#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o0l h PRO -3 N 0.00 0.00 -4.28 1.61 0.11 -2.08 -3.48 132.00 123.87 1o0l h PRO -3 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1o0l h PRO -3 Cb 0.00 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.09 1o0l h PRO -3 CO 0.00 0.40 -0.70 -0.11 -0.21 0.00 0.00 178.00 177.38 1o0l n LEU -2 N -3.89 -5.42 -3.20 2.35 7.94 -1.26 -5.05 117.00 108.47 1o0l n LEU -2 Ca -0.01 1.01 -0.22 0.00 -1.11 0.00 0.00 56.01 55.68 1o0l n LEU -2 Cb 0.46 -2.43 -0.07 0.00 0.53 0.00 0.00 43.42 41.91 1o0l n LEU -2 CO 0.38 -2.10 -0.23 0.61 -1.11 0.00 0.00 177.39 174.94 1o0l n GLY -1 N 0.58 1.95 3.44 -3.96 0.00 -1.26 -5.11 105.19 100.83 1o0l n GLY -1 Ca -0.06 -1.10 -0.10 0.00 0.00 0.00 0.00 46.02 44.76 1o0l n GLY -1 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1o0l s SER 0 N -0.45 -0.17 -0.10 1.61 0.01 -1.26 -5.16 113.70 108.19 1o0l s SER 0 Ca 0.33 -0.57 0.03 0.00 1.31 0.00 0.00 55.95 57.05 1o0l s SER 0 Cb 0.10 0.52 0.01 0.00 0.21 0.00 0.00 66.02 66.86 1o0l s SER 0 CO -0.16 -0.98 -0.18 -0.32 0.41 0.00 0.00 173.24 172.01 1o0l s MET 1 N -3.89 2.47 -0.23 12.44 1.75 -1.26 -5.12 119.30 125.46 1o0l s MET 1 Ca 0.11 -0.67 -0.08 0.00 -1.25 0.00 0.00 55.69 53.80 1o0l s MET 1 Cb 0.01 -1.96 -0.04 0.00 2.84 0.00 0.00 34.83 35.68 1o0l s MET 1 CO -0.03 0.07 0.08 0.00 -0.65 0.00 0.00 175.02 174.49 1o0l s ALA 2 N 0.62 3.28 -0.10 4.11 0.00 -1.26 -5.09 121.76 123.31 1o0l s ALA 2 Ca -0.14 -1.01 -0.07 0.00 0.00 0.00 0.00 51.96 50.74 1o0l s ALA 2 Cb -0.16 -2.08 -0.04 0.00 0.00 0.00 0.00 23.12 20.84 1o0l s ALA 2 CO 0.04 -0.29 0.16 0.95 0.00 0.00 0.00 175.76 176.63 1o0l s THR 3 N 1.25 5.47 -2.00 0.00 -4.23 -1.25 -4.98 115.64 109.89 1o0l s THR 3 Ca 0.05 0.23 0.16 0.00 -1.18 0.00 0.00 61.69 60.95 1o0l s THR 3 Cb -0.14 -3.43 0.46 0.00 1.34 0.00 0.00 72.50 70.72 1o0l s THR 3 CO 0.04 0.59 1.53 -2.65 -0.54 0.00 0.00 174.62 173.60 1o0l n PRO 4 N 1.88 0.87 -0.05 3.99 -0.02 -1.26 -3.21 135.00 137.21 1o0l n PRO 4 Ca -0.19 0.00 -0.04 0.00 -2.02 0.00 0.00 63.50 61.25 1o0l n PRO 4 Cb 0.55 -1.29 -0.08 0.00 -0.02 0.00 0.00 33.50 32.65 1o0l n PRO 4 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1o0l n ALA 5 N -0.79 1.82 -3.69 3.55 0.00 -1.26 -5.01 120.51 115.13 1o0l n ALA 5 Ca 0.12 -0.63 -0.10 0.00 0.00 0.00 0.00 53.44 52.83 1o0l n ALA 5 Cb 0.06 -0.01 -0.10 0.00 0.00 0.00 0.00 19.45 19.39 1o0l n ALA 5 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1o0l s SER 6 N -4.15 -0.54 -0.17 0.00 0.01 -1.20 -5.15 113.70 102.50 1o0l s SER 6 Ca -0.05 0.95 -0.06 0.00 1.31 0.00 0.00 55.95 58.10 1o0l s SER 6 Cb 0.03 0.85 0.08 0.00 0.21 0.00 0.00 66.02 67.20 1o0l s SER 6 CO 0.43 -0.20 0.35 0.00 0.41 0.00 0.00 173.24 174.22 1o0l s ALA 7 N 1.48 -0.88 -0.53 1.44 0.00 -1.26 -3.97 121.76 118.05 1o0l s ALA 7 Ca -0.09 1.20 -0.07 0.00 0.00 0.00 0.00 51.96 53.00 1o0l s ALA 7 Cb -0.08 -1.22 -0.19 0.00 0.00 0.00 0.00 23.12 21.63 1o0l s ALA 7 CO -0.13 -0.75 3.16 -2.30 0.00 0.00 0.00 175.76 175.74 1o0l n PRO 8 N 5.37 2.38 0.00 0.00 -0.02 -1.26 -4.49 135.00 136.98 1o0l n PRO 8 Ca -0.07 -1.32 0.00 0.00 -2.02 0.00 0.00 63.50 60.09 1o0l n PRO 8 Cb 0.50 -2.23 0.00 0.00 -0.02 0.00 0.00 33.50 31.74 1o0l n PRO 8 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1o0l n ASP 9 N 2.96 0.00 -0.32 2.55 -0.08 -1.26 -4.72 116.55 115.67 1o0l n ASP 9 Ca 0.51 0.00 0.04 0.00 -1.51 0.00 0.00 54.79 53.83 1o0l n ASP 9 Cb 0.62 0.00 0.19 0.00 2.34 0.00 0.00 41.12 44.26 1o0l n ASP 9 CO 0.00 0.00 0.00 0.71 0.12 0.00 0.00 177.20 178.03 1o0l h THR 10 N 0.00 0.94 -0.73 5.18 1.35 -1.98 0.58 112.91 118.26 1o0l h THR 10 Ca 0.00 -0.31 -0.01 0.00 -0.55 0.00 0.00 66.41 65.54 1o0l h THR 10 Cb 0.00 -0.04 -0.04 0.00 -1.73 0.00 0.00 68.15 66.34 1o0l h THR 10 CO 0.00 0.16 0.41 -0.09 -0.25 0.00 0.00 175.52 175.76 1o0l h ARG 11 N 0.90 1.00 -0.03 4.72 2.43 -1.93 0.64 114.38 122.12 1o0l h ARG 11 Ca 0.43 -0.10 -0.21 0.00 -0.81 0.00 0.00 59.98 59.28 1o0l h ARG 11 Cb 0.36 -0.21 0.00 0.00 -0.42 0.00 0.00 29.97 29.71 1o0l h ARG 11 CO -0.24 0.72 -0.88 0.00 -1.51 0.00 0.00 179.97 178.07 1o0l h ALA 12 N 1.44 0.42 -0.11 2.80 0.00 -1.50 -2.50 119.26 119.82 1o0l h ALA 12 Ca 0.26 -0.68 -0.18 0.00 0.00 0.00 0.00 54.91 54.32 1o0l h ALA 12 Cb -0.00 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 17.77 1o0l h ALA 12 CO -0.04 0.80 -0.62 1.25 0.00 0.00 0.00 179.25 180.63 1o0l h LEU 13 N 0.26 0.74 -1.04 0.00 5.85 -0.26 -1.32 115.31 119.54 1o0l h LEU 13 Ca -0.06 -0.65 -0.06 0.00 0.84 0.00 0.00 57.88 57.95 1o0l h LEU 13 Cb 1.50 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 42.29 1o0l h LEU 13 CO 0.15 1.27 0.02 1.62 -0.34 0.00 0.00 178.44 181.16 1o0l h VAL 14 N 0.26 1.23 0.00 1.05 3.04 0.20 -0.14 116.25 121.89 1o0l h VAL 14 Ca -0.05 -0.91 -0.08 0.00 -1.01 0.00 0.00 66.70 64.66 1o0l h VAL 14 Cb 1.27 0.87 -0.01 0.00 -2.01 0.00 0.00 31.29 31.41 1o0l h VAL 14 CO 0.13 0.32 -0.36 0.00 -1.01 0.00 0.00 177.57 176.65 1o0l h ALA 15 N 1.35 0.95 0.11 3.17 0.00 -1.44 -2.49 119.26 120.92 1o0l h ALA 15 Ca 0.14 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 1o0l h ALA 15 Cb 0.39 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1o0l h ALA 15 CO 0.01 0.45 -0.05 0.22 0.00 0.00 0.00 179.25 179.88 1o0l h ASP 16 N 0.00 -0.13 0.12 0.00 3.58 -0.13 -0.93 116.42 118.94 1o0l h ASP 16 Ca -0.00 0.00 0.02 0.00 0.42 0.00 0.00 57.03 57.47 1o0l h ASP 16 Cb 0.94 0.03 -0.03 0.00 1.72 0.00 0.00 39.33 41.99 1o0l h ASP 16 CO 0.05 0.06 -0.28 0.15 -2.88 0.00 0.00 179.24 176.34 1o0l h PHE 17 N -0.45 -0.75 -0.44 0.28 3.57 -1.18 0.53 116.94 118.50 1o0l h PHE 17 Ca -0.02 0.02 -0.12 0.00 3.53 0.00 0.00 57.97 61.38 1o0l h PHE 17 Cb 0.11 0.31 -0.02 0.00 2.79 0.00 0.00 35.95 39.15 1o0l h PHE 17 CO 0.04 -0.38 -0.19 0.28 -2.23 0.00 0.00 178.31 175.82 1o0l h VAL 18 N -0.49 1.27 0.47 1.41 2.07 -1.63 -0.23 116.25 119.12 1o0l h VAL 18 Ca 0.03 -1.32 -0.02 0.00 0.82 0.00 0.00 66.70 66.21 1o0l h VAL 18 Cb 0.52 1.13 0.00 0.00 -1.52 0.00 0.00 31.29 31.43 1o0l h VAL 18 CO -0.16 0.45 -0.23 1.23 0.02 0.00 0.00 177.57 178.88 1o0l h GLY 19 N 0.94 -0.66 1.01 2.17 0.00 -0.80 0.27 103.07 106.00 1o0l h GLY 19 Ca 0.11 0.25 0.01 0.00 0.00 0.00 0.00 47.33 47.69 1o0l h GLY 19 CO 0.06 -0.24 0.49 -1.82 0.00 0.00 0.00 176.54 175.02 1o0l h TYR 20 N -0.77 0.93 -0.43 5.60 5.03 0.06 0.35 116.97 127.74 1o0l h TYR 20 Ca -0.07 0.02 -0.02 0.00 2.58 0.00 0.00 58.73 61.24 1o0l h TYR 20 Cb 0.55 -0.32 -0.02 0.00 1.55 0.00 0.00 36.73 38.50 1o0l h TYR 20 CO -0.01 0.59 0.19 0.87 -1.32 0.00 0.00 178.16 178.48 1o0l h LYS 21 N 1.00 0.63 -0.17 1.82 1.79 -0.97 0.10 116.57 120.78 1o0l h LYS 21 Ca 0.27 -0.11 -0.11 0.00 -2.18 0.00 0.00 60.65 58.53 1o0l h LYS 21 Cb -0.11 -0.11 0.00 0.00 -1.58 0.00 0.00 32.23 30.43 1o0l h LYS 21 CO -0.06 0.57 -0.31 -0.07 -1.08 0.00 0.00 179.45 178.51 1o0l h LEU 22 N 0.55 0.57 -0.56 2.94 4.07 -0.67 -2.71 115.31 119.51 1o0l h LEU 22 Ca 0.15 -0.54 0.00 0.00 0.08 0.00 0.00 57.88 57.57 1o0l h LEU 22 Cb 0.16 -0.16 0.00 0.00 1.08 0.00 0.00 40.66 41.74 1o0l h LEU 22 CO -0.01 1.00 0.00 -1.14 -1.08 0.00 0.00 178.44 177.21 1o0l n ARG 23 N -4.36 0.12 0.07 1.13 0.63 0.12 0.71 116.66 115.08 1o0l n ARG 23 Ca -0.06 0.41 -0.19 0.00 -0.92 0.00 0.00 57.85 57.09 1o0l n ARG 23 Cb 0.48 -1.75 -0.15 0.00 0.45 0.00 0.00 32.46 31.49 1o0l n ARG 23 CO 0.00 0.00 0.00 1.96 -2.51 0.00 0.00 177.63 177.08 1o0l h GLN 24 N 0.00 0.32 -1.39 -0.14 4.20 -0.51 -3.37 115.11 114.22 1o0l h GLN 24 Ca 0.00 -0.55 -0.25 0.00 0.06 0.00 0.00 58.65 57.92 1o0l h GLN 24 Cb 0.25 0.20 -0.23 0.00 0.30 0.00 0.00 27.48 28.00 1o0l h GLN 24 CO 0.00 1.21 -0.60 -1.59 -0.67 0.00 0.00 178.83 177.17 1o0l s LYS 25 N -2.60 0.93 0.00 1.46 -2.85 -0.85 -4.97 119.74 110.86 1o0l s LYS 25 Ca -0.11 -1.08 0.00 0.00 -1.00 0.00 0.00 55.97 53.78 1o0l s LYS 25 Cb 0.06 -0.37 0.00 0.00 -2.06 0.00 0.00 37.83 35.46 1o0l s LYS 25 CO 0.86 -1.29 0.00 0.41 0.10 0.00 0.00 175.35 175.43 1o0l n GLY 26 N 3.39 1.08 2.74 0.59 0.00 -0.68 -4.78 105.19 107.54 1o0l n GLY 26 Ca 0.18 -0.10 -0.39 0.00 0.00 0.00 0.00 46.02 45.71 1o0l n GLY 26 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1o0l n TYR 27 N 0.00 2.77 0.12 1.61 9.36 0.22 -4.59 117.16 126.65 1o0l n TYR 27 Ca 0.00 -2.42 -0.01 0.00 3.32 0.00 0.00 57.90 58.79 1o0l n TYR 27 Cb 0.00 -1.25 0.02 0.00 -0.63 0.00 0.00 39.34 37.48 1o0l n TYR 27 CO 0.00 0.00 0.00 -0.24 0.22 0.00 0.00 176.86 176.84 1o0l h VAL 28 N 2.13 1.19 -0.42 2.97 3.04 -1.73 -3.17 116.25 120.26 1o0l h VAL 28 Ca 0.55 -2.55 -0.14 0.00 -1.01 0.00 0.00 66.70 63.56 1o0l h VAL 28 Cb 0.21 2.50 -0.01 0.00 -2.01 0.00 0.00 31.29 31.98 1o0l h VAL 28 CO 1.29 0.65 -0.29 0.00 -1.01 0.00 0.00 177.57 178.22 1o0l n GLY 30 N -0.05 4.63 3.61 0.00 0.00 -1.20 -4.94 105.19 107.24 1o0l n GLY 30 Ca -0.01 -1.81 -0.43 0.00 0.00 0.00 0.00 46.02 43.77 1o0l n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o0l s ALA 31 N -0.25 2.92 0.00 4.61 0.00 -1.20 -4.29 121.76 123.55 1o0l s ALA 31 Ca 0.60 0.46 0.00 0.00 0.00 0.00 0.00 51.96 53.02 1o0l s ALA 31 Cb 0.23 -4.00 0.00 0.00 0.00 0.00 0.00 23.12 19.35 1o0l s ALA 31 CO -0.10 -2.54 0.00 0.41 0.00 0.00 0.00 175.76 173.53 1o0l n GLY 32 N 5.38 -0.94 0.08 0.00 0.00 -1.26 -4.97 105.19 103.48 1o0l n GLY 32 Ca 0.24 0.22 -0.12 0.00 0.00 0.00 0.00 46.02 46.36 1o0l n GLY 32 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1o0l h PRO 33 N 0.00 0.15 -1.05 1.61 0.11 -1.88 -2.90 132.00 128.03 1o0l h PRO 33 Ca 0.00 -0.04 -0.35 0.00 0.11 0.00 0.00 66.00 65.72 1o0l h PRO 33 Cb 0.00 -0.02 -0.20 0.00 0.11 0.00 0.00 31.00 30.89 1o0l h PRO 33 CO 0.00 0.35 0.45 0.41 -0.21 0.00 0.00 178.00 179.01 1o0l n GLY 34 N -0.42 3.79 0.18 -0.55 0.00 -1.23 -4.17 105.19 102.78 1o0l n GLY 34 Ca -0.06 -0.83 0.12 0.00 0.00 0.00 0.00 46.02 45.25 1o0l n GLY 34 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1o0l h GLU 35 N 0.80 0.00 -5.45 1.61 4.11 -1.85 -3.41 114.58 110.39 1o0l h GLU 35 Ca 0.41 0.00 -0.63 0.00 0.07 0.00 0.00 59.36 59.21 1o0l h GLU 35 Cb 2.03 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 31.12 1o0l h GLU 35 CO 0.77 0.00 -0.58 0.20 0.07 0.00 0.00 179.01 179.47 1o0l s GLY 36 N -4.24 1.90 0.00 1.06 0.00 -1.26 -5.06 107.32 99.72 1o0l s GLY 36 Ca 0.05 -0.75 0.00 0.00 0.00 0.00 0.00 44.72 44.01 1o0l s GLY 36 CO 0.71 -0.12 0.00 -1.55 0.00 0.00 0.00 173.10 172.14 1o0l n PRO 37 N 3.11 3.53 -2.01 2.90 -0.04 -1.26 -4.90 135.00 136.33 1o0l n PRO 37 Ca -0.17 0.00 -0.39 0.00 -0.04 0.00 0.00 63.50 62.90 1o0l n PRO 37 Cb 0.53 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.96 1o0l n PRO 37 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1o0l n ALA 38 N -3.00 3.38 -1.89 0.55 0.00 -1.26 -4.59 120.51 113.71 1o0l n ALA 38 Ca 0.00 -3.52 0.01 0.00 0.00 0.00 0.00 53.44 49.93 1o0l n ALA 38 Cb 0.00 -3.56 0.14 0.00 0.00 0.00 0.00 19.45 16.03 1o0l n ALA 38 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1o0l n ALA 39 N 9.54 3.56 -2.27 0.00 0.00 -1.26 -4.60 120.51 125.47 1o0l n ALA 39 Ca 0.48 -3.17 -0.09 0.00 0.00 0.00 0.00 53.44 50.67 1o0l n ALA 39 Cb 0.44 -0.44 -0.09 0.00 0.00 0.00 0.00 19.45 19.35 1o0l n ALA 39 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1o0l s ASP 40 N -3.08 0.29 -0.03 0.00 1.01 -1.26 -5.02 116.67 108.58 1o0l s ASP 40 Ca 0.39 -1.03 -0.05 0.00 0.71 0.00 0.00 52.55 52.56 1o0l s ASP 40 Cb 0.38 0.30 -0.21 0.00 1.01 0.00 0.00 42.92 44.40 1o0l s ASP 40 CO -0.07 -0.72 3.33 -0.81 0.21 0.00 0.00 175.17 177.11 1o0l n PRO 41 N -0.05 1.88 0.00 8.23 -0.04 -1.26 -2.78 135.00 140.98 1o0l n PRO 41 Ca -0.09 -0.94 0.00 0.00 -0.04 0.00 0.00 63.50 62.43 1o0l n PRO 41 Cb 0.63 -1.86 0.00 0.00 -0.04 0.00 0.00 33.50 32.23 1o0l n PRO 41 CO 0.00 0.00 0.00 1.47 -0.04 0.00 0.00 175.50 176.93 1o0l n LEU 42 N 2.24 0.00 0.34 1.53 -0.00 -1.26 -4.10 117.00 115.75 1o0l n LEU 42 Ca 0.37 0.00 -0.17 0.00 -0.00 0.00 0.00 56.01 56.21 1o0l n LEU 42 Cb 0.83 0.00 -0.09 0.00 -0.00 0.00 0.00 43.42 44.17 1o0l n LEU 42 CO 0.12 0.00 0.65 0.45 -0.00 0.00 0.00 177.39 178.61 1o0l h HIS 43 N 0.00 -0.84 0.00 1.47 3.86 -1.89 -0.14 115.15 117.61 1o0l h HIS 43 Ca 0.00 -0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 59.19 1o0l h HIS 43 Cb 0.00 0.29 -0.00 0.00 1.06 0.00 0.00 27.41 28.76 1o0l h HIS 43 CO 0.00 -0.51 -0.00 1.96 0.86 0.00 0.00 177.93 180.24 1o0l h GLN 44 N -0.86 0.00 0.04 2.45 4.20 -1.81 0.37 115.11 119.49 1o0l h GLN 44 Ca -0.08 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.63 1o0l h GLN 44 Cb 0.67 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.45 1o0l h GLN 44 CO 0.11 0.00 -0.02 0.00 -0.67 0.00 0.00 178.83 178.26 1o0l h ALA 45 N 2.00 -0.05 -0.41 3.87 0.00 -1.60 -2.96 119.26 120.11 1o0l h ALA 45 Ca -0.00 -0.34 -0.14 0.00 0.00 0.00 0.00 54.91 54.43 1o0l h ALA 45 Cb 0.00 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1o0l h ALA 45 CO 0.00 -0.14 -0.30 1.98 0.00 0.00 0.00 179.25 180.78 1o0l h MET 46 N -0.81 0.92 -0.49 0.00 4.05 -0.60 -1.32 114.93 116.67 1o0l h MET 46 Ca -0.00 -0.43 -0.02 0.00 -0.28 0.00 0.00 59.70 58.96 1o0l h MET 46 Cb 0.69 -0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 31.45 1o0l h MET 46 CO 0.01 1.09 0.21 0.00 0.23 0.00 0.00 176.91 178.45 1o0l h ARG 47 N 0.77 0.69 0.15 0.39 2.47 -1.06 0.21 114.38 118.01 1o0l h ARG 47 Ca 0.08 -0.09 -0.23 0.00 -1.26 0.00 0.00 59.98 58.48 1o0l h ARG 47 Cb 0.88 -0.13 0.02 0.00 -1.65 0.00 0.00 29.97 29.09 1o0l h ARG 47 CO 0.08 0.56 -1.04 0.00 0.56 0.00 0.00 179.97 180.13 1o0l h ALA 48 N 1.54 -0.04 0.34 0.04 0.00 -1.44 -2.81 119.26 116.89 1o0l h ALA 48 Ca 0.17 -0.81 -0.01 0.00 0.00 0.00 0.00 54.91 54.26 1o0l h ALA 48 Cb 0.12 0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1o0l h ALA 48 CO -0.02 0.52 -0.23 0.00 0.00 0.00 0.00 179.25 179.53 1o0l h ALA 49 N 0.06 -0.54 -0.53 0.00 0.00 -1.10 -0.56 119.26 116.59 1o0l h ALA 49 Ca -0.20 -0.10 0.10 0.00 0.00 0.00 0.00 54.91 54.71 1o0l h ALA 49 Cb 1.74 0.29 -0.08 0.00 0.00 0.00 0.00 17.79 19.74 1o0l h ALA 49 CO 0.15 -0.82 0.06 0.78 0.00 0.00 0.00 179.25 179.42 1o0l h GLY 50 N -0.55 0.61 0.90 0.00 0.00 -0.72 0.21 103.07 103.52 1o0l h GLY 50 Ca -0.03 0.02 0.01 0.00 0.00 0.00 0.00 47.33 47.33 1o0l h GLY 50 CO 0.02 -0.12 0.09 -1.80 0.00 0.00 0.00 176.54 174.73 1o0l h ASP 51 N 0.18 0.13 -0.13 0.19 1.82 -1.24 0.66 116.42 118.04 1o0l h ASP 51 Ca 0.27 0.01 0.00 0.00 -0.39 0.00 0.00 57.03 56.92 1o0l h ASP 51 Cb 0.39 -0.01 -0.01 0.00 0.68 0.00 0.00 39.33 40.38 1o0l h ASP 51 CO -0.39 0.10 0.08 -0.08 -1.61 0.00 0.00 179.24 177.35 1o0l h GLU 52 N 0.19 0.17 -0.23 0.28 4.57 -0.39 -1.83 114.58 117.33 1o0l h GLU 52 Ca 0.08 -0.01 -0.12 0.00 -1.18 0.00 0.00 59.36 58.13 1o0l h GLU 52 Cb 0.02 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 28.57 1o0l h GLU 52 CO -0.06 0.11 -0.36 0.35 -1.18 0.00 0.00 179.01 177.87 1o0l h PHE 53 N 0.17 0.60 0.00 0.92 3.57 -0.40 -1.31 116.94 120.50 1o0l h PHE 53 Ca 0.05 -0.16 -0.01 0.00 3.53 0.00 0.00 57.97 61.38 1o0l h PHE 53 Cb -0.02 -0.13 -0.00 0.00 2.79 0.00 0.00 35.95 38.59 1o0l h PHE 53 CO -0.07 0.81 -0.04 1.49 -2.23 0.00 0.00 178.31 178.27 1o0l h GLU 54 N 0.43 0.00 0.04 1.11 4.81 0.67 0.82 114.58 122.47 1o0l h GLU 54 Ca 0.05 0.00 -0.28 0.00 -0.13 0.00 0.00 59.36 59.00 1o0l h GLU 54 Cb 0.83 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.18 1o0l h GLU 54 CO 0.07 0.04 -1.48 1.15 -0.73 0.00 0.00 179.01 178.05 1o0l h THR 55 N 0.00 1.15 0.00 0.32 2.02 -0.85 -3.36 112.91 112.20 1o0l h THR 55 Ca -0.00 -2.90 -0.03 0.00 0.77 0.00 0.00 66.41 64.24 1o0l h THR 55 Cb 0.08 2.63 -0.01 0.00 -1.74 0.00 0.00 68.15 69.12 1o0l h THR 55 CO 0.01 0.73 -0.96 0.03 0.37 0.00 0.00 175.52 175.70 1o0l h ARG 56 N 0.02 0.00 -5.67 6.66 3.08 -0.11 -3.43 114.38 114.93 1o0l h ARG 56 Ca -0.21 0.00 -0.62 0.00 0.07 0.00 0.00 59.98 59.22 1o0l h ARG 56 Cb 1.95 0.00 -0.13 0.00 0.08 0.00 0.00 29.97 31.87 1o0l h ARG 56 CO 0.12 0.07 0.90 0.12 -1.07 0.00 0.00 179.97 180.10 1o0l s PHE 57 N -3.26 2.66 0.43 3.04 5.36 0.28 -4.86 117.98 121.63 1o0l s PHE 57 Ca -0.00 -0.69 0.09 0.00 -0.96 0.00 0.00 56.93 55.38 1o0l s PHE 57 Cb 0.09 -4.44 0.93 0.00 -0.34 0.00 0.00 43.02 39.26 1o0l s PHE 57 CO 0.78 -1.76 2.06 0.00 -1.46 0.00 0.00 175.22 174.84 1o0l h ARG 58 N 9.55 0.38 -3.97 10.12 3.08 -1.87 -3.34 114.38 128.33 1o0l h ARG 58 Ca -0.10 -0.03 -0.72 0.00 0.07 0.00 0.00 59.98 59.20 1o0l h ARG 58 Cb 1.04 -0.08 -0.32 0.00 0.08 0.00 0.00 29.97 30.70 1o0l h ARG 58 CO 1.23 0.29 -0.32 0.50 -1.07 0.00 0.00 179.97 180.60 1o0l s ARG 59 N -5.29 2.64 0.00 0.04 3.52 -1.26 -4.87 118.95 113.73 1o0l s ARG 59 Ca -0.07 -2.19 0.00 0.00 -0.13 0.00 0.00 55.73 53.34 1o0l s ARG 59 Cb 0.17 -3.90 0.00 0.00 -1.56 0.00 0.00 34.95 29.66 1o0l s ARG 59 CO 0.72 -1.19 0.00 0.25 -0.81 0.00 0.00 175.30 174.27 1o0l n THR 60 N 4.16 0.00 1.18 4.11 -2.24 -1.26 -4.83 114.28 115.40 1o0l n THR 60 Ca 0.03 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.94 1o0l n THR 60 Cb 0.41 -0.93 0.66 0.00 -2.10 0.00 0.00 70.33 68.36 1o0l n THR 60 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 1o0l n PHE 61 N -2.36 0.00 -0.04 4.78 3.01 -1.26 -3.77 117.46 117.82 1o0l n PHE 61 Ca 0.00 0.00 -0.14 0.00 1.01 0.00 0.00 57.45 58.32 1o0l n PHE 61 Cb 0.00 -0.37 -0.09 0.00 -0.01 0.00 0.00 39.48 39.02 1o0l n PHE 61 CO 0.00 0.00 0.00 0.77 1.01 0.00 0.00 176.76 178.54 1o0l h SER 62 N 0.00 0.30 0.80 4.37 0.02 -1.92 -2.79 113.55 114.32 1o0l h SER 62 Ca 0.00 -0.56 0.00 0.00 -0.84 0.00 0.00 61.79 60.39 1o0l h SER 62 Cb 0.34 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 62.79 1o0l h SER 62 CO 0.00 0.80 0.00 0.44 -1.14 0.00 0.00 176.83 176.93 1o0l h ASP 63 N -0.20 0.00 -0.19 3.07 5.19 -1.89 -0.31 116.42 122.09 1o0l h ASP 63 Ca 0.00 0.00 -0.20 0.00 -0.62 0.00 0.00 57.03 56.21 1o0l h ASP 63 Cb 0.75 0.00 0.01 0.00 0.18 0.00 0.00 39.33 40.27 1o0l h ASP 63 CO 0.04 0.00 -0.68 -0.07 -3.12 0.00 0.00 179.24 175.41 1o0l h LEU 64 N 0.00 0.93 -0.06 1.55 3.38 -1.67 -2.15 115.31 117.28 1o0l h LEU 64 Ca 0.00 -0.60 -0.09 0.00 0.09 0.00 0.00 57.88 57.28 1o0l h LEU 64 Cb 0.40 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.88 1o0l h LEU 64 CO 0.00 1.37 -0.32 0.00 0.09 0.00 0.00 178.44 179.58 1o0l h ALA 65 N 0.58 0.13 -0.79 1.53 0.00 -1.09 -2.54 119.26 117.08 1o0l h ALA 65 Ca -0.03 -0.45 0.12 0.00 0.00 0.00 0.00 54.91 54.55 1o0l h ALA 65 Cb 1.31 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 19.01 1o0l h ALA 65 CO 0.14 0.19 0.40 0.00 0.00 0.00 0.00 179.25 179.98 1o0l h ALA 66 N 0.42 1.13 0.39 0.00 0.00 -1.12 0.25 119.26 120.33 1o0l h ALA 66 Ca -0.02 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 1o0l h ALA 66 Cb 0.98 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.73 1o0l h ALA 66 CO 0.07 -0.04 -0.19 1.96 0.00 0.00 0.00 179.25 181.05 1o0l h GLN 67 N 0.64 -0.50 -0.62 0.00 4.20 -1.39 -3.10 115.11 114.34 1o0l h GLN 67 Ca 0.40 0.03 0.00 0.00 0.06 0.00 0.00 58.65 59.15 1o0l h GLN 67 Cb 0.48 0.11 0.00 0.00 0.30 0.00 0.00 27.48 28.38 1o0l h GLN 67 CO -0.31 -0.23 0.00 1.28 -0.67 0.00 0.00 178.83 178.90 1o0l n LEU 68 N -5.23 1.75 0.13 1.46 7.99 -0.96 -3.86 117.00 118.27 1o0l n LEU 68 Ca -0.10 -0.88 0.01 0.00 -0.01 0.00 0.00 56.01 55.02 1o0l n LEU 68 Cb 0.27 -0.38 0.05 0.00 -0.11 0.00 0.00 43.42 43.25 1o0l n LEU 68 CO 0.33 0.31 0.43 -0.74 -1.51 0.00 0.00 177.39 176.21 1o0l h HIS 69 N 1.06 0.00 0.00 -1.77 2.76 -0.42 -3.39 115.15 113.39 1o0l h HIS 69 Ca 0.00 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 1o0l h HIS 69 Cb 0.63 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.59 1o0l h HIS 69 CO 0.22 0.60 -0.10 1.33 -1.30 0.00 0.00 177.93 178.69 1o0l n VAL 70 N -3.33 0.23 -3.59 5.26 0.24 -1.25 -5.08 118.33 110.81 1o0l n VAL 70 Ca 0.01 0.45 -0.12 0.00 -2.04 0.00 0.00 64.34 62.64 1o0l n VAL 70 Cb 0.74 -1.64 -0.06 0.00 -1.47 0.00 0.00 33.84 31.40 1o0l n VAL 70 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 1o0l s THR 71 N -1.22 0.00 1.11 3.34 -1.32 -1.26 -5.18 115.64 111.11 1o0l s THR 71 Ca -0.03 0.00 -0.17 0.00 -1.21 0.00 0.00 61.69 60.28 1o0l s THR 71 Cb 0.00 -1.00 0.25 0.00 -1.51 0.00 0.00 72.50 70.24 1o0l s THR 71 CO 0.04 0.00 1.15 -2.84 -2.21 0.00 0.00 174.62 170.76 1o0l s PRO 72 N -0.53 -0.47 0.00 7.08 0.02 -1.26 -4.28 135.00 135.55 1o0l s PRO 72 Ca -0.02 -0.03 0.00 0.00 0.02 0.00 0.00 61.00 60.98 1o0l s PRO 72 Cb -0.02 -1.68 0.00 0.00 0.02 0.00 0.00 34.50 32.82 1o0l s PRO 72 CO 0.01 -3.22 0.00 0.41 -0.33 0.00 0.00 177.00 173.86 1o0l n GLY 73 N -1.59 2.14 2.17 0.52 0.00 -1.26 -4.78 105.19 102.39 1o0l n GLY 73 Ca 0.12 -0.34 -0.17 0.00 0.00 0.00 0.00 46.02 45.63 1o0l n GLY 73 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1o0l n SER 74 N 3.47 5.34 -0.03 1.61 7.64 -1.26 -3.78 113.62 126.60 1o0l n SER 74 Ca 0.00 -2.38 -0.00 0.00 1.01 0.00 0.00 58.87 57.50 1o0l n SER 74 Cb 0.00 -1.27 -0.09 0.00 -1.01 0.00 0.00 64.21 61.84 1o0l n SER 74 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1o0l n ALA 75 N 2.92 2.05 -0.06 -0.43 0.00 -1.26 -4.52 120.51 119.21 1o0l n ALA 75 Ca 0.45 -0.54 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1o0l n ALA 75 Cb 0.62 -0.18 0.29 0.00 0.00 0.00 0.00 19.45 20.17 1o0l n ALA 75 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 177.50 176.94 1o0l h GLN 76 N 0.00 0.66 -0.26 0.00 3.07 -1.99 0.03 115.11 116.61 1o0l h GLN 76 Ca -0.17 -0.11 -0.06 0.00 0.09 0.00 0.00 58.65 58.41 1o0l h GLN 76 Cb 1.19 -0.11 -0.01 0.00 0.08 0.00 0.00 27.48 28.62 1o0l h GLN 76 CO 0.01 0.58 -0.06 1.96 0.09 0.00 0.00 178.83 181.41 1o0l h GLN 77 N 0.65 0.51 -0.46 0.06 7.50 -1.89 0.11 115.11 121.59 1o0l h GLN 77 Ca 0.15 -0.19 -0.03 0.00 0.50 0.00 0.00 58.65 59.08 1o0l h GLN 77 Cb 0.20 -0.03 -0.02 0.00 0.05 0.00 0.00 27.48 27.68 1o0l h GLN 77 CO -0.01 0.72 0.17 0.00 -1.50 0.00 0.00 178.83 178.21 1o0l h ARG 78 N 0.26 0.69 -0.06 1.46 3.08 -1.71 -1.68 114.38 116.41 1o0l h ARG 78 Ca 0.07 -0.14 -0.00 0.00 0.07 0.00 0.00 59.98 59.98 1o0l h ARG 78 Cb 0.53 -0.11 -0.00 0.00 0.08 0.00 0.00 29.97 30.47 1o0l h ARG 78 CO 0.03 0.65 0.03 0.35 -1.07 0.00 0.00 179.97 179.95 1o0l h PHE 79 N 0.60 0.09 -0.32 3.04 3.57 -0.90 -2.59 116.94 120.43 1o0l h PHE 79 Ca 0.15 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.66 1o0l h PHE 79 Cb 0.22 -0.03 -0.02 0.00 2.79 0.00 0.00 35.95 38.92 1o0l h PHE 79 CO 0.01 0.17 0.21 1.79 -2.23 0.00 0.00 178.31 178.26 1o0l h THR 80 N -0.01 1.06 0.38 4.41 1.35 -0.65 -0.80 112.91 118.65 1o0l h THR 80 Ca 0.02 -0.14 -0.02 0.00 -0.55 0.00 0.00 66.41 65.73 1o0l h THR 80 Cb 0.11 0.63 0.00 0.00 -1.73 0.00 0.00 68.15 67.16 1o0l h THR 80 CO -0.00 0.07 -0.18 1.56 -0.25 0.00 0.00 175.52 176.72 1o0l h GLN 81 N 0.40 -0.50 -0.48 4.72 1.08 -0.97 0.15 115.11 119.52 1o0l h GLN 81 Ca 0.12 0.03 -0.02 0.00 -1.45 0.00 0.00 58.65 57.34 1o0l h GLN 81 Cb 0.01 0.11 -0.02 0.00 -0.05 0.00 0.00 27.48 27.53 1o0l h GLN 81 CO -0.03 -0.21 0.23 -0.24 -0.95 0.00 0.00 178.83 177.63 1o0l h VAL 82 N -0.76 1.17 -0.39 -0.54 3.04 -1.27 -0.18 116.25 117.32 1o0l h VAL 82 Ca -0.05 -0.47 -0.08 0.00 -1.01 0.00 0.00 66.70 65.09 1o0l h VAL 82 Cb 0.52 0.55 -0.01 0.00 -2.01 0.00 0.00 31.29 30.34 1o0l h VAL 82 CO 0.09 0.19 -0.06 0.28 -1.01 0.00 0.00 177.57 177.06 1o0l h SER 83 N 0.67 0.73 -0.42 3.17 0.02 -1.03 -0.25 113.55 116.45 1o0l h SER 83 Ca 0.17 -0.34 -0.03 0.00 -0.84 0.00 0.00 61.79 60.74 1o0l h SER 83 Cb 0.08 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.40 1o0l h SER 83 CO -0.02 0.90 0.14 0.44 -1.14 0.00 0.00 176.83 177.15 1o0l h ASP 84 N 0.54 0.60 0.88 3.07 5.19 -0.11 0.08 116.42 126.68 1o0l h ASP 84 Ca 0.10 -0.20 0.00 0.00 -0.62 0.00 0.00 57.03 56.32 1o0l h ASP 84 Cb 0.56 -0.16 0.00 0.00 0.18 0.00 0.00 39.33 39.91 1o0l h ASP 84 CO 0.03 0.64 0.00 -0.33 -3.12 0.00 0.00 179.24 176.46 1o0l h GLU 85 N 0.54 0.00 0.20 3.56 5.08 -0.94 -0.14 114.58 122.88 1o0l h GLU 85 Ca 0.14 0.00 -0.35 0.00 -1.00 0.00 0.00 59.36 58.15 1o0l h GLU 85 Cb 0.24 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.51 1o0l h GLU 85 CO -0.01 0.00 -1.67 -0.07 -1.00 0.00 0.00 179.01 176.26 1o0l h LEU 86 N 0.00 0.67 -0.18 1.33 4.07 -0.24 -3.27 115.31 117.69 1o0l h LEU 86 Ca 0.00 -0.91 0.00 0.00 0.08 0.00 0.00 57.88 57.05 1o0l h LEU 86 Cb 0.44 -0.22 0.00 0.00 1.08 0.00 0.00 40.66 41.96 1o0l h LEU 86 CO 0.00 1.75 -0.09 0.33 -1.08 0.00 0.00 178.44 179.36 1o0l n PHE 87 N -3.62 0.00 -0.31 1.13 7.35 -0.06 -3.90 117.46 118.05 1o0l n PHE 87 Ca -0.22 0.00 0.17 0.00 -0.76 0.00 0.00 57.45 56.64 1o0l n PHE 87 Cb 1.08 -0.20 0.36 0.00 0.35 0.00 0.00 39.48 41.07 1o0l n PHE 87 CO 0.00 0.00 0.00 0.37 -0.76 0.00 0.00 176.76 176.37 1o0l h GLN 88 N 0.44 0.19 0.00 -4.13 4.15 -1.08 -3.38 115.11 111.30 1o0l h GLN 88 Ca 0.00 -0.01 0.00 0.00 0.77 0.00 0.00 58.65 59.41 1o0l h GLN 88 Cb 0.34 -0.04 0.00 0.00 0.21 0.00 0.00 27.48 27.98 1o0l h GLN 88 CO 0.00 0.13 0.00 0.41 -1.93 0.00 0.00 178.83 177.44 1o0l n GLY 89 N -1.36 -1.31 0.00 2.39 0.00 -1.26 -5.08 105.19 98.58 1o0l n GLY 89 Ca 0.25 0.65 0.00 0.00 0.00 0.00 0.00 46.02 46.93 1o0l n GLY 89 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1o0l n GLY 90 N 0.00 -1.23 1.51 -0.02 0.00 -1.25 -5.00 105.19 99.20 1o0l n GLY 90 Ca 0.00 0.49 -0.01 0.00 0.00 0.00 0.00 46.02 46.50 1o0l n GLY 90 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1o0l n PRO 91 N 0.00 1.04 -1.11 1.61 -0.04 -1.26 -4.70 135.00 130.54 1o0l n PRO 91 Ca 0.00 -0.08 -0.32 0.00 -0.04 0.00 0.00 63.50 63.06 1o0l n PRO 91 Cb 0.00 -1.03 0.12 0.00 -0.04 0.00 0.00 33.50 32.54 1o0l n PRO 91 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 1o0l s ASN 92 N 1.89 3.94 0.57 3.54 3.84 -1.26 -4.62 114.94 122.83 1o0l s ASN 92 Ca 0.02 2.03 0.27 0.00 0.21 0.00 0.00 52.86 55.39 1o0l s ASN 92 Cb 0.01 -2.55 1.50 0.00 -0.55 0.00 0.00 41.25 39.67 1o0l s ASN 92 CO -0.00 -2.42 2.01 -0.50 -2.79 0.00 0.00 177.10 173.40 1o0l h TRP 93 N -1.21 0.00 -0.74 0.43 4.06 -1.97 0.54 115.95 117.06 1o0l h TRP 93 Ca -0.44 0.00 -0.05 0.00 2.06 0.00 0.00 58.89 60.45 1o0l h TRP 93 Cb 1.25 0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 29.38 1o0l h TRP 93 CO 0.54 0.00 0.24 0.78 -3.56 0.00 0.00 178.44 176.44 1o0l h GLY 94 N 0.00 1.22 1.27 1.49 0.00 -1.90 -2.63 103.07 102.51 1o0l h GLY 94 Ca 0.18 -0.70 -0.12 0.00 0.00 0.00 0.00 47.33 46.68 1o0l h GLY 94 CO -0.00 0.66 -1.09 -0.09 0.00 0.00 0.00 176.54 176.01 1o0l h ARG 95 N 1.09 0.00 -0.51 4.80 9.65 -0.89 -3.32 114.38 125.20 1o0l h ARG 95 Ca 0.24 0.00 0.14 0.00 -1.10 0.00 0.00 59.98 59.26 1o0l h ARG 95 Cb 0.28 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 28.84 1o0l h ARG 95 CO -0.01 0.29 0.36 1.25 2.80 0.00 0.00 179.97 184.66 1o0l h LEU 96 N 0.00 0.06 0.29 3.80 6.46 0.28 0.11 115.31 126.31 1o0l h LEU 96 Ca -0.10 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.65 1o0l h LEU 96 Cb 1.44 -0.01 0.00 0.00 -0.73 0.00 0.00 40.66 41.36 1o0l h LEU 96 CO 0.04 0.03 -0.14 0.58 -0.62 0.00 0.00 178.44 178.34 1o0l h VAL 97 N 0.06 0.75 0.00 1.05 2.07 -1.62 -2.66 116.25 115.90 1o0l h VAL 97 Ca 0.24 -0.29 -0.04 0.00 0.82 0.00 0.00 66.70 67.43 1o0l h VAL 97 Cb 0.88 0.91 -0.01 0.00 -1.52 0.00 0.00 31.29 31.55 1o0l h VAL 97 CO -0.02 0.06 -0.19 0.00 0.02 0.00 0.00 177.57 177.45 1o0l h ALA 98 N 0.13 1.50 0.43 1.67 0.00 -1.29 0.12 119.26 121.80 1o0l h ALA 98 Ca -0.04 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 1o0l h ALA 98 Cb 0.40 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 1o0l h ALA 98 CO 0.07 0.23 -0.36 0.74 0.00 0.00 0.00 179.25 179.93 1o0l h PHE 99 N 0.00 -0.96 0.01 0.00 0.04 -0.52 0.27 116.94 115.78 1o0l h PHE 99 Ca -0.00 0.00 -0.23 0.00 2.80 0.00 0.00 57.97 60.54 1o0l h PHE 99 Cb 0.38 0.36 0.01 0.00 2.20 0.00 0.00 35.95 38.90 1o0l h PHE 99 CO 0.00 -0.51 -0.97 0.74 -0.60 0.00 0.00 178.31 176.96 1o0l h PHE 100 N -0.79 0.67 -0.80 -0.55 -1.00 -1.36 -3.25 116.94 109.86 1o0l h PHE 100 Ca -0.04 -0.37 0.01 0.00 2.81 0.00 0.00 57.97 60.38 1o0l h PHE 100 Cb 0.68 -0.07 -0.04 0.00 3.61 0.00 0.00 35.95 40.13 1o0l h PHE 100 CO -0.17 1.19 0.52 0.28 -1.61 0.00 0.00 178.31 178.53 1o0l h VAL 101 N 0.25 1.21 -0.33 -0.55 2.07 -0.64 0.20 116.25 118.46 1o0l h VAL 101 Ca -0.09 -0.40 0.03 0.00 0.82 0.00 0.00 66.70 67.06 1o0l h VAL 101 Cb 1.61 0.03 -0.03 0.00 -1.52 0.00 0.00 31.29 31.39 1o0l h VAL 101 CO 0.17 0.21 0.15 -0.26 0.02 0.00 0.00 177.57 177.86 1o0l h PHE 102 N 1.09 0.27 0.11 1.57 0.04 -0.48 0.29 116.94 119.83 1o0l h PHE 102 Ca 0.29 0.01 -0.30 0.00 2.80 0.00 0.00 57.97 60.78 1o0l h PHE 102 Cb -0.11 -0.08 0.03 0.00 2.20 0.00 0.00 35.95 37.99 1o0l h PHE 102 CO 0.00 0.14 -1.23 0.78 -0.60 0.00 0.00 178.31 177.40 1o0l h GLY 103 N 0.31 0.72 0.97 -1.45 0.00 -1.56 -2.17 103.07 99.89 1o0l h GLY 103 Ca 0.14 -1.48 0.01 0.00 0.00 0.00 0.00 47.33 46.00 1o0l h GLY 103 CO -0.11 1.30 0.36 0.00 0.00 0.00 0.00 176.54 178.10 1o0l h ALA 104 N 0.30 0.72 -0.41 3.60 0.00 -0.49 0.44 119.26 123.42 1o0l h ALA 104 Ca -0.18 -0.03 -0.12 0.00 0.00 0.00 0.00 54.91 54.58 1o0l h ALA 104 Cb 1.90 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 19.47 1o0l h ALA 104 CO 0.24 0.13 -0.21 0.00 0.00 0.00 0.00 179.25 179.41 1o0l h ALA 105 N 1.22 0.58 -0.30 0.00 0.00 -1.03 -1.83 119.26 117.89 1o0l h ALA 105 Ca 0.21 -0.38 0.02 0.00 0.00 0.00 0.00 54.91 54.76 1o0l h ALA 105 Cb -0.06 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1o0l h ALA 105 CO -0.06 0.54 0.15 1.25 0.00 0.00 0.00 179.25 181.14 1o0l h LEU 106 N 0.68 0.23 -0.81 0.00 6.46 -0.80 -2.43 115.31 118.64 1o0l h LEU 106 Ca 0.09 0.01 -0.01 0.00 -0.12 0.00 0.00 57.88 57.86 1o0l h LEU 106 Cb 0.77 -0.03 -0.04 0.00 -0.73 0.00 0.00 40.66 40.63 1o0l h LEU 106 CO 0.06 0.17 0.49 0.00 -0.62 0.00 0.00 178.44 178.54 1o0l h ALA 108 N 1.26 -0.59 0.00 0.00 0.00 -0.86 -0.63 119.26 118.44 1o0l h ALA 108 Ca 0.29 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1o0l h ALA 108 Cb -0.04 0.53 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1o0l h ALA 108 CO -0.05 -0.89 0.00 1.49 0.00 0.00 0.00 179.25 179.80 1o0l h GLU 109 N -0.58 0.00 0.00 0.00 4.81 -1.35 -2.14 114.58 115.32 1o0l h GLU 109 Ca 0.02 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 59.10 1o0l h GLU 109 Cb 0.59 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.95 1o0l h GLU 109 CO -0.17 0.00 -0.72 0.77 -0.73 0.00 0.00 179.01 178.17 1o0l h SER 110 N 0.00 0.00 1.55 1.04 0.02 -0.06 -2.80 113.55 113.30 1o0l h SER 110 Ca 0.00 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.88 1o0l h SER 110 Cb 0.39 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.92 1o0l h SER 110 CO 0.00 0.72 -0.46 0.58 -1.14 0.00 0.00 176.83 176.52 1o0l h VAL 111 N 0.00 0.48 0.00 2.27 2.07 -0.53 -2.74 116.25 117.80 1o0l h VAL 111 Ca -0.01 -1.70 0.00 0.00 0.82 0.00 0.00 66.70 65.81 1o0l h VAL 111 Cb 1.45 2.17 0.00 0.00 -1.52 0.00 0.00 31.29 33.39 1o0l h VAL 111 CO 0.09 0.27 0.00 0.78 0.02 0.00 0.00 177.57 178.73 1o0l h ASN 112 N 0.00 0.00 -2.51 0.57 2.35 -1.31 -3.46 115.58 111.23 1o0l h ASN 112 Ca -0.02 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.73 1o0l h ASN 112 Cb 1.25 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.62 1o0l h ASN 112 CO 0.04 0.00 0.00 0.29 -1.65 0.00 0.00 177.43 176.11 1o0l n LYS 113 N -2.34 1.41 -1.75 0.81 4.01 -1.07 -5.03 118.16 114.20 1o0l n LYS 113 Ca 0.05 0.00 -0.40 0.00 -0.51 0.00 0.00 58.31 57.45 1o0l n LYS 113 Cb 0.42 0.00 -0.01 0.00 -0.51 0.00 0.00 35.03 34.93 1o0l n LYS 113 CO 0.00 0.00 0.00 0.39 -1.11 0.00 0.00 177.40 176.68 1o0l n GLU 114 N 0.00 4.15 -1.60 1.97 1.02 -1.26 -4.25 120.64 120.67 1o0l n GLU 114 Ca 0.00 -2.97 0.02 0.00 -0.02 0.00 0.00 57.16 54.20 1o0l n GLU 114 Cb 0.00 -2.74 0.06 0.00 -0.02 0.00 0.00 31.44 28.74 1o0l n GLU 114 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 1o0l n MET 115 N 2.70 0.74 0.01 3.49 2.81 -1.04 -4.92 117.12 120.91 1o0l n MET 115 Ca 0.67 -2.58 -0.10 0.00 -1.81 0.00 0.00 57.70 53.88 1o0l n MET 115 Cb 0.25 -0.66 -0.03 0.00 -0.71 0.00 0.00 33.22 32.07 1o0l n MET 115 CO 0.00 0.00 0.00 0.93 1.51 0.00 0.00 175.97 178.41 1o0l h GLU 116 N 1.33 -0.19 0.00 0.03 3.07 -1.73 -1.96 114.58 115.13 1o0l h GLU 116 Ca -0.15 0.01 -0.01 0.00 -0.50 0.00 0.00 59.36 58.72 1o0l h GLU 116 Cb 1.62 0.04 -0.00 0.00 -0.84 0.00 0.00 28.75 29.58 1o0l h GLU 116 CO 0.13 -0.13 -0.04 -1.35 -1.40 0.00 0.00 179.01 176.22 1o0l h PRO 117 N -0.20 0.00 0.00 2.33 0.11 -1.92 -1.74 132.00 130.57 1o0l h PRO 117 Ca 0.09 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 66.12 1o0l h PRO 117 Cb 0.32 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.42 1o0l h PRO 117 CO -0.23 0.04 -0.38 -0.07 -0.21 0.00 0.00 178.00 177.15 1o0l h LEU 118 N 0.00 0.00 0.24 2.35 4.07 -1.75 -3.17 115.31 117.05 1o0l h LEU 118 Ca -0.00 0.00 -0.00 0.00 0.08 0.00 0.00 57.88 57.96 1o0l h LEU 118 Cb 0.09 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 41.82 1o0l h LEU 118 CO 0.01 0.38 -0.19 0.58 -1.08 0.00 0.00 178.44 178.13 1o0l h VAL 119 N 0.00 0.58 -0.24 1.22 2.07 -0.99 -0.26 116.25 118.63 1o0l h VAL 119 Ca -0.00 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.49 1o0l h VAL 119 Cb 0.87 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 31.20 1o0l h VAL 119 CO 0.05 0.00 0.04 1.23 0.02 0.00 0.00 177.57 178.91 1o0l h GLY 120 N -0.45 0.36 0.84 2.17 0.00 -1.67 -1.45 103.07 102.87 1o0l h GLY 120 Ca -0.01 -0.18 -0.02 0.00 0.00 0.00 0.00 47.33 47.13 1o0l h GLY 120 CO -0.02 0.17 -0.15 1.46 0.00 0.00 0.00 176.54 178.00 1o0l h GLN 121 N 0.34 -0.40 -0.54 4.80 4.20 -1.39 -0.34 115.11 121.77 1o0l h GLN 121 Ca 0.08 0.03 0.07 0.00 0.06 0.00 0.00 58.65 58.89 1o0l h GLN 121 Cb 0.17 0.09 -0.03 0.00 0.30 0.00 0.00 27.48 28.01 1o0l h GLN 121 CO -0.00 -0.16 0.36 0.28 -0.67 0.00 0.00 178.83 178.64 1o0l h VAL 122 N -0.59 0.97 -0.26 -0.54 2.07 -0.76 0.50 116.25 117.65 1o0l h VAL 122 Ca -0.04 -0.16 -0.02 0.00 0.82 0.00 0.00 66.70 67.29 1o0l h VAL 122 Cb 0.43 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 30.64 1o0l h VAL 122 CO 0.07 0.09 0.06 -0.61 0.02 0.00 0.00 177.57 177.20 1o0l h GLN 123 N 0.47 0.41 -0.09 1.57 4.15 -0.85 -1.57 115.11 119.20 1o0l h GLN 123 Ca 0.24 -0.10 -0.22 0.00 0.77 0.00 0.00 58.65 59.35 1o0l h GLN 123 Cb 0.34 -0.05 0.01 0.00 0.21 0.00 0.00 27.48 27.98 1o0l h GLN 123 CO -0.07 0.50 -0.82 1.05 -1.93 0.00 0.00 178.83 177.57 1o0l h GLU 124 N 0.24 0.60 -0.83 1.69 4.11 0.10 -1.33 114.58 119.17 1o0l h GLU 124 Ca 0.08 -0.53 0.08 0.00 0.07 0.00 0.00 59.36 59.06 1o0l h GLU 124 Cb 0.27 0.12 -0.06 0.00 0.50 0.00 0.00 28.75 29.59 1o0l h GLU 124 CO 0.00 1.15 0.54 -1.49 0.07 0.00 0.00 179.01 179.28 1o0l h TRP 125 N 0.39 0.89 0.31 2.06 6.55 0.03 0.28 115.95 126.46 1o0l h TRP 125 Ca -0.06 0.02 -0.02 0.00 0.95 0.00 0.00 58.89 59.79 1o0l h TRP 125 Cb 1.43 -0.29 0.00 0.00 -0.86 0.00 0.00 29.16 29.45 1o0l h TRP 125 CO 0.07 0.44 -0.15 1.98 -1.05 0.00 0.00 178.44 179.73 1o0l h MET 126 N 0.86 -0.40 -0.03 0.49 4.05 -1.17 -2.74 114.93 115.99 1o0l h MET 126 Ca 0.37 0.03 -0.01 0.00 -0.28 0.00 0.00 59.70 59.80 1o0l h MET 126 Cb 0.33 0.09 -0.00 0.00 -0.80 0.00 0.00 31.60 31.21 1o0l h MET 126 CO -0.14 -0.14 -0.05 -0.24 0.23 0.00 0.00 176.91 176.57 1o0l h VAL 127 N -1.03 1.06 0.03 -5.77 3.04 -1.02 -0.68 116.25 111.88 1o0l h VAL 127 Ca -0.04 -0.25 -0.00 0.00 -1.01 0.00 0.00 66.70 65.40 1o0l h VAL 127 Cb 0.45 1.08 0.00 0.00 -2.01 0.00 0.00 31.29 30.81 1o0l h VAL 127 CO 0.07 0.07 -0.02 -0.33 -1.01 0.00 0.00 177.57 176.36 1o0l h GLU 128 N 0.05 -0.04 -0.10 4.17 4.39 -0.53 0.21 114.58 122.72 1o0l h GLU 128 Ca 0.01 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.69 1o0l h GLU 128 Cb 0.12 0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.77 1o0l h GLU 128 CO 0.01 0.39 -0.05 -0.92 -1.16 0.00 0.00 179.01 177.28 1o0l h TYR 129 N -0.48 0.15 0.08 4.33 3.20 -1.15 -1.94 116.97 121.14 1o0l h TYR 129 Ca -0.00 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.86 1o0l h TYR 129 Cb 0.45 -0.05 0.00 0.00 1.54 0.00 0.00 36.73 38.67 1o0l h TYR 129 CO 0.07 0.20 -0.04 -0.07 -1.64 0.00 0.00 178.16 176.69 1o0l h LEU 130 N 0.14 -0.09 -1.34 2.82 4.07 -1.01 -2.38 115.31 117.52 1o0l h LEU 130 Ca 0.03 -0.48 -0.01 0.00 0.08 0.00 0.00 57.88 57.50 1o0l h LEU 130 Cb 0.19 0.02 -0.03 0.00 1.08 0.00 0.00 40.66 41.92 1o0l h LEU 130 CO 0.01 0.59 0.31 -0.33 -1.08 0.00 0.00 178.44 177.93 1o0l h GLU 131 N -0.92 0.75 0.09 1.13 4.39 -0.91 0.42 114.58 119.54 1o0l h GLU 131 Ca -0.01 -0.07 -0.26 0.00 0.34 0.00 0.00 59.36 59.35 1o0l h GLU 131 Cb 0.56 -0.16 0.01 0.00 -0.10 0.00 0.00 28.75 29.07 1o0l h GLU 131 CO 0.02 0.55 -1.15 1.15 -1.16 0.00 0.00 179.01 178.42 1o0l h THR 132 N 0.77 1.42 0.00 1.13 2.02 -1.47 -3.40 112.91 113.38 1o0l h THR 132 Ca 0.20 -2.73 0.00 0.00 0.77 0.00 0.00 66.41 64.65 1o0l h THR 132 Cb 0.01 2.72 0.00 0.00 -1.74 0.00 0.00 68.15 69.15 1o0l h THR 132 CO -0.03 0.81 -0.65 0.54 0.37 0.00 0.00 175.52 176.55 1o0l n ARG 133 N -3.66 0.00 -0.13 6.66 1.74 -0.91 -4.76 116.66 115.60 1o0l n ARG 133 Ca -0.09 0.00 -0.06 0.00 -0.77 0.00 0.00 57.85 56.93 1o0l n ARG 133 Cb 0.95 -0.64 0.02 0.00 -1.02 0.00 0.00 32.46 31.78 1o0l n ARG 133 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 1o0l h LEU 134 N 0.00 0.33 -1.42 0.55 -0.00 -0.56 -2.21 115.31 111.99 1o0l h LEU 134 Ca 0.00 0.02 0.20 0.00 -0.00 0.00 0.00 57.88 58.10 1o0l h LEU 134 Cb 0.65 -0.05 -0.07 0.00 -0.00 0.00 0.00 40.66 41.19 1o0l h LEU 134 CO 0.00 0.24 0.61 0.00 -0.00 0.00 0.00 178.44 179.28 1o0l h ALA 135 N 1.20 2.12 0.14 1.53 0.00 -0.54 0.18 119.26 123.89 1o0l h ALA 135 Ca 0.17 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 1o0l h ALA 135 Cb 0.06 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1o0l h ALA 135 CO -0.11 -0.42 -0.07 0.22 0.00 0.00 0.00 179.25 178.87 1o0l h ASP 136 N 0.47 -0.16 -0.31 0.00 3.58 -1.66 0.16 116.42 118.49 1o0l h ASP 136 Ca 0.49 -0.24 0.03 0.00 0.42 0.00 0.00 57.03 57.73 1o0l h ASP 136 Cb 1.13 0.04 -0.03 0.00 1.72 0.00 0.00 39.33 42.20 1o0l h ASP 136 CO -0.21 0.16 0.14 -0.25 -2.88 0.00 0.00 179.24 176.20 1o0l h TRP 137 N -0.50 0.25 -0.32 0.28 7.01 -1.19 -0.94 115.95 120.54 1o0l h TRP 137 Ca -0.02 0.01 0.04 0.00 2.11 0.00 0.00 58.89 61.03 1o0l h TRP 137 Cb 0.39 -0.07 -0.04 0.00 -2.10 0.00 0.00 29.16 27.35 1o0l h TRP 137 CO 0.02 0.13 0.09 0.82 -2.79 0.00 0.00 178.44 176.72 1o0l h ILE 138 N 0.29 0.89 -0.24 2.65 2.04 -0.62 0.20 117.51 122.72 1o0l h ILE 138 Ca 0.13 -0.08 -0.04 0.00 1.00 0.00 0.00 64.86 65.88 1o0l h ILE 138 Cb 0.07 0.65 -0.01 0.00 -0.74 0.00 0.00 36.82 36.78 1o0l h ILE 138 CO -0.11 0.04 -0.02 0.45 0.00 0.00 0.00 178.15 178.51 1o0l h HIS 139 N 0.22 0.36 0.00 1.37 3.86 -0.33 0.14 115.15 120.78 1o0l h HIS 139 Ca 0.14 -0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.33 1o0l h HIS 139 Cb 0.13 -0.11 0.00 0.00 1.06 0.00 0.00 27.41 28.49 1o0l h HIS 139 CO -0.15 0.39 -0.17 0.77 0.86 0.00 0.00 177.93 179.63 1o0l h SER 140 N 0.35 0.00 0.00 2.45 0.02 -0.46 -3.37 113.55 112.54 1o0l h SER 140 Ca 0.08 -0.02 -0.05 0.00 -0.84 0.00 0.00 61.79 60.96 1o0l h SER 140 Cb 0.27 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.81 1o0l h SER 140 CO 0.01 0.01 -0.38 -1.28 -1.14 0.00 0.00 176.83 174.05 1o0l h SER 141 N 0.00 0.00 0.00 3.07 0.87 -0.36 -3.48 113.55 113.65 1o0l h SER 141 Ca 0.00 -0.39 0.00 0.00 -1.23 0.00 0.00 61.79 60.17 1o0l h SER 141 Cb 0.92 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.88 1o0l h SER 141 CO 0.00 0.91 0.00 0.61 -0.53 0.00 0.00 176.83 177.82 1o0l n GLY 142 N 1.62 0.00 0.00 5.77 0.00 -0.84 -5.08 105.19 106.66 1o0l n GLY 142 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.91 1o0l n GLY 142 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1o0l n GLY 143 N 0.00 1.22 0.29 -0.02 0.00 0.44 -4.07 105.19 103.05 1o0l n GLY 143 Ca 0.00 -2.02 0.12 0.00 0.00 0.00 0.00 46.02 44.11 1o0l n GLY 143 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 1o0l h TRP 144 N 0.00 0.00 -0.29 1.61 4.06 -1.89 0.02 115.95 119.46 1o0l h TRP 144 Ca 0.00 0.00 -0.08 0.00 2.06 0.00 0.00 58.89 60.87 1o0l h TRP 144 Cb 0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 28.14 1o0l h TRP 144 CO 0.00 0.00 -0.15 0.00 -3.56 0.00 0.00 178.44 174.73 1o0l h ALA 145 N 1.97 1.21 -0.66 1.49 0.00 -1.81 -0.59 119.26 120.87 1o0l h ALA 145 Ca 0.02 -0.29 -0.04 0.00 0.00 0.00 0.00 54.91 54.60 1o0l h ALA 145 Cb 0.09 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 1o0l h ALA 145 CO -0.00 0.51 0.24 1.49 0.00 0.00 0.00 179.25 181.49 1o0l h GLU 146 N 0.46 1.00 -0.24 0.00 4.81 -1.13 -1.95 114.58 117.53 1o0l h GLU 146 Ca 0.08 -0.20 -0.08 0.00 -0.13 0.00 0.00 59.36 59.03 1o0l h GLU 146 Cb 0.53 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 29.74 1o0l h GLU 146 CO 0.03 0.85 -0.20 0.35 -0.73 0.00 0.00 179.01 179.32 1o0l h PHE 147 N 0.94 0.48 0.00 0.92 3.57 -1.30 -1.54 116.94 120.01 1o0l h PHE 147 Ca 0.22 -0.09 -0.05 0.00 3.53 0.00 0.00 57.97 61.58 1o0l h PHE 147 Cb 0.25 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 38.86 1o0l h PHE 147 CO 0.02 0.62 -0.23 1.15 -2.23 0.00 0.00 178.31 177.63 1o0l h THR 148 N 0.40 1.09 0.00 4.41 2.02 -0.37 -0.41 112.91 120.04 1o0l h THR 148 Ca 0.07 -0.82 -0.15 0.00 0.77 0.00 0.00 66.41 66.28 1o0l h THR 148 Cb 0.58 1.45 -0.02 0.00 -1.74 0.00 0.00 68.15 68.42 1o0l h THR 148 CO 0.04 0.23 -1.02 0.00 0.37 0.00 0.00 175.52 175.13 1o0l h ALA 149 N 1.77 0.64 -0.11 6.16 0.00 -0.93 -0.08 119.26 126.70 1o0l h ALA 149 Ca -0.00 -0.72 -0.23 0.00 0.00 0.00 0.00 54.91 53.96 1o0l h ALA 149 Cb 0.43 0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.33 1o0l h ALA 149 CO 0.03 0.86 -0.83 -0.07 0.00 0.00 0.00 179.25 179.25 1o0l h LEU 150 N 0.00 0.87 -2.97 0.00 3.38 -0.51 -3.08 115.31 113.00 1o0l h LEU 150 Ca -0.09 -0.60 -0.06 0.00 0.09 0.00 0.00 57.88 57.23 1o0l h LEU 150 Cb 1.54 -0.26 -0.12 0.00 0.09 0.00 0.00 40.66 41.91 1o0l h LEU 150 CO 0.06 1.39 -0.65 -1.22 0.09 0.00 0.00 178.44 178.12 1o0l n TYR 151 N -3.90 0.00 -0.10 1.13 4.01 -0.24 -4.62 117.16 113.45 1o0l n TYR 151 Ca -0.08 -1.12 0.00 0.00 -0.16 0.00 0.00 57.90 56.54 1o0l n TYR 151 Cb 0.77 -0.21 0.00 0.00 -0.31 0.00 0.00 39.34 39.59 1o0l n TYR 151 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1o0l n GLY 152 N -0.60 5.28 0.17 2.72 0.00 -0.04 -4.28 105.19 108.45 1o0l n GLY 152 Ca 0.14 -1.50 -0.12 0.00 0.00 0.00 0.00 46.02 44.54 1o0l n GLY 152 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1o0l h ASP 153 N 0.00 -0.29 -0.13 1.61 3.32 -1.87 -3.30 116.42 115.76 1o0l h ASP 153 Ca 0.00 -0.24 -0.39 0.00 0.02 0.00 0.00 57.03 56.42 1o0l h ASP 153 Cb 0.00 0.07 -0.05 0.00 0.22 0.00 0.00 39.33 39.58 1o0l h ASP 153 CO 0.00 0.16 1.13 0.61 -1.72 0.00 0.00 179.24 179.42 1o0l n GLY 154 N 0.10 3.59 2.94 2.75 0.00 -1.26 -4.77 105.19 108.54 1o0l n GLY 154 Ca -0.09 -1.39 -0.42 0.00 0.00 0.00 0.00 46.02 44.12 1o0l n GLY 154 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o0l n ALA 155 N 2.68 5.11 -0.56 4.61 0.00 -1.16 -4.60 120.51 126.60 1o0l n ALA 155 Ca 0.56 -4.10 -0.29 0.00 0.00 0.00 0.00 53.44 49.60 1o0l n ALA 155 Cb 0.65 -3.26 0.22 0.00 0.00 0.00 0.00 19.45 17.06 1o0l n ALA 155 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 1o0l s LEU 156 N 1.34 1.60 0.43 0.00 2.34 -1.26 -4.62 118.68 118.52 1o0l s LEU 156 Ca 0.44 1.82 0.13 0.00 0.06 0.00 0.00 54.13 56.58 1o0l s LEU 156 Cb 0.10 -3.90 1.01 0.00 -0.56 0.00 0.00 46.19 42.84 1o0l s LEU 156 CO -0.02 -3.86 1.99 -0.33 -1.06 0.00 0.00 176.35 173.07 1o0l h GLU 157 N -2.39 0.41 -0.13 1.48 5.08 -1.99 -0.78 114.58 116.25 1o0l h GLU 157 Ca -0.54 -0.02 -0.08 0.00 -1.00 0.00 0.00 59.36 57.71 1o0l h GLU 157 Cb 1.31 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.47 1o0l h GLU 157 CO 0.46 0.27 -0.24 0.93 -1.00 0.00 0.00 179.01 179.44 1o0l h GLU 158 N 0.43 0.40 -0.29 2.33 4.39 -1.99 -2.62 114.58 117.22 1o0l h GLU 158 Ca 0.25 -0.25 0.00 0.00 0.34 0.00 0.00 59.36 59.71 1o0l h GLU 158 Cb 0.44 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 29.10 1o0l h GLU 158 CO -0.07 0.84 0.19 0.00 -1.16 0.00 0.00 179.01 178.82 1o0l h ALA 159 N 0.55 0.37 -0.51 3.43 0.00 -1.66 -0.66 119.26 120.78 1o0l h ALA 159 Ca 0.01 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 1o0l h ALA 159 Cb 0.82 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.47 1o0l h ALA 159 CO 0.05 -0.16 0.18 0.07 0.00 0.00 0.00 179.25 179.39 1o0l h ARG 160 N 0.40 0.79 0.00 0.00 0.11 -1.22 -0.26 114.38 114.19 1o0l h ARG 160 Ca 0.11 -0.16 -0.03 0.00 0.10 0.00 0.00 59.98 60.00 1o0l h ARG 160 Cb -0.04 -0.12 -0.00 0.00 1.11 0.00 0.00 29.97 30.91 1o0l h ARG 160 CO -0.03 0.72 -0.14 0.07 0.10 0.00 0.00 179.97 180.69 1o0l h ARG 161 N 0.70 0.00 0.06 0.08 0.11 -1.35 -2.82 114.38 111.15 1o0l h ARG 161 Ca 0.17 0.00 -0.09 0.00 0.10 0.00 0.00 59.98 60.15 1o0l h ARG 161 Cb 0.25 0.00 0.01 0.00 1.11 0.00 0.00 29.97 31.34 1o0l h ARG 161 CO -0.01 0.14 -0.40 -0.07 0.10 0.00 0.00 179.97 179.73 1o0l h LEU 162 N 0.00 0.26 -0.30 0.08 3.38 -0.63 -2.60 115.31 115.50 1o0l h LEU 162 Ca -0.00 -0.92 -0.01 0.00 0.09 0.00 0.00 57.88 57.04 1o0l h LEU 162 Cb 0.72 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 1o0l h LEU 162 CO 0.02 1.16 0.14 0.08 0.09 0.00 0.00 178.44 179.93 1o0l h ARG 163 N -0.60 0.43 -0.46 1.13 0.11 -1.05 0.15 114.38 114.10 1o0l h ARG 163 Ca -0.07 -0.06 -0.03 0.00 0.10 0.00 0.00 59.98 59.92 1o0l h ARG 163 Cb 1.27 -0.08 -0.02 0.00 1.11 0.00 0.00 29.97 32.25 1o0l h ARG 163 CO 0.08 0.41 0.19 0.93 0.10 0.00 0.00 179.97 181.67 1o0l h GLU 164 N 0.35 0.69 0.00 0.08 3.07 -1.64 -1.05 114.58 116.08 1o0l h GLU 164 Ca 0.10 -0.12 0.00 0.00 -0.50 0.00 0.00 59.36 58.84 1o0l h GLU 164 Cb 0.12 -0.11 0.00 0.00 -0.84 0.00 0.00 28.75 27.92 1o0l h GLU 164 CO -0.01 0.62 0.00 0.41 -1.40 0.00 0.00 179.01 178.63 1o0l n GLY 165 N -0.79 -1.12 0.07 -3.84 0.00 -0.98 -2.51 105.19 96.03 1o0l n GLY 165 Ca 0.01 -0.05 -0.05 0.00 0.00 0.00 0.00 46.02 45.92 1o0l n GLY 165 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1o0l h ASN 166 N 0.00 0.00 0.10 1.61 4.21 0.50 -3.36 115.58 118.64 1o0l h ASN 166 Ca 0.00 -0.14 -0.01 0.00 1.21 0.00 0.00 56.30 57.36 1o0l h ASN 166 Cb 0.31 0.00 -0.00 0.00 -1.12 0.00 0.00 38.32 37.51 1o0l h ASN 166 CO 0.00 0.76 -0.03 4.11 -1.29 0.00 0.00 177.43 180.97 1o0l h TRP 167 N -1.00 0.00 -0.89 1.19 5.08 -1.26 -1.66 115.95 117.41 1o0l h TRP 167 Ca -0.04 0.00 0.04 0.00 1.08 0.00 0.00 58.89 59.98 1o0l h TRP 167 Cb 0.44 0.00 -0.06 0.00 -3.00 0.00 0.00 29.16 26.54 1o0l h TRP 167 CO -0.06 0.03 0.57 0.00 -1.28 0.00 0.00 178.44 177.71 1o0l h ALA 168 N 1.97 1.18 0.00 0.11 0.00 -1.64 0.29 119.26 121.17 1o0l h ALA 168 Ca -0.00 -0.03 -0.22 0.00 0.00 0.00 0.00 54.91 54.66 1o0l h ALA 168 Cb 0.09 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.56 1o0l h ALA 168 CO 0.00 0.39 -1.41 0.77 0.00 0.00 0.00 179.25 179.01 1o0l h SER 169 N 1.08 0.00 0.08 0.00 0.02 -1.48 -3.34 113.55 109.92 1o0l h SER 169 Ca 0.36 0.00 -0.34 0.00 -0.84 0.00 0.00 61.79 60.97 1o0l h SER 169 Cb 0.05 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.57 1o0l h SER 169 CO -0.13 0.80 -1.88 1.33 -1.14 0.00 0.00 176.83 175.81 1o0l n VAL 170 N -3.04 1.70 0.22 2.27 0.24 -0.72 -3.14 118.33 115.85 1o0l n VAL 170 Ca -0.10 -0.49 0.09 0.00 -2.04 0.00 0.00 64.34 61.79 1o0l n VAL 170 Cb 0.93 -1.79 0.47 0.00 -1.47 0.00 0.00 33.84 31.98 1o0l n VAL 170 CO 0.00 0.00 0.00 0.08 -2.14 0.00 0.00 176.83 174.77 1o0l h ARG 171 N -0.22 0.00 -0.00 7.34 0.11 -0.65 -2.69 114.38 118.26 1o0l h ARG 171 Ca -0.43 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.65 1o0l h ARG 171 Cb 1.84 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.92 1o0l h ARG 171 CO -0.01 0.25 -0.66 2.41 0.10 0.00 0.00 179.97 182.06 1o0l n THR 172 N -3.49 0.00 0.11 0.08 -1.04 -1.25 -3.28 114.28 105.41 1o0l n THR 172 Ca -0.00 -0.00 0.05 0.00 -2.04 0.00 0.00 64.05 62.06 1o0l n THR 172 Cb 0.41 0.49 0.01 0.00 -1.82 0.00 0.00 70.33 69.42 1o0l n THR 172 CO 0.00 0.00 0.00 1.62 -0.64 0.00 0.00 175.07 176.05 1o0l h VAL 173 N 0.01 0.40 -0.77 12.58 3.04 -1.43 -3.31 116.25 126.78 1o0l h VAL 173 Ca 0.00 -1.65 -0.55 0.00 -1.01 0.00 0.00 66.70 63.49 1o0l h VAL 173 Cb 0.50 2.01 -0.43 0.00 -2.01 0.00 0.00 31.29 31.36 1o0l h VAL 173 CO 0.00 0.23 -0.82 0.18 -1.01 0.00 0.00 177.57 176.14 1o0l n LEU 174 N -2.97 4.86 0.25 3.16 4.77 -1.16 -4.77 117.00 121.16 1o0l n LEU 174 Ca -0.02 -4.74 0.14 0.00 -0.03 0.00 0.00 56.01 51.36 1o0l n LEU 174 Cb 0.69 -0.33 0.62 0.00 -2.33 0.00 0.00 43.42 42.07 1o0l n LEU 174 CO 0.40 2.10 0.92 0.71 -1.33 0.00 0.00 177.39 180.18 1o0l h THR 175 N 2.25 0.32 -0.05 -5.08 1.35 -1.64 -2.98 112.91 107.07 1o0l h THR 175 Ca 0.36 -0.75 0.00 0.00 -0.55 0.00 0.00 66.41 65.47 1o0l h THR 175 Cb 1.52 1.57 0.00 0.00 -1.73 0.00 0.00 68.15 69.51 1o0l h THR 175 CO 0.75 0.11 0.00 0.61 -0.25 0.00 0.00 175.52 176.74 1o0l n GLY 176 N -0.07 -0.75 0.00 5.82 0.00 -1.26 -3.87 105.19 105.06 1o0l n GLY 176 Ca -0.00 -0.06 0.03 0.00 0.00 0.00 0.00 46.02 45.99 1o0l n GLY 176 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1o0l n ALA 177 N -0.35 2.38 -1.60 4.61 0.00 -1.13 -4.44 120.51 119.99 1o0l n ALA 177 Ca 0.02 -0.04 -0.41 0.00 0.00 0.00 0.00 53.44 53.01 1o0l n ALA 177 Cb 0.05 -1.11 -0.01 0.00 0.00 0.00 0.00 19.45 18.37 1o0l n ALA 177 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1o0l n VAL 178 N -0.63 3.98 -0.57 0.00 0.31 -1.25 -4.47 118.33 115.69 1o0l n VAL 178 Ca 0.05 -2.98 0.10 0.00 -0.01 0.00 0.00 64.34 61.50 1o0l n VAL 178 Cb 0.02 -2.57 0.34 0.00 -0.91 0.00 0.00 33.84 30.72 1o0l n VAL 178 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1o0l n ALA 179 N 4.65 2.91 -0.14 3.52 0.00 -1.26 -4.35 120.51 125.84 1o0l n ALA 179 Ca 0.63 -1.56 -0.26 0.00 0.00 0.00 0.00 53.44 52.26 1o0l n ALA 179 Cb 0.31 -0.96 -0.11 0.00 0.00 0.00 0.00 19.45 18.70 1o0l n ALA 179 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1o0l n LEU 180 N 1.14 2.29 -4.57 0.00 4.32 -1.26 -4.87 117.00 114.06 1o0l n LEU 180 Ca 0.25 0.18 -0.41 0.00 -0.02 0.00 0.00 56.01 56.00 1o0l n LEU 180 Cb 0.82 -0.85 -0.03 0.00 -1.62 0.00 0.00 43.42 41.75 1o0l n LEU 180 CO 0.22 0.70 1.23 -0.83 -1.22 0.00 0.00 177.39 177.48 1o0l s GLY 181 N -5.84 0.88 0.00 -0.72 0.00 -1.26 -3.81 107.32 96.57 1o0l s GLY 181 Ca -0.37 -0.90 0.25 0.00 0.00 0.00 0.00 44.72 43.70 1o0l s GLY 181 CO 0.52 2.75 1.41 0.00 0.00 0.00 0.00 173.10 177.79 1o0l n ALA 182 N 9.56 3.06 -2.00 3.20 0.00 -1.26 -5.06 120.51 128.01 1o0l n ALA 182 Ca 0.10 -0.52 0.00 0.00 0.00 0.00 0.00 53.44 53.01 1o0l n ALA 182 Cb 0.49 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 18.95 1o0l n ALA 182 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39