30 N 3.95 1.93 -0.32 4.36 5.15 0.21 -4.70 115.26 125.84 2cwj n ASN 30 Ca -0.11 -0.62 0.20 0.00 -0.60 0.00 0.00 54.58 53.45 2cwj n ASN 30 Cb 0.52 -1.51 0.38 0.00 -0.53 0.00 0.00 39.78 38.64 2cwj n ASN 30 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 2cwj n PRO 31 N 8.83 -0.07 -0.12 1.20 -0.04 -1.26 0.19 135.00 143.73 2cwj n PRO 31 Ca 0.43 1.40 0.02 0.00 -0.04 0.00 0.00 63.50 65.30 2cwj n PRO 31 Cb 0.47 -2.32 0.07 0.00 -0.04 0.00 0.00 33.50 31.68 2cwj n PRO 31 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2cwj n GLU 32 N -5.34 1.54 -0.30 0.54 1.02 -1.26 -3.31 120.64 113.53 2cwj n GLU 32 Ca 0.27 -0.60 0.00 0.00 -0.02 0.00 0.00 57.16 56.82 2cwj n GLU 32 Cb 0.91 -1.33 0.00 0.00 -0.02 0.00 0.00 31.44 31.00 2cwj n GLU 32 CO 0.00 0.00 0.00 2.41 1.18 0.00 0.00 177.13 180.72 2cwj n THR 33 N 0.02 0.00 -2.65 2.62 -1.04 0.50 -5.03 114.28 108.70 2cwj n THR 33 Ca 0.05 0.00 -0.01 0.00 -2.04 0.00 0.00 64.05 62.05 2cwj n THR 33 Cb 0.26 0.37 -0.00 0.00 -1.82 0.00 0.00 70.33 69.13 2cwj n THR 33 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2cwj n GLY 34 N 0.00 -0.01 3.12 3.41 0.00 0.96 -4.78 105.19 107.90 2cwj n GLY 34 Ca 0.00 0.01 -0.09 0.00 0.00 0.00 0.00 46.02 45.94 2cwj n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cwj s ALA 35 N -3.17 -0.08 0.92 4.61 0.00 -1.25 -4.93 121.76 117.86 2cwj s ALA 35 Ca 0.00 -0.56 -0.11 0.00 0.00 0.00 0.00 51.96 51.29 2cwj s ALA 35 Cb -0.00 0.27 0.14 0.00 0.00 0.00 0.00 23.12 23.53 2cwj s ALA 35 CO 0.05 -0.33 1.11 -0.51 0.00 0.00 0.00 175.76 176.07 2cwj s LEU 36 N -2.19 2.47 0.84 0.00 1.43 -1.26 0.64 118.68 120.61 2cwj s LEU 36 Ca -0.04 1.88 -0.11 0.00 -1.03 0.00 0.00 54.13 54.82 2cwj s LEU 36 Cb -0.00 -4.26 0.10 0.00 0.03 0.00 0.00 46.19 42.05 2cwj s LEU 36 CO -0.05 -2.95 1.09 -1.61 0.23 0.00 0.00 176.35 173.06 2cwj s GLU 37 N -4.73 1.71 -0.16 1.70 0.41 -0.51 -4.56 118.70 112.56 2cwj s GLU 37 Ca 0.65 0.87 -0.07 0.00 -0.41 0.00 0.00 54.97 56.01 2cwj s GLU 37 Cb -0.21 -1.86 -0.04 0.00 -1.78 0.00 0.00 34.13 30.24 2cwj s GLU 37 CO 0.58 -1.94 0.09 -2.00 -0.49 0.00 0.00 175.26 171.50 2cwj s GLU 38 N -4.98 3.75 0.00 1.61 -6.30 -1.26 -4.57 118.70 106.95 2cwj s GLU 38 Ca 0.62 -0.27 0.00 0.00 -2.50 0.00 0.00 54.97 52.82 2cwj s GLU 38 Cb -0.17 -3.20 0.00 0.00 0.00 0.00 0.00 34.13 30.77 2cwj s GLU 38 CO 0.56 0.47 0.00 0.41 0.02 0.00 0.00 175.26 176.72 2cwj n GLY 39 N 2.94 2.09 0.00 -1.50 0.00 -1.26 -4.68 105.19 102.78 2cwj n GLY 39 Ca -0.18 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.54 2cwj n GLY 39 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cwj n GLY 40 N 0.00 1.29 0.00 -0.02 0.00 -1.26 -4.99 105.19 100.21 2cwj n GLY 40 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.85 2cwj n GLY 40 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2cwj n PHE 41 N 0.00 0.00 -0.11 1.61 0.99 -1.26 -4.86 117.46 113.82 2cwj n PHE 41 Ca 0.00 0.00 -0.13 0.00 -0.00 0.00 0.00 57.45 57.32 2cwj n PHE 41 Cb 0.00 0.00 -0.03 0.00 -1.00 0.00 0.00 39.48 38.45 2cwj n PHE 41 CO 0.00 0.00 0.00 -0.22 -0.00 0.00 0.00 176.76 176.54 2cwj h LYS 42 N 0.00 0.81 -0.42 -1.08 3.64 -1.94 -2.96 116.57 114.63 2cwj h LYS 42 Ca 0.00 -0.41 0.04 0.00 -1.27 0.00 0.00 60.65 59.01 2cwj h LYS 42 Cb 0.00 0.01 -0.06 0.00 -0.41 0.00 0.00 32.23 31.77 2cwj h LYS 42 CO 0.00 1.05 -0.32 0.93 -2.27 0.00 0.00 179.45 178.84 2cwj h GLU 43 N 0.60 -0.09 0.12 1.90 3.07 -1.92 1.21 114.58 119.47 2cwj h GLU 43 Ca 0.06 0.01 0.01 0.00 -0.50 0.00 0.00 59.36 58.93 2cwj h GLU 43 Cb 0.87 0.02 -0.03 0.00 -0.84 0.00 0.00 28.75 28.77 2cwj h GLU 43 CO 0.08 -0.06 -0.36 0.77 -1.40 0.00 0.00 179.01 178.04 2cwj h SER 44 N -0.09 -1.06 0.00 1.42 0.02 -1.83 0.31 113.55 112.32 2cwj h SER 44 Ca 0.07 0.11 0.00 0.00 -0.84 0.00 0.00 61.79 61.13 2cwj h SER 44 Cb 0.27 0.39 0.00 0.00 0.14 0.00 0.00 62.40 63.19 2cwj h SER 44 CO -0.44 -0.39 0.33 0.00 -1.14 0.00 0.00 176.83 175.19 2cwj h ALA 45 N -0.92 1.24 0.00 3.77 0.00 -1.24 0.53 119.26 122.65 2cwj h ALA 45 Ca -0.01 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 2cwj h ALA 45 Cb 0.52 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 2cwj h ALA 45 CO -0.17 -0.24 -0.71 -0.22 0.00 0.00 0.00 179.25 177.91 2cwj h LYS 46 N 0.00 0.00 -0.13 0.00 3.64 0.44 -3.35 116.57 117.17 2cwj h LYS 46 Ca 0.00 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.37 2cwj h LYS 46 Cb 0.66 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.48 2cwj h LYS 46 CO 0.00 0.33 0.06 -0.09 -2.27 0.00 0.00 179.45 177.48 2cwj h ARG 47 N -1.00 0.19 -1.13 1.90 9.65 0.11 -1.19 114.38 122.90 2cwj h ARG 47 Ca -0.11 -0.03 0.36 0.00 -1.10 0.00 0.00 59.98 59.10 2cwj h ARG 47 Cb 0.74 -0.03 -0.13 0.00 -1.39 0.00 0.00 29.97 29.15 2cwj h ARG 47 CO -0.07 0.25 0.70 0.00 2.80 0.00 0.00 179.97 183.65 2cwj h ALA 48 N 0.93 2.33 -0.00 2.80 0.00 -0.25 2.93 119.26 127.99 2cwj h ALA 48 Ca 0.04 0.14 -0.07 0.00 0.00 0.00 0.00 54.91 55.02 2cwj h ALA 48 Cb 0.13 0.16 0.01 0.00 0.00 0.00 0.00 17.79 18.08 2cwj h ALA 48 CO -0.01 -0.92 -0.27 -0.07 0.00 0.00 0.00 179.25 177.98 2cwj h LEU 49 N 0.22 0.25 -0.05 0.00 3.38 -1.54 -2.82 115.31 114.76 2cwj h LEU 49 Ca 0.75 -0.77 0.04 0.00 0.09 0.00 0.00 57.88 57.99 2cwj h LEU 49 Cb 2.03 -0.08 -0.05 0.00 0.09 0.00 0.00 40.66 42.65 2cwj h LEU 49 CO -0.48 0.98 -0.24 0.44 0.09 0.00 0.00 178.44 179.23 2cwj h ASP 50 N -0.46 -0.71 -1.07 -0.43 3.32 0.14 1.14 116.42 118.35 2cwj h ASP 50 Ca -0.03 0.10 0.31 0.00 0.02 0.00 0.00 57.03 57.43 2cwj h ASP 50 Cb 1.02 0.30 -0.04 0.00 0.22 0.00 0.00 39.33 40.83 2cwj h ASP 50 CO 0.05 -0.30 1.20 0.78 -1.72 0.00 0.00 179.24 179.26 2cwj h ASN 51 N -0.35 0.00 0.00 6.45 4.21 0.50 0.93 115.58 127.32 2cwj h ASN 51 Ca 0.08 0.00 -0.18 0.00 1.21 0.00 0.00 56.30 57.41 2cwj h ASN 51 Cb 0.45 0.00 -0.03 0.00 -1.12 0.00 0.00 38.32 37.63 2cwj h ASN 51 CO -0.25 0.00 -1.20 -0.11 -1.29 0.00 0.00 177.43 174.58 2cwj n LEU 52 N -3.31 1.86 -0.43 1.61 7.94 0.32 -4.02 117.00 120.98 2cwj n LEU 52 Ca 0.24 0.47 0.34 0.00 -1.11 0.00 0.00 56.01 55.94 2cwj n LEU 52 Cb 1.53 -0.90 0.52 0.00 0.53 0.00 0.00 43.42 45.09 2cwj n LEU 52 CO 0.25 0.05 1.00 1.17 -1.11 0.00 0.00 177.39 178.75 2cwj n LYS 53 N -4.46 0.00 0.00 1.96 4.81 0.31 -2.08 118.16 118.70 2cwj n LYS 53 Ca -0.27 0.74 0.00 0.00 -0.87 0.00 0.00 58.31 57.91 2cwj n LYS 53 Cb 0.57 -1.73 0.00 0.00 0.02 0.00 0.00 35.03 33.89 2cwj n LYS 53 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2cwj n ALA 54 N -2.50 -0.11 -0.31 3.14 0.00 -0.35 -3.36 120.51 117.02 2cwj n ALA 54 Ca 0.28 0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.86 2cwj n ALA 54 Cb 1.33 0.00 0.32 0.00 0.00 0.00 0.00 19.45 21.11 2cwj n ALA 54 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 2cwj h ILE 55 N 0.00 0.45 -0.66 0.00 5.03 -1.59 0.28 117.51 121.02 2cwj h ILE 55 Ca 0.00 -0.13 0.12 0.00 -0.12 0.00 0.00 64.86 64.73 2cwj h ILE 55 Cb 0.00 0.03 -0.12 0.00 -3.03 0.00 0.00 36.82 33.69 2cwj h ILE 55 CO 0.00 0.07 -0.28 0.58 -0.68 0.00 0.00 178.15 177.84 2cwj h VAL 56 N 0.39 0.20 -0.10 1.67 2.07 -1.65 0.26 116.25 119.09 2cwj h VAL 56 Ca 0.58 0.00 -0.09 0.00 0.82 0.00 0.00 66.70 68.01 2cwj h VAL 56 Cb 1.13 0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 31.08 2cwj h VAL 56 CO -0.54 0.00 -0.35 -0.33 0.02 0.00 0.00 177.57 176.37 2cwj h GLU 57 N -0.10 0.20 0.00 1.57 5.08 -0.51 -3.23 114.58 117.60 2cwj h GLU 57 Ca 0.28 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 2cwj h GLU 57 Cb 0.55 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.79 2cwj h GLU 57 CO -0.72 0.53 0.00 0.41 -1.00 0.00 0.00 179.01 178.23 2cwj n GLY 58 N -0.36 -3.06 2.80 -3.84 0.00 0.91 -1.29 105.19 100.35 2cwj n GLY 58 Ca -0.01 0.50 -0.26 0.00 0.00 0.00 0.00 46.02 46.24 2cwj n GLY 58 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cwj n ALA 59 N -2.66 3.92 -0.50 4.61 0.00 -1.14 -4.68 120.51 120.06 2cwj n ALA 59 Ca 0.00 -2.19 0.00 0.00 0.00 0.00 0.00 53.44 51.25 2cwj n ALA 59 Cb 0.00 -3.14 0.00 0.00 0.00 0.00 0.00 19.45 16.31 2cwj n ALA 59 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2cwj n GLY 60 N 4.02 0.00 3.61 0.00 0.00 -0.41 -4.90 105.19 107.50 2cwj n GLY 60 Ca 0.42 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.43 2cwj n GLY 60 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2cwj s TYR 61 N 0.00 -1.17 0.23 1.61 5.04 -1.22 -5.00 117.35 116.84 2cwj s TYR 61 Ca 0.00 2.07 -0.30 0.00 -2.44 0.00 0.00 57.07 56.40 2cwj s TYR 61 Cb 0.00 0.70 -0.09 0.00 0.35 0.00 0.00 41.96 42.92 2cwj s TYR 61 CO 0.00 -0.58 1.13 -1.12 -1.34 0.00 0.00 175.55 173.64 2cwj s SER 62 N 2.60 7.21 0.15 4.32 0.01 -1.26 -3.72 113.70 123.02 2cwj s SER 62 Ca -0.06 2.23 -0.12 0.00 1.31 0.00 0.00 55.95 59.31 2cwj s SER 62 Cb -0.10 -2.62 0.01 0.00 0.21 0.00 0.00 66.02 63.53 2cwj s SER 62 CO -0.19 -0.23 1.59 0.24 0.41 0.00 0.00 173.24 175.06 2cwj h MET 63 N 4.46 0.89 0.00 12.44 2.86 -1.93 -1.80 114.93 131.86 2cwj h MET 63 Ca -0.46 -0.31 0.00 0.00 -2.06 0.00 0.00 59.70 56.88 2cwj h MET 63 Cb 1.21 -0.07 0.00 0.00 0.06 0.00 0.00 31.60 32.80 2cwj h MET 63 CO 0.70 0.95 0.00 -0.40 1.06 0.00 0.00 176.91 179.22 2cwj n ASP 64 N -4.29 0.00 0.02 1.22 5.68 -1.26 0.16 116.55 118.08 2cwj n ASP 64 Ca 0.01 0.00 0.11 0.00 -0.50 0.00 0.00 54.79 54.41 2cwj n ASP 64 Cb 0.34 0.00 -0.03 0.00 -1.14 0.00 0.00 41.12 40.29 2cwj n ASP 64 CO 0.00 0.00 0.00 -0.67 -1.33 0.00 0.00 177.20 175.20 2cwj n ASP 65 N -0.78 0.59 -4.68 -1.12 4.64 -0.68 -4.89 116.55 109.63 2cwj n ASP 65 Ca 0.00 -0.30 -0.42 0.00 -1.38 0.00 0.00 54.79 52.68 2cwj n ASP 65 Cb 0.00 1.01 -0.03 0.00 -1.04 0.00 0.00 41.12 41.06 2cwj n ASP 65 CO 0.00 0.00 0.00 -0.63 -0.82 0.00 0.00 177.20 175.75 2cwj s ILE 66 N -3.21 3.42 -0.09 5.18 1.01 0.42 -4.17 121.20 123.75 2cwj s ILE 66 Ca 0.03 0.73 0.15 0.00 0.00 0.00 0.00 60.65 61.55 2cwj s ILE 66 Cb 0.15 -3.47 -0.12 0.00 0.01 0.00 0.00 42.46 39.03 2cwj s ILE 66 CO 0.83 -0.03 0.98 -0.37 0.00 0.00 0.00 174.94 176.35 2cwj h VAL 67 N 5.12 0.77 -3.29 2.92 -1.51 -1.86 -3.39 116.25 115.01 2cwj h VAL 67 Ca -0.40 -2.32 -0.16 0.00 -1.23 0.00 0.00 66.70 62.59 2cwj h VAL 67 Cb 1.19 2.27 -0.23 0.00 -2.13 0.00 0.00 31.29 32.38 2cwj h VAL 67 CO 0.93 0.44 -0.45 -0.75 -1.23 0.00 0.00 177.57 176.51 2cwj s LYS 68 N -2.85 0.39 0.00 5.19 2.47 -1.08 -2.23 119.74 121.63 2cwj s LYS 68 Ca -0.01 -0.01 0.01 0.00 -1.56 0.00 0.00 55.97 54.40 2cwj s LYS 68 Cb 0.08 0.17 -0.00 0.00 -1.46 0.00 0.00 37.83 36.62 2cwj s LYS 68 CO 0.80 -0.08 -0.02 0.54 0.16 0.00 0.00 175.35 176.75 2cwj s VAL 69 N -0.59 0.15 -0.17 4.02 0.11 -0.92 -0.53 120.40 122.47 2cwj s VAL 69 Ca -0.07 -0.21 -0.01 0.00 -2.93 0.00 0.00 61.98 58.76 2cwj s VAL 69 Cb -0.04 -0.16 0.05 0.00 -1.53 0.00 0.00 36.38 34.70 2cwj s VAL 69 CO 0.01 -0.04 -0.01 -0.89 -3.33 0.00 0.00 175.10 170.84 2cwj s THR 70 N -0.25 0.87 0.42 5.04 2.01 -0.19 -2.14 115.64 121.40 2cwj s THR 70 Ca -0.02 -0.60 0.08 0.00 0.31 0.00 0.00 61.69 61.46 2cwj s THR 70 Cb -0.02 -1.18 0.01 0.00 0.01 0.00 0.00 72.50 71.31 2cwj s THR 70 CO -0.00 -0.01 0.54 -0.69 -0.69 0.00 0.00 174.62 173.77 2cwj s VAL 71 N 1.72 2.96 -0.16 3.82 1.01 -1.18 -1.06 120.40 127.52 2cwj s VAL 71 Ca -0.00 -1.05 -0.04 0.00 0.00 0.00 0.00 61.98 60.89 2cwj s VAL 71 Cb -0.16 -3.00 0.08 0.00 0.00 0.00 0.00 36.38 33.29 2cwj s VAL 71 CO -0.07 -0.00 0.23 -0.31 0.00 0.00 0.00 175.10 174.95 2cwj s TYR 72 N -2.37 -0.34 -0.13 5.22 2.02 -0.14 -3.89 117.35 117.71 2cwj s TYR 72 Ca 0.54 0.61 0.02 0.00 -0.37 0.00 0.00 57.07 57.86 2cwj s TYR 72 Cb -0.09 -0.20 -0.00 0.00 -0.40 0.00 0.00 41.96 41.27 2cwj s TYR 72 CO 0.32 -0.46 -0.19 0.42 -1.57 0.00 0.00 175.55 174.08 2cwj s ILE 73 N 2.37 2.44 0.19 2.71 1.01 -0.59 -1.82 121.20 127.51 2cwj s ILE 73 Ca 0.04 -0.86 -0.03 0.00 0.00 0.00 0.00 60.65 59.80 2cwj s ILE 73 Cb -0.14 -1.99 -0.06 0.00 0.01 0.00 0.00 42.46 40.28 2cwj s ILE 73 CO -0.10 0.54 1.50 0.74 0.00 0.00 0.00 174.94 177.62 2cwj h THR 74 N 5.66 1.32 -3.15 2.92 2.02 -1.81 -0.31 112.91 119.57 2cwj h THR 74 Ca -0.27 -1.81 -0.63 0.00 0.77 0.00 0.00 66.41 64.47 2cwj h THR 74 Cb 1.21 1.78 -0.12 0.00 -1.74 0.00 0.00 68.15 69.27 2cwj h THR 74 CO 0.54 0.56 -0.68 -0.62 0.37 0.00 0.00 175.52 175.69 2cwj s ASP 75 N -6.92 4.72 -0.03 4.18 3.68 -1.26 -4.63 116.67 116.40 2cwj s ASP 75 Ca -0.07 -0.35 -0.30 0.00 2.13 0.00 0.00 52.55 53.96 2cwj s ASP 75 Cb 0.11 -1.00 -0.06 0.00 -1.45 0.00 0.00 42.92 40.52 2cwj s ASP 75 CO 0.84 0.13 1.58 -0.63 0.13 0.00 0.00 175.17 177.22 2cwj s ILE 76 N -1.51 3.56 0.00 4.11 1.01 -1.26 -3.93 121.20 123.18 2cwj s ILE 76 Ca 0.25 0.79 0.00 0.00 0.00 0.00 0.00 60.65 61.70 2cwj s ILE 76 Cb -0.10 -3.51 0.00 0.00 0.01 0.00 0.00 42.46 38.86 2cwj s ILE 76 CO 0.17 -0.05 0.00 -1.20 0.00 0.00 0.00 174.94 173.86 2cwj n SER 77 N 6.54 0.00 -0.78 3.58 7.64 -1.26 -4.70 113.62 124.63 2cwj n SER 77 Ca 0.16 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.04 2cwj n SER 77 Cb 0.43 -0.01 0.00 0.00 -1.01 0.00 0.00 64.21 63.62 2cwj n SER 77 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2cwj n ARG 78 N -0.24 0.18 -0.04 1.43 1.74 -1.25 -0.35 116.66 118.12 2cwj n ARG 78 Ca 0.00 0.00 -0.15 0.00 -0.77 0.00 0.00 57.85 56.93 2cwj n ARG 78 Cb 0.00 -1.27 -0.08 0.00 -1.02 0.00 0.00 32.46 30.09 2cwj n ARG 78 CO 0.00 0.00 0.00 0.35 -1.52 0.00 0.00 177.63 176.46 2cwj h PHE 79 N 1.28 0.55 0.60 -1.55 3.04 -1.84 -1.71 116.94 117.31 2cwj h PHE 79 Ca 0.00 -0.22 -0.03 0.00 3.98 0.00 0.00 57.97 61.70 2cwj h PHE 79 Cb 0.14 -0.09 0.01 0.00 2.56 0.00 0.00 35.95 38.56 2cwj h PHE 79 CO 0.00 0.95 -0.29 0.66 -2.02 0.00 0.00 178.31 177.61 2cwj h SER 80 N -0.00 -0.68 -0.93 0.41 4.64 -1.10 2.11 113.55 118.00 2cwj h SER 80 Ca -0.01 0.01 0.27 0.00 -0.47 0.00 0.00 61.79 61.59 2cwj h SER 80 Cb 0.96 0.18 -0.04 0.00 -0.31 0.00 0.00 62.40 63.19 2cwj h SER 80 CO 0.07 -0.28 0.74 -0.33 -0.87 0.00 0.00 176.83 176.16 2cwj h GLU 81 N -1.19 0.00 0.00 4.77 5.08 -1.71 0.97 114.58 122.50 2cwj h GLU 81 Ca -0.08 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.22 2cwj h GLU 81 Cb 0.63 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.87 2cwj h GLU 81 CO 0.13 0.00 -0.63 0.35 -1.00 0.00 0.00 179.01 177.86 2cwj h PHE 82 N 0.00 0.00 -1.33 4.33 3.57 -1.16 -3.34 116.94 119.01 2cwj h PHE 82 Ca 0.44 0.00 0.43 0.00 3.53 0.00 0.00 57.97 62.37 2cwj h PHE 82 Cb 1.92 0.00 -0.10 0.00 2.79 0.00 0.00 35.95 40.57 2cwj h PHE 82 CO 0.00 0.38 0.90 0.09 -2.23 0.00 0.00 178.31 177.45 2cwj n ASN 83 N -4.59 0.11 0.21 0.41 4.13 0.71 0.95 115.26 117.19 2cwj n ASN 83 Ca -0.13 1.02 -0.08 0.00 1.68 0.00 0.00 54.58 57.08 2cwj n ASN 83 Cb 0.35 -0.51 -0.04 0.00 -1.54 0.00 0.00 39.78 38.04 2cwj n ASN 83 CO 0.00 0.00 0.00 -0.08 0.28 0.00 0.00 177.26 177.46 2cwj h GLU 84 N 0.00 -0.51 -0.14 3.52 4.81 -0.99 -3.14 114.58 118.14 2cwj h GLU 84 Ca 0.75 0.03 0.04 0.00 -0.13 0.00 0.00 59.36 60.05 2cwj h GLU 84 Cb 2.65 0.12 -0.01 0.00 0.63 0.00 0.00 28.75 32.14 2cwj h GLU 84 CO -0.24 -0.34 0.24 0.28 -0.73 0.00 0.00 179.01 178.22 2cwj h VAL 85 N -0.53 0.26 -0.83 0.32 2.07 0.46 -2.37 116.25 115.63 2cwj h VAL 85 Ca -0.05 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.45 2cwj h VAL 85 Cb 0.40 0.79 -0.04 0.00 -1.52 0.00 0.00 31.29 30.92 2cwj h VAL 85 CO 0.09 0.00 0.47 0.22 0.02 0.00 0.00 177.57 178.37 2cwj h TYR 86 N 0.00 1.13 0.28 1.57 3.20 -1.34 -3.22 116.97 118.58 2cwj h TYR 86 Ca 0.07 -0.02 -0.01 0.00 3.14 0.00 0.00 58.73 61.91 2cwj h TYR 86 Cb 0.55 -0.36 -0.01 0.00 1.54 0.00 0.00 36.73 38.45 2cwj h TYR 86 CO 0.00 0.78 -0.27 0.07 -1.64 0.00 0.00 178.16 177.10 2cwj h ARG 87 N 1.16 -0.52 0.00 1.82 0.11 -1.52 -2.43 114.38 113.00 2cwj h ARG 87 Ca 0.29 0.04 0.00 0.00 0.10 0.00 0.00 59.98 60.41 2cwj h ARG 87 Cb 0.01 0.12 0.00 0.00 1.11 0.00 0.00 29.97 31.21 2cwj h ARG 87 CO -0.05 -0.35 0.77 0.39 0.10 0.00 0.00 179.97 180.84 2cwj n GLU 88 N -3.96 0.02 -0.12 0.08 1.02 -1.22 -1.23 120.64 115.23 2cwj n GLU 88 Ca -0.06 0.73 -0.26 0.00 -0.02 0.00 0.00 57.16 57.55 2cwj n GLU 88 Cb 0.24 -1.98 -0.09 0.00 -0.02 0.00 0.00 31.44 29.59 2cwj n GLU 88 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 2cwj n TYR 89 N -2.04 0.00 -3.64 -0.32 4.02 -0.94 -4.96 117.16 109.28 2cwj n TYR 89 Ca 0.00 0.00 -0.37 0.00 -0.01 0.00 0.00 57.90 57.52 2cwj n TYR 89 Cb 0.77 -0.88 -0.09 0.00 -0.02 0.00 0.00 39.34 39.12 2cwj n TYR 89 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 2cwj s PHE 90 N -2.45 3.31 -0.06 -0.72 0.08 -0.37 -4.75 117.98 113.03 2cwj s PHE 90 Ca -0.34 0.25 -0.00 0.00 0.12 0.00 0.00 56.93 56.95 2cwj s PHE 90 Cb 0.13 -2.29 -0.03 0.00 -0.57 0.00 0.00 43.02 40.26 2cwj s PHE 90 CO 0.43 0.05 -0.01 0.54 -0.10 0.00 0.00 175.22 176.12 2cwj s ASN 91 N 1.10 5.08 0.03 1.36 4.22 -1.26 -4.67 114.94 120.80 2cwj s ASN 91 Ca 0.08 0.06 -0.30 0.00 -2.14 0.00 0.00 52.86 50.56 2cwj s ASN 91 Cb -0.14 -1.37 -0.16 0.00 1.28 0.00 0.00 41.25 40.87 2cwj s ASN 91 CO 0.05 0.35 0.77 0.54 -2.04 0.00 0.00 177.10 176.77 2cwj n ARG 92 N 1.93 0.00 -0.92 3.55 5.12 -1.26 -4.49 116.66 120.58 2cwj n ARG 92 Ca -0.17 0.00 -0.27 0.00 -1.93 0.00 0.00 57.85 55.47 2cwj n ARG 92 Cb 0.53 -1.13 0.23 0.00 -1.16 0.00 0.00 32.46 30.93 2cwj n ARG 92 CO 0.00 0.00 0.00 -2.30 -1.93 0.00 0.00 177.63 173.40 2cwj n PRO 93 N 1.13 -3.02 -4.65 5.56 -0.02 -1.26 -5.14 135.00 127.59 2cwj n PRO 93 Ca 0.16 -1.59 -0.29 0.00 -2.02 0.00 0.00 63.50 59.76 2cwj n PRO 93 Cb 0.09 -1.50 -0.10 0.00 -0.02 0.00 0.00 33.50 31.97 2cwj n PRO 93 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 2cwj s TYR 94 N -2.78 2.32 -0.17 6.00 2.02 -1.26 -5.00 117.35 118.48 2cwj s TYR 94 Ca 0.65 -0.76 -0.07 0.00 -0.37 0.00 0.00 57.07 56.52 2cwj s TYR 94 Cb -0.07 -1.71 -0.04 0.00 -0.40 0.00 0.00 41.96 39.75 2cwj s TYR 94 CO 0.50 0.37 0.07 -1.25 -1.57 0.00 0.00 175.55 173.66 2cwj s PRO 95 N -3.76 3.82 -0.10 -1.71 0.04 -1.26 -4.98 135.00 127.05 2cwj s PRO 95 Ca 0.28 -0.32 -0.40 0.00 0.04 0.00 0.00 61.00 60.60 2cwj s PRO 95 Cb 0.08 -3.17 -0.18 0.00 0.04 0.00 0.00 34.50 31.26 2cwj s PRO 95 CO 0.14 0.38 1.37 0.00 0.04 0.00 0.00 177.00 178.93 2cwj n ALA 96 N 3.20 -1.75 -2.79 8.56 0.00 -0.95 -4.47 120.51 122.31 2cwj n ALA 96 Ca -0.17 0.52 -0.15 0.00 0.00 0.00 0.00 53.44 53.64 2cwj n ALA 96 Cb 0.53 -1.98 -0.13 0.00 0.00 0.00 0.00 19.45 17.87 2cwj n ALA 96 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2cwj s ARG 97 N 1.27 0.56 0.39 0.00 3.52 -1.26 -2.17 118.95 121.27 2cwj s ARG 97 Ca 0.92 -0.59 0.07 0.00 -0.13 0.00 0.00 55.73 56.01 2cwj s ARG 97 Cb -1.16 -0.44 0.00 0.00 -1.56 0.00 0.00 34.95 31.79 2cwj s ARG 97 CO 0.59 0.10 0.52 0.00 -0.81 0.00 0.00 175.30 175.70 2cwj s ALA 98 N -0.91 4.39 -0.30 6.12 0.00 -0.91 -5.01 121.76 125.14 2cwj s ALA 98 Ca -0.04 -1.61 -0.13 0.00 0.00 0.00 0.00 51.96 50.18 2cwj s ALA 98 Cb -0.07 -1.60 0.15 0.00 0.00 0.00 0.00 23.12 21.59 2cwj s ALA 98 CO 0.00 -0.18 0.86 0.14 0.00 0.00 0.00 175.76 176.59 2cwj s VAL 99 N -2.29 -0.64 0.38 0.00 -7.23 -1.26 -3.11 120.40 106.24 2cwj s VAL 99 Ca 0.51 0.00 0.04 0.00 -1.81 0.00 0.00 61.98 60.71 2cwj s VAL 99 Cb -0.09 -1.00 -0.04 0.00 0.56 0.00 0.00 36.38 35.80 2cwj s VAL 99 CO 0.32 0.00 0.08 0.68 -0.31 0.00 0.00 175.10 175.87 2cwj s VAL 100 N 2.55 0.95 -0.46 1.32 -7.23 -1.25 -5.03 120.40 111.24 2cwj s VAL 100 Ca -0.04 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.14 2cwj s VAL 100 Cb -0.08 -2.56 0.12 0.00 0.56 0.00 0.00 36.38 34.43 2cwj s VAL 100 CO -0.18 0.00 0.22 -0.83 -0.31 0.00 0.00 175.10 174.00 2cwj s GLY 101 N -3.57 2.22 0.00 2.32 0.00 -1.25 -1.55 107.32 105.49 2cwj s GLY 101 Ca 0.29 -2.91 0.00 0.00 0.00 0.00 0.00 44.72 42.09 2cwj s GLY 101 CO 0.14 1.01 0.00 3.33 0.00 0.00 0.00 173.10 177.58 2cwj n VAL 102 N 3.80 0.00 0.00 1.40 0.24 -0.13 -4.94 118.33 118.71 2cwj n VAL 102 Ca 0.04 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.34 2cwj n VAL 102 Cb 0.38 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.75 2cwj n VAL 102 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2cwj n ALA 103 N -3.00 0.00 -3.55 2.33 0.00 -1.26 -4.89 120.51 110.13 2cwj n ALA 103 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 2cwj n ALA 103 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.37 2cwj n ALA 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2cwj s ALA 104 N 0.00 -1.58 0.12 0.00 0.00 -1.26 -5.03 121.76 114.00 2cwj s ALA 104 Ca 0.00 1.82 -0.04 0.00 0.00 0.00 0.00 51.96 53.74 2cwj s ALA 104 Cb 0.00 -1.06 -0.03 0.00 0.00 0.00 0.00 23.12 22.03 2cwj s ALA 104 CO 0.00 -0.30 0.11 -0.51 0.00 0.00 0.00 175.76 175.05 2cwj s LEU 105 N 0.39 1.70 0.15 0.00 1.43 -1.26 -5.04 118.68 116.06 2cwj s LEU 105 Ca -0.00 -1.02 -0.34 0.00 -1.03 0.00 0.00 54.13 51.74 2cwj s LEU 105 Cb -0.04 0.57 -0.16 0.00 0.03 0.00 0.00 46.19 46.58 2cwj s LEU 105 CO 0.00 -0.74 1.25 -2.65 0.23 0.00 0.00 176.35 174.44 2cwj n PRO 106 N -0.07 1.26 -0.24 1.29 -0.02 -1.26 -0.93 135.00 135.03 2cwj n PRO 106 Ca -0.09 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 61.84 2cwj n PRO 106 Cb 0.63 -2.01 0.00 0.00 -0.02 0.00 0.00 33.50 32.10 2cwj n PRO 106 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2cwj n LEU 107 N 2.22 0.47 0.00 2.45 4.77 -1.26 -0.42 117.00 125.24 2cwj n LEU 107 Ca 0.16 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 2cwj n LEU 107 Cb 0.24 -0.83 0.00 0.00 -2.33 0.00 0.00 43.42 40.50 2cwj n LEU 107 CO 0.62 -0.24 0.00 0.61 -1.33 0.00 0.00 177.39 177.05 2cwj n GLY 108 N -1.22 0.62 0.94 -0.72 0.00 -0.11 -5.03 105.19 99.66 2cwj n GLY 108 Ca 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.86 2cwj n GLY 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cwj n ALA 109 N -1.66 -1.35 0.12 4.61 0.00 0.44 -4.74 120.51 117.93 2cwj n ALA 109 Ca 0.00 0.16 0.20 0.00 0.00 0.00 0.00 53.44 53.80 2cwj n ALA 109 Cb 0.00 -0.47 0.75 0.00 0.00 0.00 0.00 19.45 19.73 2cwj n ALA 109 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2cwj h PRO 110 N 0.78 0.00 0.00 0.00 0.11 -1.91 -3.43 132.00 127.55 2cwj h PRO 110 Ca -0.13 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.98 2cwj h PRO 110 Cb 0.38 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.49 2cwj h PRO 110 CO 0.17 0.00 0.00 1.47 -0.21 0.00 0.00 178.00 179.43 2cwj n LEU 111 N -3.63 0.00 -3.65 2.35 -0.00 -1.26 -2.89 117.00 107.93 2cwj n LEU 111 Ca 0.06 0.00 -0.02 0.00 -0.00 0.00 0.00 56.01 56.05 2cwj n LEU 111 Cb 0.59 0.00 -0.03 0.00 -0.00 0.00 0.00 43.42 43.98 2cwj n LEU 111 CO 0.26 0.00 1.19 -0.70 -0.00 0.00 0.00 177.39 178.14 2cwj s GLU 112 N 1.09 0.02 -0.23 1.47 2.12 -0.75 -4.86 118.70 117.55 2cwj s GLU 112 Ca 0.00 -0.00 -0.10 0.00 0.36 0.00 0.00 54.97 55.22 2cwj s GLU 112 Cb 0.00 0.01 0.09 0.00 0.26 0.00 0.00 34.13 34.48 2cwj s GLU 112 CO 0.00 -0.01 0.53 0.54 -0.54 0.00 0.00 175.26 175.78 2cwj s VAL 113 N -1.58 -0.36 0.47 3.70 0.11 -1.12 -0.97 120.40 120.65 2cwj s VAL 113 Ca 0.11 0.07 0.08 0.00 -2.93 0.00 0.00 61.98 59.31 2cwj s VAL 113 Cb -0.01 -0.79 0.02 0.00 -1.53 0.00 0.00 36.38 34.06 2cwj s VAL 113 CO -0.05 0.03 0.50 -1.83 -3.33 0.00 0.00 175.10 170.42 2cwj s GLU 114 N 2.05 2.51 0.00 1.54 -1.05 -0.22 0.42 118.70 123.95 2cwj s GLU 114 Ca -0.07 -1.57 0.00 0.00 -0.15 0.00 0.00 54.97 53.18 2cwj s GLU 114 Cb -0.09 -2.47 0.00 0.00 -0.44 0.00 0.00 34.13 31.13 2cwj s GLU 114 CO -0.16 -0.41 0.00 0.00 0.95 0.00 0.00 175.26 175.64 2cwj n ALA 115 N -1.78 0.00 -2.67 -0.84 0.00 -1.23 -1.02 120.51 112.95 2cwj n ALA 115 Ca 0.06 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.20 2cwj n ALA 115 Cb 0.62 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.97 2cwj n ALA 115 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2cwj s VAL 116 N -1.94 1.67 -0.23 0.00 1.01 0.32 -2.63 120.40 118.60 2cwj s VAL 116 Ca 0.00 -2.00 -0.29 0.00 0.00 0.00 0.00 61.98 59.69 2cwj s VAL 116 Cb 0.00 -2.67 0.16 0.00 0.00 0.00 0.00 36.38 33.87 2cwj s VAL 116 CO 0.00 0.00 1.18 -1.48 0.00 0.00 0.00 175.10 174.80 2cwj s LEU 117 N -3.78 -0.21 -0.03 3.92 0.05 -1.21 -2.62 118.68 114.81 2cwj s LEU 117 Ca 0.24 0.24 -0.20 0.00 0.05 0.00 0.00 54.13 54.46 2cwj s LEU 117 Cb 0.07 1.47 -0.05 0.00 -2.05 0.00 0.00 46.19 45.63 2cwj s LEU 117 CO 0.12 -0.18 0.56 -0.72 -0.55 0.00 0.00 176.35 175.58 2cwj s TYR 118 N -0.97 3.65 -2.77 3.48 -0.85 -1.25 -0.19 117.35 118.45 2cwj s TYR 118 Ca 0.04 1.12 0.26 0.00 -0.52 0.00 0.00 57.07 57.97 2cwj s TYR 118 Cb -0.01 -2.58 0.59 0.00 0.38 0.00 0.00 41.96 40.34 2cwj s TYR 118 CO -0.04 0.33 1.49 -2.37 -1.52 0.00 0.00 175.55 173.44