#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1o0l s PRO -3 N 0.00 2.47 -0.03 1.61 0.02 -1.26 -4.98 135.00 132.83 1o0l s PRO -3 Ca 0.00 1.97 -0.01 0.00 0.02 0.00 0.00 61.00 62.98 1o0l s PRO -3 Cb 0.00 -1.85 -0.02 0.00 0.02 0.00 0.00 34.50 32.66 1o0l s PRO -3 CO 0.00 -1.64 -0.04 1.28 -0.33 0.00 0.00 177.00 176.28 1o0l n LEU -2 N -2.10 1.05 0.00 -5.54 4.32 -1.26 -5.14 117.00 108.34 1o0l n LEU -2 Ca 0.15 0.02 0.04 0.00 -0.02 0.00 0.00 56.01 56.20 1o0l n LEU -2 Cb 0.49 -0.10 -0.01 0.00 -1.62 0.00 0.00 43.42 42.18 1o0l n LEU -2 CO 0.47 0.21 -0.05 0.61 -1.22 0.00 0.00 177.39 177.41 1o0l n GLY -1 N 2.97 -2.05 3.54 -0.72 0.00 -1.26 -4.98 105.19 102.69 1o0l n GLY -1 Ca -0.06 -1.40 -0.23 0.00 0.00 0.00 0.00 46.02 44.34 1o0l n GLY -1 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1o0l n SER 0 N -1.27 -5.86 -4.83 1.61 7.64 -1.26 -4.96 113.62 104.69 1o0l n SER 0 Ca 0.00 -0.80 -0.37 0.00 1.01 0.00 0.00 58.87 58.71 1o0l n SER 0 Cb 0.12 -3.62 -0.06 0.00 -1.01 0.00 0.00 64.21 59.64 1o0l n SER 0 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 1o0l s MET 1 N -5.09 4.06 0.02 1.43 -1.94 -1.26 -5.08 119.30 111.43 1o0l s MET 1 Ca 0.30 0.57 -0.05 0.00 -1.71 0.00 0.00 55.69 54.81 1o0l s MET 1 Cb -0.10 -3.14 -0.01 0.00 2.01 0.00 0.00 34.83 33.59 1o0l s MET 1 CO 0.84 0.60 0.07 0.00 -0.01 0.00 0.00 175.02 176.52 1o0l s ALA 2 N -1.21 -0.12 -0.12 3.03 0.00 -1.26 -5.16 121.76 116.91 1o0l s ALA 2 Ca 0.30 -0.37 -0.04 0.00 0.00 0.00 0.00 51.96 51.85 1o0l s ALA 2 Cb -0.17 0.15 -0.04 0.00 0.00 0.00 0.00 23.12 23.06 1o0l s ALA 2 CO 0.18 -0.22 0.03 0.95 0.00 0.00 0.00 175.76 176.70 1o0l s THR 3 N -1.68 4.52 -0.14 0.00 -4.23 -1.26 -5.09 115.64 107.76 1o0l s THR 3 Ca -0.13 -0.15 -0.24 0.00 -1.18 0.00 0.00 61.69 59.98 1o0l s THR 3 Cb -0.07 -2.96 -0.02 0.00 1.34 0.00 0.00 72.50 70.79 1o0l s THR 3 CO -0.01 0.55 0.77 -2.16 -0.54 0.00 0.00 174.62 173.24 1o0l s PRO 4 N -0.40 4.33 0.09 3.99 0.05 -1.26 -5.03 135.00 136.77 1o0l s PRO 4 Ca 0.08 0.94 -0.31 0.00 0.05 0.00 0.00 61.00 61.76 1o0l s PRO 4 Cb -0.12 -3.53 -0.07 0.00 0.05 0.00 0.00 34.50 30.82 1o0l s PRO 4 CO 0.02 -0.19 1.34 0.00 0.05 0.00 0.00 177.00 178.22 1o0l s ALA 5 N 1.69 3.54 0.07 8.56 0.00 -1.26 -5.02 121.76 129.34 1o0l s ALA 5 Ca 0.37 1.02 0.01 0.00 0.00 0.00 0.00 51.96 53.36 1o0l s ALA 5 Cb -0.17 -3.52 -0.04 0.00 0.00 0.00 0.00 23.12 19.39 1o0l s ALA 5 CO 0.14 -0.61 -0.05 -1.12 0.00 0.00 0.00 175.76 174.12 1o0l s SER 6 N 1.20 0.85 0.10 0.00 0.01 -1.26 -5.16 113.70 109.44 1o0l s SER 6 Ca 0.63 -0.97 -0.14 0.00 1.31 0.00 0.00 55.95 56.78 1o0l s SER 6 Cb -0.34 0.13 -0.06 0.00 0.21 0.00 0.00 66.02 65.96 1o0l s SER 6 CO 0.29 -0.50 0.50 0.00 0.41 0.00 0.00 173.24 173.94 1o0l s ALA 7 N -3.59 3.63 -1.21 1.44 0.00 -1.26 -4.99 121.76 115.79 1o0l s ALA 7 Ca 0.08 -0.17 -0.20 0.00 0.00 0.00 0.00 51.96 51.67 1o0l s ALA 7 Cb 0.05 -2.46 -0.02 0.00 0.00 0.00 0.00 23.12 20.69 1o0l s ALA 7 CO -0.06 0.47 1.89 -2.30 0.00 0.00 0.00 175.76 175.76 1o0l n PRO 8 N 1.13 2.34 -0.47 0.00 -0.02 -1.26 -4.86 135.00 131.87 1o0l n PRO 8 Ca -0.08 -2.72 -0.02 0.00 -2.02 0.00 0.00 63.50 58.66 1o0l n PRO 8 Cb 0.52 -3.49 0.02 0.00 -0.02 0.00 0.00 33.50 30.52 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 10.30 0.06 -0.25 2.55 2.03 -1.26 -4.74 116.55 125.25 1o0l n ASP 9 Ca 0.48 -1.07 0.08 0.00 0.52 0.00 0.00 54.79 54.80 1o0l n ASP 9 Cb 0.45 -0.08 0.34 0.00 -0.72 0.00 0.00 41.12 41.11 1o0l n ASP 9 CO 0.00 0.00 0.00 0.74 -1.92 0.00 0.00 177.20 176.02 1o0l h THR 10 N -0.75 0.95 -0.39 5.18 2.02 -1.98 0.11 112.91 118.05 1o0l h THR 10 Ca -0.04 -0.27 -0.07 0.00 0.77 0.00 0.00 66.41 66.81 1o0l h THR 10 Cb 0.11 0.10 -0.02 0.00 -1.74 0.00 0.00 68.15 66.60 1o0l h THR 10 CO 0.03 0.14 -0.04 -0.09 0.37 0.00 0.00 175.52 175.94 1o0l h ARG 11 N 0.78 0.65 0.01 6.66 2.43 -1.95 0.46 114.38 123.42 1o0l h ARG 11 Ca 0.39 -0.17 -0.24 0.00 -0.81 0.00 0.00 59.98 59.15 1o0l h ARG 11 Cb 0.45 -0.08 0.01 0.00 -0.42 0.00 0.00 29.97 29.93 1o0l h ARG 11 CO -0.16 0.69 -0.98 0.00 -1.51 0.00 0.00 179.97 178.01 1o0l h ALA 12 N 1.36 0.30 -0.29 2.80 0.00 -1.47 -2.40 119.26 119.55 1o0l h ALA 12 Ca 0.12 -0.72 -0.14 0.00 0.00 0.00 0.00 54.91 54.17 1o0l h ALA 12 Cb 0.44 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 1o0l h ALA 12 CO 0.02 0.80 -0.36 1.25 0.00 0.00 0.00 179.25 180.96 1o0l h LEU 13 N 0.25 0.83 -1.04 0.00 5.85 -0.42 -0.93 115.31 119.85 1o0l h LEU 13 Ca -0.09 -0.49 -0.08 0.00 0.84 0.00 0.00 57.88 58.05 1o0l h LEU 13 Cb 1.63 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 42.41 1o0l h LEU 13 CO 0.17 1.15 -0.18 1.62 -0.34 0.00 0.00 178.44 180.87 1o0l h VAL 14 N 0.52 1.24 0.00 1.05 3.04 -0.14 -1.29 116.25 120.67 1o0l h VAL 14 Ca 0.04 -1.12 -0.01 0.00 -1.01 0.00 0.00 66.70 64.60 1o0l h VAL 14 Cb 0.95 1.24 -0.00 0.00 -2.01 0.00 0.00 31.29 31.47 1o0l h VAL 14 CO 0.09 0.36 -0.06 0.00 -1.01 0.00 0.00 177.57 176.95 1o0l h ALA 15 N 1.38 0.99 0.05 3.17 0.00 -1.28 -2.51 119.26 121.06 1o0l h ALA 15 Ca 0.07 -0.05 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1o0l h ALA 15 Cb 0.56 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1o0l h ALA 15 CO 0.04 0.07 -0.03 0.22 0.00 0.00 0.00 179.25 179.56 1o0l h ASP 16 N 0.00 -0.06 0.03 0.00 3.58 -0.09 -0.80 116.42 119.08 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 0.75 0.02 -0.03 0.00 1.72 0.00 0.00 39.33 41.78 1o0l h ASP 16 CO 0.01 0.19 -0.17 0.15 -2.88 0.00 0.00 179.24 176.54 1o0l h PHE 17 N -0.55 -0.44 -0.37 0.28 3.57 -1.41 0.47 116.94 118.49 1o0l h PHE 17 Ca -0.01 0.01 -0.13 0.00 3.53 0.00 0.00 57.97 61.38 1o0l h PHE 17 Cb 0.05 0.19 -0.01 0.00 2.79 0.00 0.00 35.95 38.98 1o0l h PHE 17 CO 0.01 -0.25 -0.28 0.28 -2.23 0.00 0.00 178.31 175.85 1o0l h VAL 18 N -0.30 1.28 0.23 1.41 2.07 -1.64 -0.92 116.25 118.39 1o0l h VAL 18 Ca 0.04 -1.41 -0.01 0.00 0.82 0.00 0.00 66.70 66.14 1o0l h VAL 18 Cb 0.35 1.29 0.00 0.00 -1.52 0.00 0.00 31.29 31.41 1o0l h VAL 18 CO -0.14 0.47 -0.11 1.23 0.02 0.00 0.00 177.57 179.03 1o0l h GLY 19 N 0.95 -0.33 0.97 2.17 0.00 -0.66 0.13 103.07 106.31 1o0l h GLY 19 Ca 0.08 0.12 -0.02 0.00 0.00 0.00 0.00 47.33 47.52 1o0l h GLY 19 CO 0.07 -0.12 0.23 -1.82 0.00 0.00 0.00 176.54 174.90 1o0l h TYR 20 N -0.43 0.67 -0.73 5.60 3.20 -0.08 0.36 116.97 125.56 1o0l h TYR 20 Ca -0.03 -0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.78 1o0l h TYR 20 Cb 0.32 -0.21 -0.03 0.00 1.54 0.00 0.00 36.73 38.35 1o0l h TYR 20 CO -0.03 0.53 0.35 0.87 -1.64 0.00 0.00 178.16 178.25 1o0l h LYS 21 N 0.61 1.06 -0.10 1.82 1.79 -1.09 -0.55 116.57 120.11 1o0l h LYS 21 Ca 0.16 -0.16 -0.14 0.00 -2.18 0.00 0.00 60.65 58.34 1o0l h LYS 21 Cb 0.11 -0.19 0.01 0.00 -1.58 0.00 0.00 32.23 30.58 1o0l h LYS 21 CO -0.02 0.83 -0.47 -0.07 -1.08 0.00 0.00 179.45 178.64 1o0l h LEU 22 N 1.03 0.59 -1.62 2.94 4.07 -0.53 -2.91 115.31 118.89 1o0l h LEU 22 Ca 0.25 -0.64 0.07 0.00 0.08 0.00 0.00 57.88 57.64 1o0l h LEU 22 Cb 0.12 -0.17 -0.03 0.00 1.08 0.00 0.00 40.66 41.65 1o0l h LEU 22 CO -0.03 1.13 0.36 0.03 -1.08 0.00 0.00 178.44 178.85 1o0l h ARG 23 N 0.09 0.45 -0.00 1.13 3.08 -0.08 0.54 114.38 119.59 1o0l h ARG 23 Ca -0.03 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.99 1o0l h ARG 23 Cb 1.11 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 31.06 1o0l h ARG 23 CO 0.10 0.30 -0.28 0.00 -1.07 0.00 0.00 179.97 179.01 1o0l n GLN 24 N -4.47 0.20 0.05 0.04 10.64 -0.23 -3.17 117.38 120.44 1o0l n GLN 24 Ca 0.08 -0.09 0.00 0.00 -1.83 0.00 0.00 57.00 55.16 1o0l n GLN 24 Cb 0.27 -1.50 0.00 0.00 -0.86 0.00 0.00 30.24 28.15 1o0l n GLN 24 CO 0.00 0.00 0.00 1.63 -1.83 0.00 0.00 177.06 176.86 1o0l n LYS 25 N -1.32 0.00 -0.03 2.61 5.02 -0.36 -4.99 118.16 119.09 1o0l n LYS 25 Ca 0.08 0.00 -0.06 0.00 -2.02 0.00 0.00 58.31 56.31 1o0l n LYS 25 Cb 0.33 -0.47 -0.02 0.00 -0.02 0.00 0.00 35.03 34.85 1o0l n LYS 25 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1o0l n GLY 26 N 3.33 -0.09 2.04 0.72 0.00 0.12 -4.74 105.19 106.57 1o0l n GLY 26 Ca 0.00 -0.03 -0.13 0.00 0.00 0.00 0.00 46.02 45.86 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 -3.15 0.22 0.10 1.61 9.36 0.15 -4.31 117.16 121.14 1o0l n TYR 27 Ca -0.11 -1.54 -0.02 0.00 3.32 0.00 0.00 57.90 59.56 1o0l n TYR 27 Cb 0.58 -1.51 -0.03 0.00 -0.63 0.00 0.00 39.34 37.75 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 1.94 1.28 -0.27 2.97 3.04 -1.68 -3.25 116.25 120.28 1o0l h VAL 28 Ca 0.21 -2.76 -0.12 0.00 -1.01 0.00 0.00 66.70 63.02 1o0l h VAL 28 Cb 1.39 2.60 -0.00 0.00 -2.01 0.00 0.00 31.29 33.26 1o0l h VAL 28 CO 0.31 0.72 -0.32 0.00 -1.01 0.00 0.00 177.57 177.27 1o0l n GLY 30 N 0.22 5.04 3.63 0.00 0.00 -1.23 -4.96 105.19 107.90 1o0l n GLY 30 Ca -0.04 -1.99 -0.42 0.00 0.00 0.00 0.00 46.02 43.57 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 -0.94 3.23 0.00 4.61 0.00 -1.23 -4.32 121.76 123.10 1o0l s ALA 31 Ca 0.56 0.97 0.00 0.00 0.00 0.00 0.00 51.96 53.49 1o0l s ALA 31 Cb 0.20 -3.92 0.00 0.00 0.00 0.00 0.00 23.12 19.40 1o0l s ALA 31 CO -0.10 -2.06 0.00 0.41 0.00 0.00 0.00 175.76 174.00 1o0l n GLY 32 N 4.98 -1.00 0.05 0.00 0.00 -1.26 -4.97 105.19 102.99 1o0l n GLY 32 Ca 0.23 0.24 -0.12 0.00 0.00 0.00 0.00 46.02 46.37 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 -0.02 -1.02 1.61 0.11 -1.86 -2.37 132.00 128.45 1o0l h PRO 33 Ca 0.00 0.00 -0.21 0.00 0.11 0.00 0.00 66.00 65.90 1o0l h PRO 33 Cb 0.00 0.01 -0.12 0.00 0.11 0.00 0.00 31.00 30.99 1o0l h PRO 33 CO 0.00 0.01 0.27 0.41 -0.21 0.00 0.00 178.00 178.48 1o0l n GLY 34 N -1.03 3.03 0.30 -0.55 0.00 -1.23 -4.35 105.19 101.36 1o0l n GLY 34 Ca -0.07 -0.45 -0.07 0.00 0.00 0.00 0.00 46.02 45.43 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 0.43 0.95 -5.56 1.61 4.11 -1.78 -3.43 114.58 110.92 1o0l h GLU 35 Ca 0.26 -0.28 -0.66 0.00 0.07 0.00 0.00 59.36 58.75 1o0l h GLU 35 Cb 1.73 -0.10 -0.22 0.00 0.50 0.00 0.00 28.75 30.66 1o0l h GLU 35 CO 0.45 0.94 -0.70 0.20 0.07 0.00 0.00 179.01 179.97 1o0l s GLY 36 N -3.64 1.67 0.00 1.06 0.00 -1.26 -5.07 107.32 100.07 1o0l s GLY 36 Ca -0.11 -0.86 0.00 0.00 0.00 0.00 0.00 44.72 43.76 1o0l s GLY 36 CO 0.84 -0.28 0.00 -1.55 0.00 0.00 0.00 173.10 172.11 1o0l n PRO 37 N 3.14 3.51 -1.96 2.90 -0.04 -1.26 -4.95 135.00 136.34 1o0l n PRO 37 Ca -0.18 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 62.87 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 s ALA 38 N -3.53 2.61 0.00 0.55 0.00 -1.26 -4.57 121.76 115.56 1o0l s ALA 38 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 51.96 52.03 1o0l s ALA 38 Cb 0.00 -4.11 0.00 0.00 0.00 0.00 0.00 23.12 19.01 1o0l s ALA 38 CO 0.00 -3.06 0.00 0.00 0.00 0.00 0.00 175.76 172.70 1o0l n ALA 39 N 11.32 0.85 -1.83 0.00 0.00 -1.26 -4.69 120.51 124.90 1o0l n ALA 39 Ca 0.24 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.37 1o0l n ALA 39 Cb 0.48 0.00 0.04 0.00 0.00 0.00 0.00 19.45 19.98 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 -1.46 5.48 0.00 0.00 1.01 -1.26 -4.86 116.67 115.58 1o0l s ASP 40 Ca 0.00 1.23 -0.05 0.00 0.71 0.00 0.00 52.55 54.44 1o0l s ASP 40 Cb 0.00 -2.07 -0.21 0.00 1.01 0.00 0.00 42.92 41.65 1o0l s ASP 40 CO 0.00 -1.33 3.09 -0.81 0.21 0.00 0.00 175.17 176.34 1o0l n PRO 41 N -3.01 1.67 0.00 8.23 -0.04 -1.26 -2.02 135.00 138.57 1o0l n PRO 41 Ca 0.07 -0.78 0.00 0.00 -0.04 0.00 0.00 63.50 62.75 1o0l n PRO 41 Cb 0.56 -1.83 0.00 0.00 -0.04 0.00 0.00 33.50 32.19 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 2.42 0.00 0.39 1.53 -0.00 -1.26 -4.23 117.00 115.86 1o0l n LEU 42 Ca 0.33 0.00 -0.17 0.00 -0.00 0.00 0.00 56.01 56.17 1o0l n LEU 42 Cb 0.77 0.00 -0.09 0.00 -0.00 0.00 0.00 43.42 44.11 1o0l n LEU 42 CO 0.12 0.00 0.54 0.45 -0.00 0.00 0.00 177.39 178.50 1o0l h HIS 43 N 0.00 -0.92 -0.08 1.47 3.86 -1.77 -0.37 115.15 117.34 1o0l h HIS 43 Ca 0.00 -0.02 0.02 0.00 -1.16 0.00 0.00 60.37 59.21 1o0l h HIS 43 Cb 0.00 0.31 -0.00 0.00 1.06 0.00 0.00 27.41 28.77 1o0l h HIS 43 CO 0.00 -0.55 0.07 1.96 0.86 0.00 0.00 177.93 180.27 1o0l h GLN 44 N -1.11 0.00 0.28 2.45 4.20 -1.81 -0.64 115.11 118.48 1o0l h GLN 44 Ca -0.10 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.59 1o0l h GLN 44 Cb 0.78 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.57 1o0l h GLN 44 CO 0.17 0.00 -0.13 0.00 -0.67 0.00 0.00 178.83 178.19 1o0l h ALA 45 N 1.94 -0.38 -0.36 3.87 0.00 -1.72 -2.69 119.26 119.92 1o0l h ALA 45 Ca 0.04 -0.20 -0.11 0.00 0.00 0.00 0.00 54.91 54.65 1o0l h ALA 45 Cb 0.18 0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1o0l h ALA 45 CO -0.00 -0.48 -0.21 1.98 0.00 0.00 0.00 179.25 180.54 1o0l h MET 46 N -0.83 0.70 -0.67 0.00 4.05 -0.69 -1.56 114.93 115.93 1o0l h MET 46 Ca -0.04 -0.27 -0.02 0.00 -0.28 0.00 0.00 59.70 59.09 1o0l h MET 46 Cb 0.51 -0.04 -0.03 0.00 -0.80 0.00 0.00 31.60 31.24 1o0l h MET 46 CO 0.06 0.85 0.33 -0.09 0.23 0.00 0.00 176.91 178.29 1o0l h ARG 47 N 0.62 0.95 0.21 0.39 2.43 -1.20 0.21 114.38 117.99 1o0l h ARG 47 Ca 0.09 -0.12 -0.29 0.00 -0.81 0.00 0.00 59.98 58.85 1o0l h ARG 47 Cb 0.69 -0.18 0.03 0.00 -0.42 0.00 0.00 29.97 30.09 1o0l h ARG 47 CO 0.05 0.73 -1.29 0.00 -1.51 0.00 0.00 179.97 177.95 1o0l h ALA 48 N 1.41 -0.11 0.33 2.80 0.00 -1.35 -2.85 119.26 119.49 1o0l h ALA 48 Ca 0.23 -0.84 -0.01 0.00 0.00 0.00 0.00 54.91 54.30 1o0l h ALA 48 Cb 0.09 0.18 -0.00 0.00 0.00 0.00 0.00 17.79 18.06 1o0l h ALA 48 CO -0.03 0.62 -0.19 0.00 0.00 0.00 0.00 179.25 179.65 1o0l h ALA 49 N 0.12 -0.49 -0.54 0.00 0.00 -1.14 -1.35 119.26 115.86 1o0l h ALA 49 Ca -0.23 -0.10 0.11 0.00 0.00 0.00 0.00 54.91 54.69 1o0l h ALA 49 Cb 1.99 0.23 -0.09 0.00 0.00 0.00 0.00 17.79 19.91 1o0l h ALA 49 CO 0.22 -0.78 -0.01 0.78 0.00 0.00 0.00 179.25 179.47 1o0l h GLY 50 N -0.49 0.55 0.71 0.00 0.00 -0.69 0.12 103.07 103.27 1o0l h GLY 50 Ca -0.04 0.08 0.03 0.00 0.00 0.00 0.00 47.33 47.40 1o0l h GLY 50 CO 0.05 -0.16 -0.01 -1.80 0.00 0.00 0.00 176.54 174.62 1o0l h ASP 51 N 0.11 -0.09 -0.53 0.19 3.58 -1.24 0.91 116.42 119.36 1o0l h ASP 51 Ca 0.27 0.04 -0.01 0.00 0.42 0.00 0.00 57.03 57.75 1o0l h ASP 51 Cb 0.43 0.08 -0.02 0.00 1.72 0.00 0.00 39.33 41.53 1o0l h ASP 51 CO -0.46 -0.02 0.28 -0.08 -2.88 0.00 0.00 179.24 176.08 1o0l h GLU 52 N 0.05 0.74 -0.06 0.28 4.81 -0.47 -1.77 114.58 118.15 1o0l h GLU 52 Ca 0.08 -0.10 -0.16 0.00 -0.13 0.00 0.00 59.36 59.05 1o0l h GLU 52 Cb 0.11 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.34 1o0l h GLU 52 CO -0.15 0.59 -0.68 0.74 -0.73 0.00 0.00 179.01 178.78 1o0l h PHE 53 N 0.70 0.37 0.00 0.92 -1.00 -0.47 -1.69 116.94 115.78 1o0l h PHE 53 Ca 0.18 -0.16 -0.02 0.00 2.81 0.00 0.00 57.97 60.78 1o0l h PHE 53 Cb 0.07 -0.06 -0.00 0.00 3.61 0.00 0.00 35.95 39.57 1o0l h PHE 53 CO -0.01 0.87 -0.12 1.49 -1.61 0.00 0.00 178.31 178.94 1o0l h GLU 54 N 0.20 0.00 0.00 1.51 4.81 0.12 1.08 114.58 122.29 1o0l h GLU 54 Ca -0.02 0.00 -0.16 0.00 -0.13 0.00 0.00 59.36 59.06 1o0l h GLU 54 Cb 1.23 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.58 1o0l h GLU 54 CO 0.11 0.12 -1.27 1.15 -0.73 0.00 0.00 179.01 178.38 1o0l h THR 55 N 0.00 0.55 0.00 0.32 2.02 -1.03 -3.40 112.91 111.36 1o0l h THR 55 Ca -0.00 -2.02 -0.22 0.00 0.77 0.00 0.00 66.41 64.94 1o0l h THR 55 Cb 0.26 2.08 -0.03 0.00 -1.74 0.00 0.00 68.15 68.72 1o0l h THR 55 CO 0.02 0.31 -1.73 0.54 0.37 0.00 0.00 175.52 175.03 1o0l n ARG 56 N -2.94 0.56 -2.33 6.66 1.74 -0.66 -4.71 116.66 114.99 1o0l n ARG 56 Ca -0.08 0.24 -0.43 0.00 -0.77 0.00 0.00 57.85 56.81 1o0l n ARG 56 Cb 0.82 -1.46 0.00 0.00 -1.02 0.00 0.00 32.46 30.80 1o0l n ARG 56 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1o0l n PHE 57 N -4.36 3.75 0.32 -1.55 7.35 0.36 -4.73 117.46 118.60 1o0l n PHE 57 Ca -0.33 -2.96 0.15 0.00 -0.76 0.00 0.00 57.45 53.54 1o0l n PHE 57 Cb 0.69 -2.26 0.49 0.00 0.35 0.00 0.00 39.48 38.75 1o0l n PHE 57 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1o0l h ARG 58 N 6.34 0.00 -2.89 -4.13 -0.00 -1.78 -3.36 114.38 108.57 1o0l h ARG 58 Ca 0.44 0.00 -0.58 0.00 -0.50 0.00 0.00 59.98 59.33 1o0l h ARG 58 Cb 0.71 0.00 0.01 0.00 0.00 0.00 0.00 29.97 30.70 1o0l h ARG 58 CO 1.60 0.00 3.17 -2.13 0.00 0.00 0.00 179.97 182.61 1o0l n ARG 59 N -2.85 3.35 0.00 0.04 0.63 -1.26 -3.96 116.66 112.61 1o0l n ARG 59 Ca 0.02 -1.97 0.00 0.00 -0.92 0.00 0.00 57.85 54.98 1o0l n ARG 59 Cb 0.36 -2.66 0.00 0.00 0.45 0.00 0.00 32.46 30.62 1o0l n ARG 59 CO 0.00 0.00 0.00 0.25 -2.51 0.00 0.00 177.63 175.37 1o0l n THR 60 N 3.46 0.00 0.23 5.15 -2.24 -1.26 -4.76 114.28 114.88 1o0l n THR 60 Ca 0.71 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 62.57 1o0l n THR 60 Cb 0.32 -1.34 0.57 0.00 -2.10 0.00 0.00 70.33 67.78 1o0l n THR 60 CO 0.00 0.00 0.00 -0.26 -0.57 0.00 0.00 175.07 174.24 1o0l h PHE 61 N 0.00 0.00 -0.37 4.78 0.04 -1.91 -2.66 116.94 116.82 1o0l h PHE 61 Ca 0.00 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.74 1o0l h PHE 61 Cb 0.95 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.08 1o0l h PHE 61 CO 0.00 0.17 0.11 0.77 -0.60 0.00 0.00 178.31 178.76 1o0l h SER 62 N 0.00 0.48 1.34 2.17 0.02 -1.85 -1.44 113.55 114.27 1o0l h SER 62 Ca -0.00 -0.06 0.00 0.00 -0.84 0.00 0.00 61.79 60.89 1o0l h SER 62 Cb 0.34 -0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.76 1o0l h SER 62 CO 0.02 0.47 0.00 0.44 -1.14 0.00 0.00 176.83 176.63 1o0l h ASP 63 N 0.53 0.00 -0.10 3.07 5.19 -1.77 -1.05 116.42 122.28 1o0l h ASP 63 Ca 0.13 0.00 -0.21 0.00 -0.62 0.00 0.00 57.03 56.33 1o0l h ASP 63 Cb 0.17 0.00 0.01 0.00 0.18 0.00 0.00 39.33 39.69 1o0l h ASP 63 CO -0.01 0.00 -0.73 -0.07 -3.12 0.00 0.00 179.24 175.32 1o0l h LEU 64 N 0.00 0.87 -0.01 1.55 4.07 -1.31 -2.30 115.31 118.18 1o0l h LEU 64 Ca 0.00 -0.55 -0.05 0.00 0.08 0.00 0.00 57.88 57.36 1o0l h LEU 64 Cb 0.67 -0.26 0.00 0.00 1.08 0.00 0.00 40.66 42.16 1o0l h LEU 64 CO 0.00 1.34 -0.19 0.00 -1.08 0.00 0.00 178.44 178.51 1o0l h ALA 65 N 0.65 0.04 -0.80 1.53 0.00 -1.32 -2.36 119.26 117.00 1o0l h ALA 65 Ca -0.04 -0.44 0.15 0.00 0.00 0.00 0.00 54.91 54.59 1o0l h ALA 65 Cb 1.34 0.01 -0.10 0.00 0.00 0.00 0.00 17.79 19.04 1o0l h ALA 65 CO 0.15 0.04 0.35 0.00 0.00 0.00 0.00 179.25 179.79 1o0l h ALA 66 N 0.28 1.17 0.43 0.00 0.00 -1.25 0.19 119.26 120.09 1o0l h ALA 66 Ca -0.02 0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1o0l h ALA 66 Cb 0.93 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.79 1o0l h ALA 66 CO 0.04 -0.19 -0.21 1.96 0.00 0.00 0.00 179.25 180.85 1o0l h GLN 67 N 0.49 -0.56 -0.65 0.00 4.20 -1.47 -3.28 115.11 113.84 1o0l h GLN 67 Ca 0.44 0.04 0.00 0.00 0.06 0.00 0.00 58.65 59.19 1o0l h GLN 67 Cb 0.68 0.13 0.00 0.00 0.30 0.00 0.00 27.48 28.59 1o0l h GLN 67 CO -0.41 -0.28 0.00 1.28 -0.67 0.00 0.00 178.83 178.75 1o0l n LEU 68 N -5.18 1.11 0.09 1.46 7.99 -0.89 -3.77 117.00 117.81 1o0l n LEU 68 Ca -0.09 -0.56 -0.12 0.00 -0.01 0.00 0.00 56.01 55.23 1o0l n LEU 68 Cb 0.28 -0.36 -0.08 0.00 -0.11 0.00 0.00 43.42 43.15 1o0l n LEU 68 CO 0.24 0.22 0.10 -0.74 -1.51 0.00 0.00 177.39 175.70 1o0l h HIS 69 N 0.42 0.39 0.00 -1.77 2.76 -0.68 -3.40 115.15 112.86 1o0l h HIS 69 Ca 0.00 -0.25 0.00 0.00 -2.20 0.00 0.00 60.37 57.92 1o0l h HIS 69 Cb 0.46 -0.03 0.00 0.00 1.55 0.00 0.00 27.41 29.39 1o0l h HIS 69 CO 0.09 1.13 -0.13 1.55 -1.30 0.00 0.00 177.93 179.27 1o0l n VAL 70 N -3.58 0.30 -3.50 5.26 3.14 -1.25 -5.09 118.33 113.61 1o0l n VAL 70 Ca -0.06 0.44 -0.13 0.00 -2.96 0.00 0.00 64.34 61.63 1o0l n VAL 70 Cb 0.92 -1.69 -0.04 0.00 -1.06 0.00 0.00 33.84 31.97 1o0l n VAL 70 CO 0.00 0.00 0.00 0.42 -6.46 0.00 0.00 176.83 170.79 1o0l s THR 71 N -1.29 0.00 0.00 1.55 -4.23 -1.26 -5.19 115.64 105.22 1o0l s THR 71 Ca -0.04 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 60.47 1o0l s THR 71 Cb 0.01 -1.00 0.00 0.00 1.34 0.00 0.00 72.50 72.85 1o0l s THR 71 CO 0.06 0.00 0.00 -0.81 -0.54 0.00 0.00 174.62 173.33 1o0l n PRO 72 N 0.27 2.92 0.00 3.99 -0.04 -1.26 -4.69 135.00 136.19 1o0l n PRO 72 Ca -0.14 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.32 1o0l n PRO 72 Cb 0.60 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.06 1o0l n PRO 72 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1o0l n GLY 73 N 5.00 2.39 1.99 0.55 0.00 -1.26 -4.59 105.19 109.26 1o0l n GLY 73 Ca 0.00 -0.03 -0.06 0.00 0.00 0.00 0.00 46.02 45.92 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 4.82 3.94 0.06 1.61 7.64 -1.26 -3.93 113.62 126.49 1o0l n SER 74 Ca 0.00 -2.18 0.11 0.00 1.01 0.00 0.00 58.87 57.81 1o0l n SER 74 Cb 0.00 -1.00 -0.02 0.00 -1.01 0.00 0.00 64.21 62.18 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 2.34 2.85 -0.24 -0.43 0.00 -1.26 -4.17 120.51 119.61 1o0l n ALA 75 Ca 0.23 -0.34 -0.02 0.00 0.00 0.00 0.00 53.44 53.30 1o0l n ALA 75 Cb 0.60 -0.99 0.17 0.00 0.00 0.00 0.00 19.45 19.22 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 1.05 -0.56 0.00 3.07 -1.99 0.24 115.11 116.92 1o0l h GLN 76 Ca 0.00 -0.13 -0.10 0.00 0.09 0.00 0.00 58.65 58.50 1o0l h GLN 76 Cb 0.91 -0.20 -0.02 0.00 0.08 0.00 0.00 27.48 28.25 1o0l h GLN 76 CO 0.00 0.79 -0.05 1.96 0.09 0.00 0.00 178.83 181.62 1o0l h GLN 77 N 1.05 1.02 -0.23 0.06 1.08 -1.91 0.53 115.11 116.71 1o0l h GLN 77 Ca 0.26 -0.35 -0.05 0.00 -1.45 0.00 0.00 58.65 57.06 1o0l h GLN 77 Cb 0.08 -0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 27.42 1o0l h GLN 77 CO -0.04 1.04 -0.05 0.00 -0.95 0.00 0.00 178.83 178.84 1o0l h ARG 78 N 0.90 0.44 -0.02 1.46 3.08 -1.65 -2.44 114.38 116.15 1o0l h ARG 78 Ca 0.15 -0.16 0.00 0.00 0.07 0.00 0.00 59.98 60.04 1o0l h ARG 78 Cb 0.61 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.63 1o0l h ARG 78 CO 0.04 0.67 0.02 0.35 -1.07 0.00 0.00 179.97 179.97 1o0l h PHE 79 N 0.18 0.03 -0.59 3.04 3.57 -0.84 -2.52 116.94 119.81 1o0l h PHE 79 Ca 0.06 0.00 0.06 0.00 3.53 0.00 0.00 57.97 61.63 1o0l h PHE 79 Cb 0.50 -0.01 -0.04 0.00 2.79 0.00 0.00 35.95 39.19 1o0l h PHE 79 CO 0.05 0.03 0.39 1.79 -2.23 0.00 0.00 178.31 178.34 1o0l h THR 80 N 0.02 0.98 0.77 4.41 1.35 -0.87 -0.59 112.91 118.98 1o0l h THR 80 Ca 0.01 -0.19 -0.04 0.00 -0.55 0.00 0.00 66.41 65.64 1o0l h THR 80 Cb 0.01 0.39 0.01 0.00 -1.73 0.00 0.00 68.15 66.82 1o0l h THR 80 CO -0.00 0.10 -0.37 1.56 -0.25 0.00 0.00 175.52 176.56 1o0l h GLN 81 N 0.55 -0.99 -0.87 4.72 1.08 -1.01 0.23 115.11 118.82 1o0l h GLN 81 Ca 0.26 0.07 0.04 0.00 -1.45 0.00 0.00 58.65 57.56 1o0l h GLN 81 Cb 0.31 0.23 -0.05 0.00 -0.05 0.00 0.00 27.48 27.91 1o0l h GLN 81 CO -0.07 -0.66 0.57 0.28 -0.95 0.00 0.00 178.83 178.00 1o0l h VAL 82 N -1.06 1.14 -0.25 -0.54 2.07 -1.26 0.84 116.25 117.19 1o0l h VAL 82 Ca -0.11 -0.37 -0.04 0.00 0.82 0.00 0.00 66.70 67.01 1o0l h VAL 82 Cb 0.80 -0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.52 1o0l h VAL 82 CO 0.17 0.20 0.02 0.28 0.02 0.00 0.00 177.57 178.26 1o0l h SER 83 N 1.08 0.42 -0.25 0.57 0.02 -0.89 0.06 113.55 114.56 1o0l h SER 83 Ca 0.35 -0.29 -0.11 0.00 -0.84 0.00 0.00 61.79 60.91 1o0l h SER 83 Cb 0.04 -0.11 -0.01 0.00 0.14 0.00 0.00 62.40 62.46 1o0l h SER 83 CO -0.11 0.60 -0.21 -0.78 -1.14 0.00 0.00 176.83 175.19 1o0l h ASP 84 N 0.23 0.71 1.07 3.07 3.58 -0.07 -0.07 116.42 124.94 1o0l h ASP 84 Ca 0.07 -0.25 -0.05 0.00 0.42 0.00 0.00 57.03 57.23 1o0l h ASP 84 Cb 0.37 -0.20 -0.01 0.00 1.72 0.00 0.00 39.33 41.22 1o0l h ASP 84 CO 0.01 0.92 -0.23 -0.33 -2.88 0.00 0.00 179.24 176.72 1o0l h GLU 85 N 0.62 0.00 0.18 0.28 5.08 -0.73 0.51 114.58 120.53 1o0l h GLU 85 Ca 0.09 0.00 -0.32 0.00 -1.00 0.00 0.00 59.36 58.13 1o0l h GLU 85 Cb 0.70 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.96 1o0l h GLU 85 CO 0.05 0.23 -1.47 1.25 -1.00 0.00 0.00 179.01 178.07 1o0l h LEU 86 N 0.00 0.60 -0.07 1.33 5.85 -0.51 -3.24 115.31 119.28 1o0l h LEU 86 Ca -0.00 -0.71 0.00 0.00 0.84 0.00 0.00 57.88 58.00 1o0l h LEU 86 Cb 0.83 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.66 1o0l h LEU 86 CO 0.03 1.57 -0.16 0.33 -0.34 0.00 0.00 178.44 179.87 1o0l n PHE 87 N -3.59 0.00 -0.32 1.25 7.35 -0.08 -3.70 117.46 118.37 1o0l n PHE 87 Ca -0.16 0.00 0.17 0.00 -0.76 0.00 0.00 57.45 56.70 1o0l n PHE 87 Cb 1.07 -0.33 0.37 0.00 0.35 0.00 0.00 39.48 40.93 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 0.16 0.33 0.00 -4.13 -0.00 -0.92 -3.38 115.11 107.18 1o0l h GLN 88 Ca 0.00 -0.02 -0.09 0.00 -0.00 0.00 0.00 58.65 58.54 1o0l h GLN 88 Cb 0.45 -0.08 -0.09 0.00 0.00 0.00 0.00 27.48 27.76 1o0l h GLN 88 CO 0.00 0.22 0.10 0.41 0.00 0.00 0.00 178.83 179.56 1o0l n GLY 89 N -1.33 -0.47 0.00 2.39 0.00 -1.26 -5.06 105.19 99.46 1o0l n GLY 89 Ca 0.26 -0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.25 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 -0.50 -0.69 1.57 -0.02 0.00 -1.24 -5.01 105.19 99.30 1o0l n GLY 90 Ca -0.22 0.31 -0.02 0.00 0.00 0.00 0.00 46.02 46.10 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 1.14 -1.19 1.61 -0.04 -1.25 -4.71 135.00 130.56 1o0l n PRO 91 Ca 0.00 -0.15 -0.30 0.00 -0.04 0.00 0.00 63.50 63.01 1o0l n PRO 91 Cb 0.00 -1.14 0.13 0.00 -0.04 0.00 0.00 33.50 32.45 1o0l n PRO 91 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1o0l s ASN 92 N 1.98 3.62 0.54 3.54 0.01 -1.26 -4.63 114.94 118.75 1o0l s ASN 92 Ca 0.09 1.58 0.27 0.00 -0.71 0.00 0.00 52.86 54.09 1o0l s ASN 92 Cb 0.05 -2.25 1.44 0.00 0.41 0.00 0.00 41.25 40.89 1o0l s ASN 92 CO -0.00 -2.56 1.98 -0.50 -1.51 0.00 0.00 177.10 174.51 1o0l h TRP 93 N -1.49 0.00 -0.62 2.20 4.06 -1.97 0.31 115.95 118.43 1o0l h TRP 93 Ca -0.48 0.00 -0.04 0.00 2.06 0.00 0.00 58.89 60.42 1o0l h TRP 93 Cb 1.27 0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 29.40 1o0l h TRP 93 CO 0.46 0.00 0.21 0.78 -3.56 0.00 0.00 178.44 176.33 1o0l h GLY 94 N 0.00 1.00 1.23 1.49 0.00 -1.89 -2.51 103.07 102.39 1o0l h GLY 94 Ca 0.25 -0.55 -0.13 0.00 0.00 0.00 0.00 47.33 46.90 1o0l h GLY 94 CO -0.00 0.51 -1.14 -0.09 0.00 0.00 0.00 176.54 175.82 1o0l h ARG 95 N 0.91 0.00 -0.58 4.80 9.65 -1.07 -3.33 114.38 124.76 1o0l h ARG 95 Ca 0.21 0.00 0.14 0.00 -1.10 0.00 0.00 59.98 59.23 1o0l h ARG 95 Cb 0.23 0.00 -0.03 0.00 -1.39 0.00 0.00 29.97 28.78 1o0l h ARG 95 CO -0.01 0.30 0.40 1.25 2.80 0.00 0.00 179.97 184.71 1o0l h LEU 96 N 0.00 0.14 0.26 3.80 7.12 -0.08 0.45 115.31 127.01 1o0l h LEU 96 Ca -0.11 0.01 -0.01 0.00 0.13 0.00 0.00 57.88 57.90 1o0l h LEU 96 Cb 1.47 -0.02 0.00 0.00 -0.53 0.00 0.00 40.66 41.58 1o0l h LEU 96 CO 0.04 0.08 -0.12 0.58 -0.13 0.00 0.00 178.44 178.89 1o0l h VAL 97 N 0.16 0.79 -0.10 1.05 2.07 -1.64 -2.71 116.25 115.87 1o0l h VAL 97 Ca 0.28 -0.28 -0.03 0.00 0.82 0.00 0.00 66.70 67.48 1o0l h VAL 97 Cb 0.88 0.95 -0.01 0.00 -1.52 0.00 0.00 31.29 31.60 1o0l h VAL 97 CO -0.04 0.06 -0.10 0.00 0.02 0.00 0.00 177.57 177.51 1o0l h ALA 98 N 0.21 1.66 0.22 1.67 0.00 -1.34 0.11 119.26 121.79 1o0l h ALA 98 Ca -0.04 -0.15 0.01 0.00 0.00 0.00 0.00 54.91 54.73 1o0l h ALA 98 Cb 0.37 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1o0l h ALA 98 CO 0.06 0.25 -0.26 0.74 0.00 0.00 0.00 179.25 180.04 1o0l h PHE 99 N 0.14 -0.68 -0.06 0.00 0.04 -0.67 0.41 116.94 116.11 1o0l h PHE 99 Ca 0.03 0.01 -0.25 0.00 2.80 0.00 0.00 57.97 60.56 1o0l h PHE 99 Cb 0.27 0.27 0.02 0.00 2.20 0.00 0.00 35.95 38.71 1o0l h PHE 99 CO 0.00 -0.37 -0.93 0.74 -0.60 0.00 0.00 178.31 177.15 1o0l h PHE 100 N -0.52 1.01 -0.62 -0.55 -1.00 -1.30 -3.25 116.94 110.71 1o0l h PHE 100 Ca 0.00 -0.51 -0.01 0.00 2.81 0.00 0.00 57.97 60.26 1o0l h PHE 100 Cb 0.50 -0.13 -0.03 0.00 3.61 0.00 0.00 35.95 39.90 1o0l h PHE 100 CO -0.19 1.34 0.33 0.28 -1.61 0.00 0.00 178.31 178.46 1o0l h VAL 101 N 0.43 1.19 0.32 -0.55 2.07 -0.65 -1.50 116.25 117.56 1o0l h VAL 101 Ca -0.10 -0.50 -0.00 0.00 0.82 0.00 0.00 66.70 66.92 1o0l h VAL 101 Cb 1.57 0.36 -0.04 0.00 -1.52 0.00 0.00 31.29 31.67 1o0l h VAL 101 CO 0.18 0.22 -0.51 -0.26 0.02 0.00 0.00 177.57 177.22 1o0l h PHE 102 N 0.87 -1.46 -0.35 1.57 0.04 -0.21 0.11 116.94 117.51 1o0l h PHE 102 Ca 0.22 0.02 -0.15 0.00 2.80 0.00 0.00 57.97 60.87 1o0l h PHE 102 Cb 0.04 0.59 -0.01 0.00 2.20 0.00 0.00 35.95 38.78 1o0l h PHE 102 CO 0.01 -0.64 -0.38 0.78 -0.60 0.00 0.00 178.31 177.48 1o0l h GLY 103 N -0.88 0.90 1.00 -1.45 0.00 -1.65 -0.78 103.07 100.20 1o0l h GLY 103 Ca -0.03 -0.91 0.01 0.00 0.00 0.00 0.00 47.33 46.40 1o0l h GLY 103 CO -0.17 0.82 0.35 0.00 0.00 0.00 0.00 176.54 177.53 1o0l h ALA 104 N 0.88 0.67 -0.31 3.60 0.00 -1.11 0.46 119.26 123.46 1o0l h ALA 104 Ca 0.06 -0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.78 1o0l h ALA 104 Cb 0.94 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.52 1o0l h ALA 104 CO 0.09 0.10 -0.39 0.00 0.00 0.00 0.00 179.25 179.05 1o0l h ALA 105 N 1.20 0.47 -0.32 0.00 0.00 -0.76 -0.84 119.26 119.00 1o0l h ALA 105 Ca 0.19 -0.45 0.02 0.00 0.00 0.00 0.00 54.91 54.68 1o0l h ALA 105 Cb -0.08 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 1o0l h ALA 105 CO -0.05 0.57 0.16 1.25 0.00 0.00 0.00 179.25 181.18 1o0l h LEU 106 N 0.58 0.23 -0.31 0.00 6.46 -0.68 -2.00 115.31 119.59 1o0l h LEU 106 Ca 0.04 0.02 -0.04 0.00 -0.12 0.00 0.00 57.88 57.78 1o0l h LEU 106 Cb 0.98 -0.03 -0.01 0.00 -0.73 0.00 0.00 40.66 40.87 1o0l h LEU 106 CO 0.09 0.18 0.05 0.00 -0.62 0.00 0.00 178.44 178.14 1o0l h ALA 108 N 0.89 1.49 -0.00 0.00 0.00 -0.86 0.96 119.26 121.74 1o0l h ALA 108 Ca 0.10 0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1o0l h ALA 108 Cb 0.34 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.91 1o0l h ALA 108 CO 0.01 0.27 -0.22 0.39 0.00 0.00 0.00 179.25 179.69 1o0l n GLU 109 N -4.60 0.16 -0.01 0.00 1.02 -0.78 -3.52 120.64 112.92 1o0l n GLU 109 Ca 0.18 -0.06 -0.07 0.00 -0.02 0.00 0.00 57.16 57.20 1o0l n GLU 109 Cb 0.32 -1.50 -0.13 0.00 -0.02 0.00 0.00 31.44 30.12 1o0l n GLU 109 CO 0.00 0.00 0.00 0.77 1.18 0.00 0.00 177.13 179.08 1o0l h SER 110 N 0.15 0.00 0.22 1.62 0.02 -0.05 -3.33 113.55 112.18 1o0l h SER 110 Ca 0.00 0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 60.85 1o0l h SER 110 Cb 0.47 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.00 1o0l h SER 110 CO 0.00 0.90 -0.39 0.58 -1.14 0.00 0.00 176.83 176.78 1o0l h VAL 111 N 0.00 1.30 -0.03 2.27 2.07 -1.12 -2.38 116.25 118.36 1o0l h VAL 111 Ca -0.25 -1.47 0.00 0.00 0.82 0.00 0.00 66.70 65.80 1o0l h VAL 111 Cb 1.91 1.65 0.00 0.00 -1.52 0.00 0.00 31.29 33.33 1o0l h VAL 111 CO 0.07 0.44 0.00 -0.46 0.02 0.00 0.00 177.57 177.64 1o0l n ASN 112 N -4.04 0.82 -1.82 0.57 0.23 -1.25 -4.87 115.26 104.91 1o0l n ASN 112 Ca -0.01 -1.34 -0.01 0.00 -0.53 0.00 0.00 54.58 52.69 1o0l n ASN 112 Cb 0.46 -0.01 -0.00 0.00 -2.08 0.00 0.00 39.78 38.15 1o0l n ASN 112 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 1o0l n LYS 113 N -0.33 1.40 -1.48 -3.83 5.02 -0.91 -5.03 118.16 113.00 1o0l n LYS 113 Ca 0.20 -0.14 -0.28 0.00 -2.02 0.00 0.00 58.31 56.07 1o0l n LYS 113 Cb 0.23 0.06 -0.07 0.00 -0.02 0.00 0.00 35.03 35.23 1o0l n LYS 113 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1o0l n GLU 114 N -0.04 2.94 -2.65 1.97 1.02 -1.26 -4.34 120.64 118.28 1o0l n GLU 114 Ca -0.01 -2.29 -0.10 0.00 -0.02 0.00 0.00 57.16 54.75 1o0l n GLU 114 Cb 0.03 -2.29 0.03 0.00 -0.02 0.00 0.00 31.44 29.19 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 1.69 1.76 0.26 3.49 2.81 -1.16 -4.94 117.12 121.02 1o0l n MET 115 Ca 0.54 -3.54 -0.15 0.00 -1.81 0.00 0.00 57.70 52.73 1o0l n MET 115 Cb 0.53 -1.54 -0.08 0.00 -0.71 0.00 0.00 33.22 31.42 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 2.78 -0.65 0.00 0.03 3.07 -1.76 -3.06 114.58 114.99 1o0l h GLU 116 Ca -0.03 0.04 -0.03 0.00 -0.50 0.00 0.00 59.36 58.84 1o0l h GLU 116 Cb 1.20 0.15 -0.00 0.00 -0.84 0.00 0.00 28.75 29.25 1o0l h GLU 116 CO 0.47 -0.35 -0.14 -1.35 -1.40 0.00 0.00 179.01 176.24 1o0l h PRO 117 N -0.88 0.00 0.00 2.33 0.11 -1.95 -2.37 132.00 129.23 1o0l h PRO 117 Ca -0.07 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 65.98 1o0l h PRO 117 Cb 0.59 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.70 1o0l h PRO 117 CO 0.11 0.14 -0.29 1.25 -0.21 0.00 0.00 178.00 179.00 1o0l h LEU 118 N 0.00 0.00 0.09 2.35 5.85 -1.94 -3.09 115.31 118.57 1o0l h LEU 118 Ca -0.00 0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.73 1o0l h LEU 118 Cb 0.32 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.33 1o0l h LEU 118 CO 0.02 0.29 -0.15 0.58 -0.34 0.00 0.00 178.44 178.84 1o0l h VAL 119 N 0.00 0.64 -0.18 1.05 2.07 -1.32 -0.13 116.25 118.38 1o0l h VAL 119 Ca -0.00 0.00 -0.04 0.00 0.82 0.00 0.00 66.70 67.48 1o0l h VAL 119 Cb 0.54 0.64 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 1o0l h VAL 119 CO 0.04 0.00 -0.06 1.23 0.02 0.00 0.00 177.57 178.79 1o0l h GLY 120 N -0.30 0.29 0.71 2.17 0.00 -1.68 -1.02 103.07 103.24 1o0l h GLY 120 Ca 0.02 -0.16 -0.01 0.00 0.00 0.00 0.00 47.33 47.18 1o0l h GLY 120 CO -0.09 0.15 -0.08 1.46 0.00 0.00 0.00 176.54 177.98 1o0l h GLN 121 N 0.26 -0.22 -0.64 4.80 1.08 -1.35 -0.56 115.11 118.49 1o0l h GLN 121 Ca 0.06 0.01 0.05 0.00 -1.45 0.00 0.00 58.65 57.32 1o0l h GLN 121 Cb 0.29 0.05 -0.04 0.00 -0.05 0.00 0.00 27.48 27.73 1o0l h GLN 121 CO 0.01 0.08 0.42 0.28 -0.95 0.00 0.00 178.83 178.68 1o0l h VAL 122 N -0.52 1.05 -0.26 -0.54 2.07 -0.80 0.48 116.25 117.73 1o0l h VAL 122 Ca -0.02 -0.24 -0.01 0.00 0.82 0.00 0.00 66.70 67.25 1o0l h VAL 122 Cb 0.40 0.29 -0.01 0.00 -1.52 0.00 0.00 31.29 30.44 1o0l h VAL 122 CO 0.04 0.13 0.13 -0.61 0.02 0.00 0.00 177.57 177.27 1o0l h GLN 123 N 0.70 0.37 -0.20 1.57 4.15 -0.93 -1.23 115.11 119.55 1o0l h GLN 123 Ca 0.27 -0.05 -0.21 0.00 0.77 0.00 0.00 58.65 59.42 1o0l h GLN 123 Cb 0.17 -0.07 0.01 0.00 0.21 0.00 0.00 27.48 27.80 1o0l h GLN 123 CO -0.08 0.36 -0.70 1.05 -1.93 0.00 0.00 178.83 177.53 1o0l h GLU 124 N 0.29 0.80 -0.88 1.69 4.11 -0.02 -1.03 114.58 119.55 1o0l h GLU 124 Ca 0.09 -0.60 0.10 0.00 0.07 0.00 0.00 59.36 59.02 1o0l h GLU 124 Cb 0.11 0.11 -0.06 0.00 0.50 0.00 0.00 28.75 29.40 1o0l h GLU 124 CO -0.01 1.22 0.57 -1.49 0.07 0.00 0.00 179.01 179.37 1o0l h TRP 125 N 0.57 0.92 0.11 2.06 6.55 0.05 0.40 115.95 126.62 1o0l h TRP 125 Ca -0.03 0.03 -0.01 0.00 0.95 0.00 0.00 58.89 59.83 1o0l h TRP 125 Cb 1.32 -0.30 0.00 0.00 -0.86 0.00 0.00 29.16 29.32 1o0l h TRP 125 CO 0.08 0.41 -0.05 1.98 -1.05 0.00 0.00 178.44 179.81 1o0l h MET 126 N 0.84 -0.14 -0.34 0.49 4.05 -1.10 -2.68 114.93 116.05 1o0l h MET 126 Ca 0.41 0.01 -0.03 0.00 -0.28 0.00 0.00 59.70 59.81 1o0l h MET 126 Cb 0.45 0.03 -0.02 0.00 -0.80 0.00 0.00 31.60 31.27 1o0l h MET 126 CO -0.18 0.35 0.07 -0.24 0.23 0.00 0.00 176.91 177.14 1o0l h VAL 127 N -0.85 1.17 -0.15 -5.77 3.04 -0.84 -0.74 116.25 112.11 1o0l h VAL 127 Ca -0.02 -0.60 -0.06 0.00 -1.01 0.00 0.00 66.70 65.01 1o0l h VAL 127 Cb 0.56 0.84 -0.00 0.00 -2.01 0.00 0.00 31.29 30.68 1o0l h VAL 127 CO 0.02 0.22 -0.14 -0.33 -1.01 0.00 0.00 177.57 176.33 1o0l h GLU 128 N 0.49 0.35 -0.47 4.17 5.08 -0.30 0.64 114.58 124.55 1o0l h GLU 128 Ca 0.11 -0.18 -0.02 0.00 -1.00 0.00 0.00 59.36 58.28 1o0l h GLU 128 Cb 0.22 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.45 1o0l h GLU 128 CO -0.00 0.73 0.22 -0.92 -1.00 0.00 0.00 179.01 178.04 1o0l h TYR 129 N -0.01 0.64 0.27 4.33 5.03 -1.25 -0.97 116.97 125.01 1o0l h TYR 129 Ca 0.02 -0.01 -0.01 0.00 2.58 0.00 0.00 58.73 61.31 1o0l h TYR 129 Cb 0.66 -0.20 0.00 0.00 1.55 0.00 0.00 36.73 38.74 1o0l h TYR 129 CO 0.08 0.47 -0.13 -0.07 -1.32 0.00 0.00 178.16 177.20 1o0l h LEU 130 N 0.65 -0.31 -1.65 2.82 3.38 -0.97 -1.21 115.31 118.02 1o0l h LEU 130 Ca 0.16 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 1o0l h LEU 130 Cb 0.07 0.08 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 1o0l h LEU 130 CO -0.02 0.18 0.01 -0.33 0.09 0.00 0.00 178.44 178.36 1o0l h GLU 131 N -0.96 0.22 0.15 1.13 5.08 -0.80 0.60 114.58 120.00 1o0l h GLU 131 Ca -0.04 -0.03 -0.31 0.00 -1.00 0.00 0.00 59.36 57.98 1o0l h GLU 131 Cb 0.48 -0.04 0.01 0.00 0.50 0.00 0.00 28.75 29.70 1o0l h GLU 131 CO 0.06 0.24 -1.50 1.15 -1.00 0.00 0.00 179.01 177.96 1o0l h THR 132 N 0.22 1.21 0.00 1.13 2.02 -1.25 -3.41 112.91 112.83 1o0l h THR 132 Ca 0.05 -2.79 0.00 0.00 0.77 0.00 0.00 66.41 64.44 1o0l h THR 132 Cb 0.14 2.84 0.00 0.00 -1.74 0.00 0.00 68.15 69.40 1o0l h THR 132 CO 0.00 0.84 -0.71 0.54 0.37 0.00 0.00 175.52 176.56 1o0l n ARG 133 N -3.53 0.00 -0.11 6.66 1.74 -0.48 -4.73 116.66 116.20 1o0l n ARG 133 Ca -0.16 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 56.83 1o0l n ARG 133 Cb 1.05 -0.73 -0.01 0.00 -1.02 0.00 0.00 32.46 31.76 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 0.42 -1.58 0.55 -0.00 -0.45 -2.33 115.31 111.93 1o0l h LEU 134 Ca 0.00 -0.05 0.18 0.00 -0.00 0.00 0.00 57.88 58.01 1o0l h LEU 134 Cb 0.71 -0.11 -0.06 0.00 -0.00 0.00 0.00 40.66 41.20 1o0l h LEU 134 CO 0.00 0.35 0.56 0.00 -0.00 0.00 0.00 178.44 179.35 1o0l h ALA 135 N 1.09 2.22 0.38 1.53 0.00 -0.18 0.17 119.26 124.47 1o0l h ALA 135 Ca 0.13 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 1o0l h ALA 135 Cb 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1o0l h ALA 135 CO -0.02 -0.46 -0.18 0.22 0.00 0.00 0.00 179.25 178.80 1o0l h ASP 136 N 0.37 -0.43 -0.31 0.00 3.58 -1.67 0.18 116.42 118.15 1o0l h ASP 136 Ca 0.42 -0.11 0.04 0.00 0.42 0.00 0.00 57.03 57.80 1o0l h ASP 136 Cb 1.07 0.11 -0.04 0.00 1.72 0.00 0.00 39.33 42.19 1o0l h ASP 136 CO -0.14 -0.12 0.08 -0.25 -2.88 0.00 0.00 179.24 175.93 1o0l h TRP 137 N -0.76 0.13 -0.37 0.28 7.01 -1.20 -1.26 115.95 119.78 1o0l h TRP 137 Ca -0.05 0.02 0.04 0.00 2.11 0.00 0.00 58.89 61.00 1o0l h TRP 137 Cb 0.52 -0.01 -0.04 0.00 -2.10 0.00 0.00 29.16 27.53 1o0l h TRP 137 CO 0.01 0.04 0.16 0.82 -2.79 0.00 0.00 178.44 176.67 1o0l h ILE 138 N 0.19 0.93 -0.01 2.65 2.04 -0.61 0.99 117.51 123.70 1o0l h ILE 138 Ca 0.14 -0.11 -0.09 0.00 1.00 0.00 0.00 64.86 65.80 1o0l h ILE 138 Cb 0.14 0.58 -0.01 0.00 -0.74 0.00 0.00 36.82 36.79 1o0l h ILE 138 CO -0.18 0.06 -0.41 0.45 0.00 0.00 0.00 178.15 178.07 1o0l h HIS 139 N 0.33 0.01 -0.00 1.37 3.86 -0.31 0.29 115.15 120.70 1o0l h HIS 139 Ca 0.16 -0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.37 1o0l h HIS 139 Cb 0.11 -0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.58 1o0l h HIS 139 CO -0.12 0.42 -0.41 0.43 0.86 0.00 0.00 177.93 179.11 1o0l n SER 140 N -4.05 0.54 -0.08 2.45 7.64 -0.50 -4.34 113.62 115.28 1o0l n SER 140 Ca -0.02 -0.31 -0.10 0.00 1.01 0.00 0.00 58.87 59.45 1o0l n SER 140 Cb 0.44 0.16 -0.05 0.00 -1.01 0.00 0.00 64.21 63.76 1o0l n SER 140 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1o0l n SER 141 N -1.35 1.84 0.00 6.43 2.88 0.30 -4.97 113.62 118.76 1o0l n SER 141 Ca 0.07 0.54 0.00 0.00 -1.33 0.00 0.00 58.87 58.15 1o0l n SER 141 Cb 0.34 -0.88 0.00 0.00 -0.75 0.00 0.00 64.21 62.91 1o0l n SER 141 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1o0l n GLY 142 N 1.54 0.24 0.00 0.46 0.00 -0.97 -5.10 105.19 101.35 1o0l n GLY 142 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.86 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 0.17 0.25 -0.02 0.00 1.00 -3.77 105.19 102.82 1o0l n GLY 143 Ca 0.00 -1.80 0.07 0.00 0.00 0.00 0.00 46.02 44.29 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 -0.43 1.61 4.06 -1.89 -1.17 115.95 118.13 1o0l h TRP 144 Ca 0.00 0.00 -0.04 0.00 2.06 0.00 0.00 58.89 60.91 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 0.08 0.09 0.00 -3.56 0.00 0.00 178.44 175.05 1o0l h ALA 145 N 1.92 1.35 -0.20 1.49 0.00 -1.80 -0.59 119.26 121.43 1o0l h ALA 145 Ca -0.00 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 1o0l h ALA 145 Cb 0.15 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1o0l h ALA 145 CO 0.01 0.46 0.07 1.49 0.00 0.00 0.00 179.25 181.28 1o0l h GLU 146 N 0.63 0.30 -0.66 0.00 4.81 -1.30 -1.97 114.58 116.38 1o0l h GLU 146 Ca 0.14 -0.06 -0.04 0.00 -0.13 0.00 0.00 59.36 59.27 1o0l h GLU 146 Cb 0.26 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.57 1o0l h GLU 146 CO -0.00 0.38 0.23 0.35 -0.73 0.00 0.00 179.01 179.24 1o0l h PHE 147 N 0.15 1.01 0.00 0.92 3.57 -1.43 -0.70 116.94 120.47 1o0l h PHE 147 Ca 0.06 -0.08 -0.05 0.00 3.53 0.00 0.00 57.97 61.44 1o0l h PHE 147 Cb 0.20 -0.30 -0.01 0.00 2.79 0.00 0.00 35.95 38.63 1o0l h PHE 147 CO -0.01 0.79 -0.22 1.15 -2.23 0.00 0.00 178.31 177.80 1o0l h THR 148 N 0.97 0.88 0.11 4.41 2.02 -0.86 0.14 112.91 120.58 1o0l h THR 148 Ca 0.22 -0.83 -0.29 0.00 0.77 0.00 0.00 66.41 66.29 1o0l h THR 148 Cb 0.23 1.48 -0.01 0.00 -1.74 0.00 0.00 68.15 68.12 1o0l h THR 148 CO -0.01 0.21 -1.40 0.00 0.37 0.00 0.00 175.52 174.68 1o0l h ALA 149 N 1.78 0.23 -0.62 6.16 0.00 -0.73 -0.04 119.26 126.05 1o0l h ALA 149 Ca -0.00 -1.03 -0.10 0.00 0.00 0.00 0.00 54.91 53.78 1o0l h ALA 149 Cb 0.47 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 1o0l h ALA 149 CO 0.03 1.10 0.00 -0.07 0.00 0.00 0.00 179.25 180.31 1o0l h LEU 150 N 0.06 1.06 -3.11 0.00 3.38 -0.55 -3.06 115.31 113.10 1o0l h LEU 150 Ca -0.19 -0.30 -0.00 0.00 0.09 0.00 0.00 57.88 57.47 1o0l h LEU 150 Cb 1.99 -0.29 -0.00 0.00 0.09 0.00 0.00 40.66 42.45 1o0l h LEU 150 CO 0.17 1.11 -0.01 -1.22 0.09 0.00 0.00 178.44 178.58 1o0l n TYR 151 N -4.18 0.38 -0.05 1.13 4.01 -0.02 -4.65 117.16 113.79 1o0l n TYR 151 Ca 0.03 -0.98 0.00 0.00 -0.16 0.00 0.00 57.90 56.79 1o0l n TYR 151 Cb 0.35 -0.22 0.00 0.00 -0.31 0.00 0.00 39.34 39.16 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 -1.08 3.08 0.10 2.72 0.00 -0.03 -4.56 105.19 105.43 1o0l n GLY 152 Ca 0.18 -1.70 -0.15 0.00 0.00 0.00 0.00 46.02 44.35 1o0l n GLY 152 CO 0.00 0.00 0.00 -1.80 0.00 0.00 0.00 173.32 171.52 1o0l h ASP 153 N 0.00 0.32 -0.19 1.61 3.58 -1.82 -3.33 116.42 116.58 1o0l h ASP 153 Ca 0.00 -0.44 -0.15 0.00 0.42 0.00 0.00 57.03 56.87 1o0l h ASP 153 Cb 0.00 -0.10 -0.06 0.00 1.72 0.00 0.00 39.33 40.89 1o0l h ASP 153 CO 0.00 1.36 0.07 0.61 -2.88 0.00 0.00 179.24 178.41 1o0l n GLY 154 N 1.62 3.11 2.73 -0.78 0.00 -1.26 -4.71 105.19 105.90 1o0l n GLY 154 Ca -0.14 -0.60 -0.42 0.00 0.00 0.00 0.00 46.02 44.86 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 1.32 5.77 -0.67 4.61 0.00 -1.16 -4.63 120.51 125.75 1o0l n ALA 155 Ca 0.18 -4.07 -0.29 0.00 0.00 0.00 0.00 53.44 49.26 1o0l n ALA 155 Cb 0.59 -3.20 0.25 0.00 0.00 0.00 0.00 19.45 17.09 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 0.54 0.36 0.33 0.00 2.34 -1.26 -4.45 118.68 116.54 1o0l s LEU 156 Ca 0.46 1.15 0.10 0.00 0.06 0.00 0.00 54.13 55.89 1o0l s LEU 156 Cb 0.13 -2.93 0.86 0.00 -0.56 0.00 0.00 46.19 43.69 1o0l s LEU 156 CO -0.05 -4.37 1.76 -0.33 -1.06 0.00 0.00 176.35 172.31 1o0l h GLU 157 N -2.74 0.61 0.19 1.48 4.39 -1.99 0.99 114.58 117.51 1o0l h GLU 157 Ca -0.54 -0.04 -0.01 0.00 0.34 0.00 0.00 59.36 59.11 1o0l h GLU 157 Cb 1.33 -0.14 0.00 0.00 -0.10 0.00 0.00 28.75 29.85 1o0l h GLU 157 CO 0.44 0.40 -0.09 0.93 -1.16 0.00 0.00 179.01 179.53 1o0l h GLU 158 N 0.63 -0.25 -0.81 2.33 4.39 -1.98 -2.23 114.58 116.66 1o0l h GLU 158 Ca 0.60 0.02 -0.01 0.00 0.34 0.00 0.00 59.36 60.31 1o0l h GLU 158 Cb 1.13 0.06 -0.04 0.00 -0.10 0.00 0.00 28.75 29.79 1o0l h GLU 158 CO -0.40 -0.03 0.45 0.00 -1.16 0.00 0.00 179.01 177.87 1o0l h ALA 159 N 0.33 1.27 0.69 3.43 0.00 -1.55 -0.24 119.26 123.19 1o0l h ALA 159 Ca -0.03 -0.12 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 1o0l h ALA 159 Cb 0.34 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1o0l h ALA 159 CO 0.04 0.60 -0.35 0.00 0.00 0.00 0.00 179.25 179.54 1o0l h ARG 160 N 1.13 -0.92 0.00 0.00 3.08 -0.75 -0.67 114.38 116.25 1o0l h ARG 160 Ca 0.29 0.06 -0.08 0.00 0.07 0.00 0.00 59.98 60.32 1o0l h ARG 160 Cb 0.02 0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.26 1o0l h ARG 160 CO -0.05 -0.61 -0.36 0.07 -1.07 0.00 0.00 179.97 177.95 1o0l h ARG 161 N -0.96 0.00 -0.15 0.04 0.11 -1.33 -2.74 114.38 109.36 1o0l h ARG 161 Ca -0.09 0.00 -0.05 0.00 0.10 0.00 0.00 59.98 59.94 1o0l h ARG 161 Cb 0.74 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.82 1o0l h ARG 161 CO 0.14 0.36 -0.10 1.25 0.10 0.00 0.00 179.97 181.72 1o0l h LEU 162 N 0.00 0.34 -0.63 0.08 5.85 -0.84 0.15 115.31 120.25 1o0l h LEU 162 Ca -0.00 -0.44 -0.13 0.00 0.84 0.00 0.00 57.88 58.14 1o0l h LEU 162 Cb 0.67 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 1o0l h LEU 162 CO 0.05 0.71 -0.33 0.08 -0.34 0.00 0.00 178.44 178.61 1o0l h ARG 163 N -0.03 0.71 -0.23 1.25 0.11 -1.08 0.01 114.38 115.13 1o0l h ARG 163 Ca 0.03 -0.33 -0.12 0.00 0.10 0.00 0.00 59.98 59.66 1o0l h ARG 163 Cb 0.60 -0.01 -0.00 0.00 1.11 0.00 0.00 29.97 31.67 1o0l h ARG 163 CO 0.03 0.94 -0.33 0.93 0.10 0.00 0.00 179.97 181.64 1o0l h GLU 164 N 0.60 0.62 0.00 0.08 5.08 -1.51 -2.59 114.58 116.86 1o0l h GLU 164 Ca 0.06 -0.37 0.00 0.00 -1.00 0.00 0.00 59.36 58.06 1o0l h GLU 164 Cb 0.85 0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.13 1o0l h GLU 164 CO 0.07 0.98 0.00 0.41 -1.00 0.00 0.00 179.01 179.47 1o0l n GLY 165 N 0.30 -1.28 0.10 -3.84 0.00 0.04 -2.44 105.19 98.06 1o0l n GLY 165 Ca -0.05 0.06 -0.03 0.00 0.00 0.00 0.00 46.02 46.00 1o0l n GLY 165 CO 0.00 0.00 0.00 -0.57 0.00 0.00 0.00 173.32 172.75 1o0l h ASN 166 N 0.00 -0.18 0.12 1.61 -0.73 -0.60 -3.32 115.58 112.48 1o0l h ASN 166 Ca 0.00 0.01 -0.01 0.00 1.87 0.00 0.00 56.30 58.17 1o0l h ASN 166 Cb 0.38 0.05 -0.00 0.00 0.27 0.00 0.00 38.32 39.01 1o0l h ASN 166 CO 0.00 0.02 -0.04 4.11 -0.37 0.00 0.00 177.43 181.16 1o0l h TRP 167 N -0.51 0.00 0.03 0.67 5.08 -1.53 0.28 115.95 119.97 1o0l h TRP 167 Ca -0.02 0.00 0.01 0.00 1.08 0.00 0.00 58.89 59.96 1o0l h TRP 167 Cb 0.16 0.00 -0.03 0.00 -3.00 0.00 0.00 29.16 26.29 1o0l h TRP 167 CO 0.04 0.04 -0.32 0.00 -1.28 0.00 0.00 178.44 176.92 1o0l h ALA 168 N 1.96 -0.79 0.00 0.11 0.00 -1.57 0.14 119.26 119.12 1o0l h ALA 168 Ca -0.00 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 1o0l h ALA 168 Cb 0.10 0.75 -0.01 0.00 0.00 0.00 0.00 17.79 18.64 1o0l h ALA 168 CO 0.00 -0.88 -0.89 0.77 0.00 0.00 0.00 179.25 178.26 1o0l h SER 169 N -0.42 0.00 0.51 0.00 0.02 -1.64 -3.30 113.55 108.72 1o0l h SER 169 Ca 0.00 0.00 -0.30 0.00 -0.84 0.00 0.00 61.79 60.66 1o0l h SER 169 Cb 0.44 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.99 1o0l h SER 169 CO -0.20 0.15 -1.37 0.58 -1.14 0.00 0.00 176.83 174.85 1o0l h VAL 170 N 0.00 1.37 0.00 2.27 2.07 -0.87 -2.68 116.25 118.41 1o0l h VAL 170 Ca -0.03 -2.92 0.00 0.00 0.82 0.00 0.00 66.70 64.57 1o0l h VAL 170 Cb 1.14 2.93 0.00 0.00 -1.52 0.00 0.00 31.29 33.84 1o0l h VAL 170 CO 0.01 0.86 -0.19 -2.11 0.02 0.00 0.00 177.57 176.16 1o0l n ARG 171 N -3.56 0.19 -0.00 1.57 1.85 0.50 -3.45 116.66 113.76 1o0l n ARG 171 Ca -0.12 0.12 -0.10 0.00 -1.00 0.00 0.00 57.85 56.74 1o0l n ARG 171 Cb 1.05 -1.68 -0.14 0.00 -1.05 0.00 0.00 32.46 30.63 1o0l n ARG 171 CO 0.00 0.00 0.00 1.79 -0.01 0.00 0.00 177.63 179.41 1o0l h THR 172 N 0.00 0.95 0.00 8.89 1.35 -1.63 -3.07 112.91 119.40 1o0l h THR 172 Ca 0.00 -2.76 -0.03 0.00 -0.55 0.00 0.00 66.41 63.07 1o0l h THR 172 Cb 0.67 2.51 -0.00 0.00 -1.73 0.00 0.00 68.15 69.59 1o0l h THR 172 CO 0.00 0.62 -0.16 1.62 -0.25 0.00 0.00 175.52 177.35 1o0l h VAL 173 N 0.01 0.57 -0.96 6.82 3.04 -1.50 -2.75 116.25 121.48 1o0l h VAL 173 Ca -0.26 -0.74 -0.55 0.00 -1.01 0.00 0.00 66.70 64.13 1o0l h VAL 173 Cb 1.99 1.49 -0.43 0.00 -2.01 0.00 0.00 31.29 32.33 1o0l h VAL 173 CO 0.09 0.16 -0.81 0.18 -1.01 0.00 0.00 177.57 176.18 1o0l n LEU 174 N -3.55 4.73 -0.09 3.16 4.77 -1.24 -4.81 117.00 119.97 1o0l n LEU 174 Ca -0.01 -4.82 -0.13 0.00 -0.03 0.00 0.00 56.01 51.02 1o0l n LEU 174 Cb 0.30 -0.34 -0.04 0.00 -2.33 0.00 0.00 43.42 41.01 1o0l n LEU 174 CO 0.31 2.11 0.61 0.71 -1.33 0.00 0.00 177.39 179.80 1o0l h THR 175 N 2.40 1.30 0.00 -5.08 1.35 -1.38 -3.21 112.91 108.30 1o0l h THR 175 Ca 0.33 -1.37 0.00 0.00 -0.55 0.00 0.00 66.41 64.82 1o0l h THR 175 Cb 1.36 1.56 0.00 0.00 -1.73 0.00 0.00 68.15 69.33 1o0l h THR 175 CO 0.77 0.44 0.00 0.61 -0.25 0.00 0.00 175.52 177.08 1o0l n GLY 176 N 0.09 1.64 0.51 5.82 0.00 -1.26 -3.77 105.19 108.22 1o0l n GLY 176 Ca -0.04 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.11 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 0.42 2.55 -1.66 4.61 0.00 -1.21 -4.60 120.51 120.62 1o0l n ALA 177 Ca 0.00 -0.48 -0.41 0.00 0.00 0.00 0.00 53.44 52.55 1o0l n ALA 177 Cb 0.38 -1.13 -0.01 0.00 0.00 0.00 0.00 19.45 18.69 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 0.23 3.61 0.60 0.00 0.31 -1.25 -4.37 118.33 117.45 1o0l n VAL 178 Ca 0.18 -2.94 0.07 0.00 -0.01 0.00 0.00 64.34 61.64 1o0l n VAL 178 Cb 0.34 -2.61 0.21 0.00 -0.91 0.00 0.00 33.84 30.86 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 5.64 2.43 -0.09 3.52 0.00 -1.26 -4.08 120.51 126.68 1o0l n ALA 179 Ca 0.57 -0.78 -0.22 0.00 0.00 0.00 0.00 53.44 53.01 1o0l n ALA 179 Cb 0.36 -0.97 -0.12 0.00 0.00 0.00 0.00 19.45 18.72 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 0.80 2.51 -4.56 0.00 4.77 -1.26 -4.80 117.00 114.46 1o0l n LEU 180 Ca 0.15 0.14 -0.32 0.00 -0.03 0.00 0.00 56.01 55.95 1o0l n LEU 180 Cb 0.38 -0.96 -0.04 0.00 -2.33 0.00 0.00 43.42 40.47 1o0l n LEU 180 CO 0.10 0.74 1.46 -0.83 -1.33 0.00 0.00 177.39 177.54 1o0l s GLY 181 N -5.80 0.22 0.29 -0.72 0.00 -1.26 -3.94 107.32 96.10 1o0l s GLY 181 Ca -0.31 -1.14 -0.15 0.00 0.00 0.00 0.00 44.72 43.12 1o0l s GLY 181 CO 0.62 3.43 0.70 0.00 0.00 0.00 0.00 173.10 177.86 1o0l s ALA 182 N 9.49 3.38 -0.94 3.20 0.00 -1.26 -5.07 121.76 130.56 1o0l s ALA 182 Ca 0.68 0.00 0.07 0.00 0.00 0.00 0.00 51.96 52.72 1o0l s ALA 182 Cb -0.09 -2.72 0.06 0.00 0.00 0.00 0.00 23.12 20.37 1o0l s ALA 182 CO 0.09 0.36 0.74 1.28 0.00 0.00 0.00 175.76 178.23