#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 2.71 0.21 1.61 0.02 -1.26 -4.82 135.00 133.48 1o0l s PRO -3 Ca 0.00 0.06 -0.04 0.00 0.02 0.00 0.00 61.00 61.03 1o0l s PRO -3 Cb 0.00 -4.71 0.18 0.00 0.02 0.00 0.00 34.50 29.98 1o0l s PRO -3 CO 0.00 -2.91 1.61 -0.07 -0.33 0.00 0.00 177.00 175.31 1o0l h LEU -2 N 16.48 0.77 0.00 -5.54 -0.00 -2.11 -3.49 115.31 121.43 1o0l h LEU -2 Ca -0.08 -0.29 0.00 0.00 -0.00 0.00 0.00 57.88 57.50 1o0l h LEU -2 Cb 1.08 -0.21 0.00 0.00 -0.00 0.00 0.00 40.66 41.53 1o0l h LEU -2 CO 1.24 1.00 0.00 0.61 -0.00 0.00 0.00 178.44 181.28 1o0l n GLY -1 N -0.18 -0.53 3.73 0.83 0.00 -1.26 -5.12 105.19 102.66 1o0l n GLY -1 Ca -0.00 -0.07 -0.41 0.00 0.00 0.00 0.00 46.02 45.53 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 -4.00 7.27 -0.08 1.61 0.01 -1.26 -5.04 113.70 112.21 1o0l s SER 0 Ca 0.00 2.03 0.01 0.00 1.31 0.00 0.00 55.95 59.30 1o0l s SER 0 Cb 0.00 -2.60 -0.03 0.00 0.21 0.00 0.00 66.02 63.61 1o0l s SER 0 CO 0.00 -0.24 -0.10 -0.32 0.41 0.00 0.00 173.24 172.99 1o0l s MET 1 N -0.08 2.85 -0.24 12.44 1.75 -1.26 -5.10 119.30 129.66 1o0l s MET 1 Ca 0.50 -0.61 -0.11 0.00 -1.25 0.00 0.00 55.69 54.23 1o0l s MET 1 Cb -0.28 -2.56 -0.05 0.00 2.84 0.00 0.00 34.83 34.78 1o0l s MET 1 CO 0.33 0.54 0.17 0.00 -0.65 0.00 0.00 175.02 175.41 1o0l s ALA 2 N -0.50 3.61 -0.25 4.11 0.00 -1.26 -5.08 121.76 122.40 1o0l s ALA 2 Ca 0.07 -0.86 -0.11 0.00 0.00 0.00 0.00 51.96 51.06 1o0l s ALA 2 Cb -0.12 -2.32 -0.05 0.00 0.00 0.00 0.00 23.12 20.63 1o0l s ALA 2 CO 0.02 -0.17 0.18 0.95 0.00 0.00 0.00 175.76 176.73 1o0l s THR 3 N 1.02 5.34 0.07 0.00 -4.23 -1.26 -5.05 115.64 111.52 1o0l s THR 3 Ca 0.08 0.20 -0.31 0.00 -1.18 0.00 0.00 61.69 60.48 1o0l s THR 3 Cb -0.13 -3.51 -0.08 0.00 1.34 0.00 0.00 72.50 70.11 1o0l s THR 3 CO 0.04 0.32 1.70 -2.84 -0.54 0.00 0.00 174.62 173.30 1o0l s PRO 4 N 1.22 4.18 0.04 3.99 0.02 -1.26 -4.92 135.00 138.28 1o0l s PRO 4 Ca 0.08 2.38 -0.18 0.00 0.02 0.00 0.00 61.00 63.30 1o0l s PRO 4 Cb -0.14 -3.65 -0.21 0.00 0.02 0.00 0.00 34.50 30.52 1o0l s PRO 4 CO 0.06 -0.77 1.18 0.00 -0.33 0.00 0.00 177.00 177.14 1o0l h ALA 5 N 8.55 0.15 -2.66 -1.55 0.00 -2.06 -3.47 119.26 118.22 1o0l h ALA 5 Ca -0.43 -0.56 -0.03 0.00 0.00 0.00 0.00 54.91 53.89 1o0l h ALA 5 Cb 1.20 0.02 -0.14 0.00 0.00 0.00 0.00 17.79 18.87 1o0l h ALA 5 CO 0.93 0.43 0.21 -1.12 0.00 0.00 0.00 179.25 179.71 1o0l s SER 6 N -6.82 -0.59 -0.13 0.00 0.01 -1.26 -5.18 113.70 99.74 1o0l s SER 6 Ca -0.12 0.23 -0.10 0.00 1.31 0.00 0.00 55.95 57.27 1o0l s SER 6 Cb 0.05 0.58 0.04 0.00 0.21 0.00 0.00 66.02 66.90 1o0l s SER 6 CO 0.84 -0.84 0.32 0.00 0.41 0.00 0.00 173.24 173.97 1o0l s ALA 7 N -2.90 -0.80 -0.77 1.44 0.00 -1.26 -5.06 121.76 112.42 1o0l s ALA 7 Ca -0.03 1.04 -0.07 0.00 0.00 0.00 0.00 51.96 52.89 1o0l s ALA 7 Cb -0.01 -0.62 -0.16 0.00 0.00 0.00 0.00 23.12 22.33 1o0l s ALA 7 CO -0.05 -0.18 3.07 -2.30 0.00 0.00 0.00 175.76 176.30 1o0l n PRO 8 N 3.39 2.64 -0.02 0.00 -0.02 -1.26 -4.62 135.00 135.11 1o0l n PRO 8 Ca -0.17 -1.50 0.00 0.00 -2.02 0.00 0.00 63.50 59.81 1o0l n PRO 8 Cb 0.56 -2.36 0.00 0.00 -0.02 0.00 0.00 33.50 31.69 1o0l n PRO 8 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1o0l n ASP 9 N 3.14 0.00 -0.22 2.55 9.92 -1.26 -4.67 116.55 126.01 1o0l n ASP 9 Ca 0.56 -0.29 0.06 0.00 -0.53 0.00 0.00 54.79 54.60 1o0l n ASP 9 Cb 0.51 0.00 0.33 0.00 -0.64 0.00 0.00 41.12 41.32 1o0l n ASP 9 CO 0.00 0.00 0.00 0.74 0.13 0.00 0.00 177.20 178.07 1o0l h THR 10 N -0.26 1.02 -0.67 -3.53 2.02 -1.98 -0.49 112.91 109.02 1o0l h THR 10 Ca 0.00 -0.28 -0.03 0.00 0.77 0.00 0.00 66.41 66.87 1o0l h THR 10 Cb 0.00 0.13 -0.03 0.00 -1.74 0.00 0.00 68.15 66.51 1o0l h THR 10 CO 0.00 0.15 0.29 -0.09 0.37 0.00 0.00 175.52 176.23 1o0l h ARG 11 N 0.81 0.97 -0.04 6.66 2.43 -1.91 0.59 114.38 123.89 1o0l h ARG 11 Ca 0.34 -0.15 -0.21 0.00 -0.81 0.00 0.00 59.98 59.15 1o0l h ARG 11 Cb 0.28 -0.17 -0.00 0.00 -0.42 0.00 0.00 29.97 29.66 1o0l h ARG 11 CO -0.12 0.77 -0.85 0.00 -1.51 0.00 0.00 179.97 178.27 1o0l h ALA 12 N 1.36 0.46 -0.13 2.80 0.00 -1.52 -2.52 119.26 119.70 1o0l h ALA 12 Ca 0.23 -0.66 -0.22 0.00 0.00 0.00 0.00 54.91 54.26 1o0l h ALA 12 Cb 0.15 -0.04 0.01 0.00 0.00 0.00 0.00 17.79 17.92 1o0l h ALA 12 CO -0.02 0.79 -0.77 1.25 0.00 0.00 0.00 179.25 180.50 1o0l h LEU 13 N 0.26 0.91 -0.86 0.00 5.85 -0.59 -1.54 115.31 119.34 1o0l h LEU 13 Ca -0.06 -0.64 -0.07 0.00 0.84 0.00 0.00 57.88 57.95 1o0l h LEU 13 Cb 1.46 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 42.19 1o0l h LEU 13 CO 0.15 1.41 0.02 1.62 -0.34 0.00 0.00 178.44 181.30 1o0l h VAL 14 N 0.48 1.25 0.00 1.05 3.04 0.13 -0.03 116.25 122.16 1o0l h VAL 14 Ca -0.06 -1.01 -0.07 0.00 -1.01 0.00 0.00 66.70 64.55 1o0l h VAL 14 Cb 1.41 0.82 -0.01 0.00 -2.01 0.00 0.00 31.29 31.49 1o0l h VAL 14 CO 0.16 0.36 -0.32 0.00 -1.01 0.00 0.00 177.57 176.76 1o0l h ALA 15 N 1.21 0.94 0.21 3.17 0.00 -1.45 -2.45 119.26 120.89 1o0l h ALA 15 Ca 0.16 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 1o0l h ALA 15 Cb 0.45 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1o0l h ALA 15 CO 0.02 0.40 -0.10 0.22 0.00 0.00 0.00 179.25 179.78 1o0l h ASP 16 N 0.00 -0.24 0.54 0.00 3.58 -0.46 -0.96 116.42 118.88 1o0l h ASP 16 Ca -0.00 0.01 -0.02 0.00 0.42 0.00 0.00 57.03 57.43 1o0l h ASP 16 Cb 0.93 0.06 -0.00 0.00 1.72 0.00 0.00 39.33 42.04 1o0l h ASP 16 CO 0.04 0.21 -0.30 0.15 -2.88 0.00 0.00 179.24 176.46 1o0l h PHE 17 N -1.04 -0.79 -0.66 0.28 3.57 -1.12 0.30 116.94 117.47 1o0l h PHE 17 Ca -0.03 -0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.40 1o0l h PHE 17 Cb 0.22 0.27 -0.03 0.00 2.79 0.00 0.00 35.95 39.21 1o0l h PHE 17 CO 0.00 -0.47 0.16 0.28 -2.23 0.00 0.00 178.31 176.05 1o0l h VAL 18 N -0.79 1.25 0.22 1.41 2.07 -1.62 -0.17 116.25 118.62 1o0l h VAL 18 Ca -0.07 -0.93 -0.01 0.00 0.82 0.00 0.00 66.70 66.51 1o0l h VAL 18 Cb 0.63 0.57 0.00 0.00 -1.52 0.00 0.00 31.29 30.97 1o0l h VAL 18 CO 0.09 0.35 -0.10 1.23 0.02 0.00 0.00 177.57 179.16 1o0l h GLY 19 N 1.06 -0.30 1.01 2.17 0.00 -0.96 0.12 103.07 106.17 1o0l h GLY 19 Ca 0.21 0.11 -0.02 0.00 0.00 0.00 0.00 47.33 47.63 1o0l h GLY 19 CO 0.00 -0.11 0.37 -1.82 0.00 0.00 0.00 176.54 174.98 1o0l h TYR 20 N -0.33 1.05 -0.61 5.60 3.20 -0.26 0.35 116.97 125.97 1o0l h TYR 20 Ca -0.03 -0.04 -0.05 0.00 3.14 0.00 0.00 58.73 61.75 1o0l h TYR 20 Cb 0.26 -0.33 -0.03 0.00 1.54 0.00 0.00 36.73 38.17 1o0l h TYR 20 CO -0.05 0.76 0.20 0.87 -1.64 0.00 0.00 178.16 178.29 1o0l h LYS 21 N 1.03 0.94 -0.14 1.82 1.79 -0.85 0.63 116.57 121.78 1o0l h LYS 21 Ca 0.26 -0.20 -0.09 0.00 -2.18 0.00 0.00 60.65 58.44 1o0l h LYS 21 Cb 0.09 -0.14 0.00 0.00 -1.58 0.00 0.00 32.23 30.60 1o0l h LYS 21 CO -0.04 0.83 -0.26 -0.07 -1.08 0.00 0.00 179.45 178.83 1o0l h LEU 22 N 0.86 0.48 -1.20 2.94 4.07 -0.47 -2.82 115.31 119.17 1o0l h LEU 22 Ca 0.20 -0.55 0.00 0.00 0.08 0.00 0.00 57.88 57.61 1o0l h LEU 22 Cb 0.28 -0.14 0.00 0.00 1.08 0.00 0.00 40.66 41.88 1o0l h LEU 22 CO -0.01 0.93 0.00 -0.09 -1.08 0.00 0.00 178.44 178.20 1o0l h ARG 23 N 0.04 0.00 0.13 1.13 2.43 -0.16 0.54 114.38 118.49 1o0l h ARG 23 Ca 0.01 0.00 -0.30 0.00 -0.81 0.00 0.00 59.98 58.87 1o0l h ARG 23 Cb 0.85 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.39 1o0l h ARG 23 CO 0.06 0.00 -1.49 1.96 -1.51 0.00 0.00 179.97 178.99 1o0l h GLN 24 N 0.00 0.28 -1.31 0.20 4.20 -0.63 -3.38 115.11 114.46 1o0l h GLN 24 Ca 0.00 -0.47 -0.30 0.00 0.06 0.00 0.00 58.65 57.94 1o0l h GLN 24 Cb 0.22 0.18 -0.23 0.00 0.30 0.00 0.00 27.48 27.94 1o0l h GLN 24 CO 0.00 1.16 -0.65 0.36 -0.67 0.00 0.00 178.83 179.03 1o0l n LYS 25 N -3.49 0.48 0.00 1.46 2.85 -0.82 -4.99 118.16 113.65 1o0l n LYS 25 Ca -0.15 -2.37 0.00 0.00 -1.05 0.00 0.00 58.31 54.73 1o0l n LYS 25 Cb 1.05 -1.51 0.00 0.00 -0.65 0.00 0.00 35.03 33.91 1o0l n LYS 25 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1o0l n GLY 26 N 2.70 0.80 2.52 2.58 0.00 -0.69 -4.74 105.19 108.36 1o0l n GLY 26 Ca 0.20 -0.02 -0.36 0.00 0.00 0.00 0.00 46.02 45.84 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 2.33 0.08 1.61 9.36 0.18 -4.57 117.16 126.15 1o0l n TYR 27 Ca 0.00 -2.50 -0.10 0.00 3.32 0.00 0.00 57.90 58.62 1o0l n TYR 27 Cb 0.00 -1.60 -0.08 0.00 -0.63 0.00 0.00 39.34 37.03 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 2.35 1.58 -0.11 2.97 3.04 -1.74 -3.20 116.25 121.13 1o0l h VAL 28 Ca 0.59 -3.03 -0.13 0.00 -1.01 0.00 0.00 66.70 63.11 1o0l h VAL 28 Cb 0.42 2.74 -0.01 0.00 -2.01 0.00 0.00 31.29 32.43 1o0l h VAL 28 CO 1.26 0.88 -0.51 0.00 -1.01 0.00 0.00 177.57 178.19 1o0l n GLY 30 N 0.07 4.96 3.61 0.00 0.00 -1.21 -4.95 105.19 107.68 1o0l n GLY 30 Ca -0.02 -2.03 -0.43 0.00 0.00 0.00 0.00 46.02 43.54 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 -1.58 3.06 0.00 4.61 0.00 -1.21 -4.27 121.76 122.37 1o0l s ALA 31 Ca 0.55 0.40 0.00 0.00 0.00 0.00 0.00 51.96 52.91 1o0l s ALA 31 Cb 0.26 -3.94 0.00 0.00 0.00 0.00 0.00 23.12 19.44 1o0l s ALA 31 CO -0.15 -2.32 0.00 0.41 0.00 0.00 0.00 175.76 173.70 1o0l n GLY 32 N 5.10 -0.42 0.23 0.00 0.00 -1.26 -4.97 105.19 103.87 1o0l n GLY 32 Ca 0.21 0.10 -0.08 0.00 0.00 0.00 0.00 46.02 46.24 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 0.75 -0.96 1.61 0.11 -1.87 -2.87 132.00 128.78 1o0l h PRO 33 Ca 0.00 -0.14 -0.54 0.00 0.11 0.00 0.00 66.00 65.43 1o0l h PRO 33 Cb 0.00 -0.12 -0.30 0.00 0.11 0.00 0.00 31.00 30.70 1o0l h PRO 33 CO 0.00 0.68 0.65 0.41 -0.21 0.00 0.00 178.00 179.53 1o0l n GLY 34 N -0.76 4.86 0.06 -0.55 0.00 -1.23 -4.34 105.19 103.23 1o0l n GLY 34 Ca 0.02 -1.39 0.12 0.00 0.00 0.00 0.00 46.02 44.77 1o0l n GLY 34 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1o0l n GLU 35 N -1.09 0.25 -3.55 1.61 0.28 -1.08 -4.45 120.64 112.61 1o0l n GLU 35 Ca 0.59 0.08 -0.37 0.00 -0.16 0.00 0.00 57.16 57.31 1o0l n GLU 35 Cb 1.41 -1.67 -0.06 0.00 1.43 0.00 0.00 31.44 32.55 1o0l n GLU 35 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 1o0l s GLY 36 N -3.57 2.40 0.00 -1.84 0.00 -1.26 -5.06 107.32 97.99 1o0l s GLY 36 Ca 0.07 -0.31 0.00 0.00 0.00 0.00 0.00 44.72 44.48 1o0l s GLY 36 CO 0.71 -0.01 0.00 -1.55 0.00 0.00 0.00 173.10 172.25 1o0l n PRO 37 N 1.44 3.13 -2.78 2.90 -0.04 -1.26 -4.96 135.00 133.43 1o0l n PRO 37 Ca -0.12 0.00 -0.44 0.00 -0.04 0.00 0.00 63.50 62.91 1o0l n PRO 37 Cb 0.52 0.00 -0.00 0.00 -0.04 0.00 0.00 33.50 33.98 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 -2.95 3.69 -0.06 0.55 0.00 -1.26 -4.62 121.76 117.11 1o0l s ALA 38 Ca 0.00 -3.16 0.09 0.00 0.00 0.00 0.00 51.96 48.90 1o0l s ALA 38 Cb 0.00 -4.37 0.14 0.00 0.00 0.00 0.00 23.12 18.90 1o0l s ALA 38 CO 0.00 -3.02 1.03 0.00 0.00 0.00 0.00 175.76 173.78 1o0l n ALA 39 N 6.91 2.04 -2.40 0.00 0.00 -1.26 -4.62 120.51 121.19 1o0l n ALA 39 Ca 0.42 -1.76 -0.19 0.00 0.00 0.00 0.00 53.44 51.91 1o0l n ALA 39 Cb 0.44 -0.26 -0.11 0.00 0.00 0.00 0.00 19.45 19.53 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 -1.84 2.51 0.00 0.00 1.01 -1.26 -5.02 116.67 112.08 1o0l s ASP 40 Ca 0.16 -0.94 0.00 0.00 0.71 0.00 0.00 52.55 52.47 1o0l s ASP 40 Cb 0.14 -0.13 0.00 0.00 1.01 0.00 0.00 42.92 43.94 1o0l s ASP 40 CO 0.01 -0.13 0.94 -2.65 0.21 0.00 0.00 175.17 173.56 1o0l n PRO 41 N -0.05 0.57 0.00 8.23 -0.02 -1.26 -2.21 135.00 140.26 1o0l n PRO 41 Ca -0.11 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.37 1o0l n PRO 41 Cb 0.59 -1.22 0.00 0.00 -0.02 0.00 0.00 33.50 32.85 1o0l n PRO 41 CO 0.00 0.00 0.00 1.47 1.98 0.00 0.00 175.50 178.95 1o0l n LEU 42 N 1.37 0.00 0.29 2.45 -0.00 -1.26 -4.28 117.00 115.58 1o0l n LEU 42 Ca 0.00 0.00 -0.16 0.00 -0.00 0.00 0.00 56.01 55.85 1o0l n LEU 42 Cb 0.28 0.00 -0.08 0.00 -0.00 0.00 0.00 43.42 43.62 1o0l n LEU 42 CO 0.00 0.00 0.69 0.45 -0.00 0.00 0.00 177.39 178.53 1o0l h HIS 43 N 0.00 -0.68 0.00 1.47 3.86 -1.81 -0.14 115.15 117.86 1o0l h HIS 43 Ca 0.00 -0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.19 1o0l h HIS 43 Cb 0.00 0.23 -0.00 0.00 1.06 0.00 0.00 27.41 28.70 1o0l h HIS 43 CO 0.00 -0.41 -0.04 1.96 0.86 0.00 0.00 177.93 180.30 1o0l h GLN 44 N -0.71 0.00 0.01 2.45 4.20 -1.81 -1.02 115.11 118.23 1o0l h GLN 44 Ca -0.07 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.61 1o0l h GLN 44 Cb 0.55 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.33 1o0l h GLN 44 CO 0.10 0.04 -0.14 0.00 -0.67 0.00 0.00 178.83 178.16 1o0l h ALA 45 N 1.96 0.01 -0.13 3.87 0.00 -1.69 -3.17 119.26 120.12 1o0l h ALA 45 Ca -0.00 -0.46 -0.11 0.00 0.00 0.00 0.00 54.91 54.34 1o0l h ALA 45 Cb 0.18 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1o0l h ALA 45 CO 0.00 0.02 -0.41 1.98 0.00 0.00 0.00 179.25 180.85 1o0l h MET 46 N -0.69 0.29 -0.69 0.00 4.05 -0.69 -2.16 114.93 115.03 1o0l h MET 46 Ca -0.02 -0.14 0.00 0.00 -0.28 0.00 0.00 59.70 59.27 1o0l h MET 46 Cb 0.96 -0.00 -0.03 0.00 -0.80 0.00 0.00 31.60 31.72 1o0l h MET 46 CO 0.03 0.65 0.45 -0.09 0.23 0.00 0.00 176.91 178.18 1o0l h ARG 47 N 0.24 0.92 0.01 0.39 9.65 -1.29 0.11 114.38 124.42 1o0l h ARG 47 Ca 0.02 -0.06 -0.20 0.00 -1.10 0.00 0.00 59.98 58.64 1o0l h ARG 47 Cb 0.82 -0.20 -0.02 0.00 -1.39 0.00 0.00 29.97 29.18 1o0l h ARG 47 CO 0.07 0.62 -0.94 0.00 2.80 0.00 0.00 179.97 182.52 1o0l h ALA 48 N 1.24 0.46 0.69 2.80 0.00 -1.51 -2.84 119.26 120.11 1o0l h ALA 48 Ca 0.25 -0.81 -0.03 0.00 0.00 0.00 0.00 54.91 54.32 1o0l h ALA 48 Cb -0.09 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 17.60 1o0l h ALA 48 CO -0.05 1.07 -0.33 0.00 0.00 0.00 0.00 179.25 179.94 1o0l h ALA 49 N 1.01 -1.12 -0.62 0.00 0.00 -0.96 -1.92 119.26 115.65 1o0l h ALA 49 Ca -0.03 -0.20 0.13 0.00 0.00 0.00 0.00 54.91 54.81 1o0l h ALA 49 Cb 1.63 0.36 -0.11 0.00 0.00 0.00 0.00 17.79 19.67 1o0l h ALA 49 CO 0.13 -1.05 -0.01 0.78 0.00 0.00 0.00 179.25 179.10 1o0l h GLY 50 N -1.03 0.64 0.70 0.00 0.00 -0.88 -1.13 103.07 101.37 1o0l h GLY 50 Ca -0.09 0.10 0.05 0.00 0.00 0.00 0.00 47.33 47.38 1o0l h GLY 50 CO 0.16 -0.21 0.27 -1.80 0.00 0.00 0.00 176.54 174.96 1o0l h ASP 51 N 0.10 0.39 -0.48 0.19 3.58 -1.49 0.80 116.42 119.51 1o0l h ASP 51 Ca 0.32 0.03 -0.00 0.00 0.42 0.00 0.00 57.03 57.80 1o0l h ASP 51 Cb 0.52 -0.04 -0.02 0.00 1.72 0.00 0.00 39.33 41.51 1o0l h ASP 51 CO -0.54 0.26 0.29 -0.08 -2.88 0.00 0.00 179.24 176.29 1o0l h GLU 52 N 0.52 0.66 0.00 0.28 4.81 -0.41 -1.68 114.58 118.75 1o0l h GLU 52 Ca 0.24 -0.06 -0.15 0.00 -0.13 0.00 0.00 59.36 59.26 1o0l h GLU 52 Cb 0.15 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.38 1o0l h GLU 52 CO -0.17 0.49 -0.69 0.74 -0.73 0.00 0.00 179.01 178.65 1o0l h PHE 53 N 0.64 0.00 0.00 0.92 -1.00 -0.79 0.15 116.94 116.86 1o0l h PHE 53 Ca 0.17 0.00 -0.02 0.00 2.81 0.00 0.00 57.97 60.93 1o0l h PHE 53 Cb 0.00 0.00 -0.00 0.00 3.61 0.00 0.00 35.95 39.56 1o0l h PHE 53 CO -0.03 0.69 -0.09 1.49 -1.61 0.00 0.00 178.31 178.76 1o0l h GLU 54 N 0.00 0.00 0.06 1.51 4.81 0.98 0.74 114.58 122.69 1o0l h GLU 54 Ca -0.01 0.00 -0.37 0.00 -0.13 0.00 0.00 59.36 58.85 1o0l h GLU 54 Cb 1.38 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.72 1o0l h GLU 54 CO 0.09 0.09 -2.21 2.41 -0.73 0.00 0.00 179.01 178.66 1o0l n THR 55 N -3.43 1.64 -0.07 0.32 -1.04 -0.67 -4.62 114.28 106.41 1o0l n THR 55 Ca -0.01 -0.63 -0.06 0.00 -2.04 0.00 0.00 64.05 61.31 1o0l n THR 55 Cb 0.25 -1.52 -0.03 0.00 -1.82 0.00 0.00 70.33 67.21 1o0l n THR 55 CO 0.00 0.00 0.00 0.03 -0.64 0.00 0.00 175.07 174.46 1o0l h ARG 56 N 0.04 0.00 -4.45 -2.82 3.08 -0.41 -3.41 114.38 106.41 1o0l h ARG 56 Ca -0.49 0.00 -0.71 0.00 0.07 0.00 0.00 59.98 58.84 1o0l h ARG 56 Cb 1.98 0.00 -0.09 0.00 0.08 0.00 0.00 29.97 31.95 1o0l h ARG 56 CO 0.01 0.23 2.50 0.34 -1.07 0.00 0.00 179.97 181.98 1o0l n PHE 57 N -4.66 3.86 0.81 3.04 7.35 0.26 -4.71 117.46 123.40 1o0l n PHE 57 Ca -0.07 -2.95 0.12 0.00 -0.76 0.00 0.00 57.45 53.79 1o0l n PHE 57 Cb 0.23 -2.42 0.51 0.00 0.35 0.00 0.00 39.48 38.14 1o0l n PHE 57 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 1o0l n ARG 58 N 6.20 0.01 -1.39 -4.13 1.74 -1.26 -4.03 116.66 113.80 1o0l n ARG 58 Ca 0.47 0.10 -0.28 0.00 -0.77 0.00 0.00 57.85 57.37 1o0l n ARG 58 Cb 0.41 -1.52 -0.08 0.00 -1.02 0.00 0.00 32.46 30.25 1o0l n ARG 58 CO 0.00 0.00 0.00 -2.13 -1.52 0.00 0.00 177.63 173.98 1o0l n ARG 59 N -1.54 3.03 0.04 5.56 0.63 -1.26 -4.16 116.66 118.96 1o0l n ARG 59 Ca 0.06 -2.11 0.00 0.00 -0.92 0.00 0.00 57.85 54.88 1o0l n ARG 59 Cb 0.29 -2.36 0.00 0.00 0.45 0.00 0.00 32.46 30.84 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 2.21 0.86 -0.04 5.15 -2.24 -1.26 -4.76 114.28 114.20 1o0l n THR 60 Ca 0.57 0.28 0.17 0.00 -2.27 0.00 0.00 64.05 62.80 1o0l n THR 60 Cb 0.53 -1.50 0.61 0.00 -2.10 0.00 0.00 70.33 67.87 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 0.20 -0.52 4.78 0.04 -1.90 -2.04 116.94 117.50 1o0l h PHE 61 Ca 0.00 0.01 -0.11 0.00 2.80 0.00 0.00 57.97 60.67 1o0l h PHE 61 Cb 0.24 -0.06 -0.02 0.00 2.20 0.00 0.00 35.95 38.31 1o0l h PHE 61 CO 0.00 0.09 -0.10 0.77 -0.60 0.00 0.00 178.31 178.46 1o0l h SER 62 N 0.18 0.96 1.04 2.17 0.02 -1.87 -2.50 113.55 113.55 1o0l h SER 62 Ca 0.27 -0.31 -0.01 0.00 -0.84 0.00 0.00 61.79 60.91 1o0l h SER 62 Cb 0.84 -0.26 -0.00 0.00 0.14 0.00 0.00 62.40 63.12 1o0l h SER 62 CO -0.04 1.07 -0.03 0.44 -1.14 0.00 0.00 176.83 177.12 1o0l h ASP 63 N 0.86 0.00 -0.31 3.07 5.19 -1.67 -0.31 116.42 123.25 1o0l h ASP 63 Ca 0.14 0.00 -0.14 0.00 -0.62 0.00 0.00 57.03 56.40 1o0l h ASP 63 Cb 0.64 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.15 1o0l h ASP 63 CO 0.04 0.03 -0.36 -0.07 -3.12 0.00 0.00 179.24 175.76 1o0l h LEU 64 N 0.00 0.86 -0.11 1.55 3.38 -1.32 -1.54 115.31 118.13 1o0l h LEU 64 Ca -0.00 -0.48 -0.13 0.00 0.09 0.00 0.00 57.88 57.35 1o0l h LEU 64 Cb 0.56 -0.24 0.01 0.00 0.09 0.00 0.00 40.66 41.07 1o0l h LEU 64 CO 0.00 1.17 -0.44 0.00 0.09 0.00 0.00 178.44 179.27 1o0l h ALA 65 N 0.72 0.20 -0.74 1.53 0.00 -1.20 -2.64 119.26 117.13 1o0l h ALA 65 Ca 0.04 -0.48 0.09 0.00 0.00 0.00 0.00 54.91 54.57 1o0l h ALA 65 Cb 0.95 -0.02 -0.07 0.00 0.00 0.00 0.00 17.79 18.65 1o0l h ALA 65 CO 0.09 0.34 0.38 0.00 0.00 0.00 0.00 179.25 180.06 1o0l h ALA 66 N 0.49 1.02 0.69 0.00 0.00 -1.05 0.14 119.26 120.55 1o0l h ALA 66 Ca -0.02 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1o0l h ALA 66 Cb 1.08 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.81 1o0l h ALA 66 CO 0.09 -0.01 -0.33 1.96 0.00 0.00 0.00 179.25 180.96 1o0l h GLN 67 N 0.65 -0.89 -0.01 0.00 4.20 -1.27 -3.13 115.11 114.65 1o0l h GLN 67 Ca 0.36 0.06 0.00 0.00 0.06 0.00 0.00 58.65 59.13 1o0l h GLN 67 Cb 0.36 0.20 0.00 0.00 0.30 0.00 0.00 27.48 28.35 1o0l h GLN 67 CO -0.26 -0.57 0.00 1.28 -0.67 0.00 0.00 178.83 178.61 1o0l n LEU 68 N -5.43 0.08 0.18 1.46 7.99 -1.00 -3.50 117.00 116.78 1o0l n LEU 68 Ca -0.13 -0.04 0.07 0.00 -0.01 0.00 0.00 56.01 55.90 1o0l n LEU 68 Cb 0.39 -0.01 0.13 0.00 -0.11 0.00 0.00 43.42 43.82 1o0l n LEU 68 CO 0.34 0.02 0.63 -0.74 -1.51 0.00 0.00 177.39 176.13 1o0l h HIS 69 N 0.10 0.00 0.00 -1.77 2.76 -0.66 -3.37 115.15 112.20 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 0.02 0.00 0.00 0.00 1.55 0.00 0.00 27.41 28.98 1o0l h HIS 69 CO 0.01 0.29 -0.37 0.28 -1.30 0.00 0.00 177.93 176.84 1o0l n VAL 70 N -3.19 0.93 -3.63 5.26 0.31 -1.23 -5.08 118.33 111.71 1o0l n VAL 70 Ca 0.02 0.31 -0.07 0.00 -0.01 0.00 0.00 64.34 64.60 1o0l n VAL 70 Cb 0.63 -2.08 -0.06 0.00 -0.91 0.00 0.00 33.84 31.42 1o0l n VAL 70 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 1o0l s THR 71 N -1.86 0.00 0.89 2.52 -1.32 -1.26 -5.18 115.64 109.42 1o0l s THR 71 Ca -0.11 0.00 -0.13 0.00 -1.21 0.00 0.00 61.69 60.24 1o0l s THR 71 Cb 0.01 -1.00 0.13 0.00 -1.51 0.00 0.00 72.50 70.13 1o0l s THR 71 CO 0.16 0.00 1.19 -2.84 -2.21 0.00 0.00 174.62 170.92 1o0l s PRO 72 N -0.40 1.32 0.00 7.08 0.02 -1.26 -4.42 135.00 137.33 1o0l s PRO 72 Ca 0.04 0.07 0.00 0.00 0.02 0.00 0.00 61.00 61.13 1o0l s PRO 72 Cb -0.03 -1.88 0.00 0.00 0.02 0.00 0.00 34.50 32.61 1o0l s PRO 72 CO -0.07 -2.03 0.00 0.41 -0.33 0.00 0.00 177.00 174.98 1o0l n GLY 73 N -2.92 2.49 0.46 0.52 0.00 -1.26 -4.75 105.19 99.72 1o0l n GLY 73 Ca 0.09 -0.55 0.00 0.00 0.00 0.00 0.00 46.02 45.56 1o0l n GLY 73 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1o0l n SER 74 N 3.19 0.66 0.21 1.61 3.41 -1.26 -3.54 113.62 117.89 1o0l n SER 74 Ca 0.00 -1.43 0.10 0.00 -0.26 0.00 0.00 58.87 57.28 1o0l n SER 74 Cb 0.00 -0.33 0.30 0.00 -0.26 0.00 0.00 64.21 63.93 1o0l n SER 74 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1o0l h ALA 75 N 1.77 0.93 -0.84 7.33 0.00 -1.85 -3.24 119.26 123.36 1o0l h ALA 75 Ca 0.00 -0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.71 1o0l h ALA 75 Cb 0.33 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.05 1o0l h ALA 75 CO 0.00 0.24 0.42 -0.56 0.00 0.00 0.00 179.25 179.35 1o0l h GLN 76 N 0.00 1.19 -0.19 0.00 3.07 -1.99 0.17 115.11 117.35 1o0l h GLN 76 Ca -0.00 -0.16 -0.05 0.00 0.09 0.00 0.00 58.65 58.53 1o0l h GLN 76 Cb 0.94 -0.22 -0.01 0.00 0.08 0.00 0.00 27.48 28.27 1o0l h GLN 76 CO 0.02 0.90 -0.06 1.96 0.09 0.00 0.00 178.83 181.74 1o0l h GLN 77 N 1.18 0.38 -0.50 0.06 4.20 -1.87 0.28 115.11 118.85 1o0l h GLN 77 Ca 0.29 -0.15 0.01 0.00 0.06 0.00 0.00 58.65 58.86 1o0l h GLN 77 Cb 0.09 -0.02 -0.03 0.00 0.30 0.00 0.00 27.48 27.82 1o0l h GLN 77 CO -0.04 0.65 0.33 0.00 -0.67 0.00 0.00 178.83 179.09 1o0l h ARG 78 N 0.10 0.65 0.16 1.46 3.08 -1.61 -0.26 114.38 117.95 1o0l h ARG 78 Ca 0.05 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.05 1o0l h ARG 78 Cb 0.51 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.42 1o0l h ARG 78 CO 0.02 0.43 -0.08 0.35 -1.07 0.00 0.00 179.97 179.62 1o0l h PHE 79 N 0.66 -0.19 -0.43 3.04 3.57 -0.88 -2.37 116.94 120.34 1o0l h PHE 79 Ca 0.18 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.70 1o0l h PHE 79 Cb -0.07 0.06 -0.02 0.00 2.79 0.00 0.00 35.95 38.71 1o0l h PHE 79 CO -0.04 -0.02 0.29 1.79 -2.23 0.00 0.00 178.31 178.09 1o0l h THR 80 N -0.33 1.06 0.06 4.41 1.35 -0.73 0.93 112.91 119.65 1o0l h THR 80 Ca -0.02 -0.17 -0.00 0.00 -0.55 0.00 0.00 66.41 65.66 1o0l h THR 80 Cb 0.26 0.51 0.00 0.00 -1.73 0.00 0.00 68.15 67.19 1o0l h THR 80 CO 0.04 0.09 -0.03 1.56 -0.25 0.00 0.00 175.52 176.93 1o0l h GLN 81 N 0.50 -0.07 -0.57 4.72 1.08 -0.79 -0.24 115.11 119.74 1o0l h GLN 81 Ca 0.17 0.00 -0.05 0.00 -1.45 0.00 0.00 58.65 57.32 1o0l h GLN 81 Cb 0.06 0.02 -0.03 0.00 -0.05 0.00 0.00 27.48 27.48 1o0l h GLN 81 CO -0.04 0.12 0.15 0.28 -0.95 0.00 0.00 178.83 178.39 1o0l h VAL 82 N -0.25 1.23 -0.30 -0.54 2.07 -0.96 -1.37 116.25 116.13 1o0l h VAL 82 Ca -0.01 -0.82 -0.01 0.00 0.82 0.00 0.00 66.70 66.69 1o0l h VAL 82 Cb 0.22 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 30.61 1o0l h VAL 82 CO 0.01 0.31 0.16 0.28 0.02 0.00 0.00 177.57 178.35 1o0l h SER 83 N 0.84 0.37 -0.68 0.57 0.02 -0.56 0.19 113.55 114.30 1o0l h SER 83 Ca 0.19 -0.09 -0.07 0.00 -0.84 0.00 0.00 61.79 60.98 1o0l h SER 83 Cb 0.29 -0.09 -0.03 0.00 0.14 0.00 0.00 62.40 62.70 1o0l h SER 83 CO -0.00 0.35 0.18 0.44 -1.14 0.00 0.00 176.83 176.66 1o0l h ASP 84 N 0.36 1.03 0.45 3.07 5.19 -0.77 -0.08 116.42 125.67 1o0l h ASP 84 Ca 0.10 -0.21 -0.07 0.00 -0.62 0.00 0.00 57.03 56.23 1o0l h ASP 84 Cb 0.07 -0.27 -0.01 0.00 0.18 0.00 0.00 39.33 39.29 1o0l h ASP 84 CO -0.02 0.99 -0.34 -0.33 -3.12 0.00 0.00 179.24 176.42 1o0l h GLU 85 N 1.04 0.00 0.04 3.56 4.39 -0.90 -0.54 114.58 122.17 1o0l h GLU 85 Ca 0.22 0.00 -0.27 0.00 0.34 0.00 0.00 59.36 59.65 1o0l h GLU 85 Cb 0.35 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 29.02 1o0l h GLU 85 CO 0.00 0.34 -1.08 -0.07 -1.16 0.00 0.00 179.01 177.04 1o0l h LEU 86 N 0.00 0.78 -0.03 1.33 3.38 0.14 -3.17 115.31 117.75 1o0l h LEU 86 Ca -0.00 -0.66 0.00 0.00 0.09 0.00 0.00 57.88 57.31 1o0l h LEU 86 Cb 0.66 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.17 1o0l h LEU 86 CO 0.04 1.46 -0.10 0.33 0.09 0.00 0.00 178.44 180.27 1o0l n PHE 87 N -3.79 0.00 -0.35 1.13 7.35 -0.11 -3.62 117.46 118.07 1o0l n PHE 87 Ca -0.10 0.00 0.22 0.00 -0.76 0.00 0.00 57.45 56.81 1o0l n PHE 87 Cb 0.91 -0.39 0.47 0.00 0.35 0.00 0.00 39.48 40.81 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 0.07 0.41 0.00 -4.13 4.15 -1.07 -3.39 115.11 111.15 1o0l h GLN 88 Ca 0.00 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.40 1o0l h GLN 88 Cb 0.45 -0.09 0.00 0.00 0.21 0.00 0.00 27.48 28.05 1o0l h GLN 88 CO 0.00 0.27 0.00 0.41 -1.93 0.00 0.00 178.83 177.58 1o0l n GLY 89 N -1.37 -1.27 0.00 2.39 0.00 -1.25 -5.08 105.19 98.61 1o0l n GLY 89 Ca 0.29 0.60 0.00 0.00 0.00 0.00 0.00 46.02 46.90 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 -0.17 0.85 -0.02 0.00 -1.24 -4.89 105.19 99.72 1o0l n GLY 90 Ca 0.00 0.07 -0.01 0.00 0.00 0.00 0.00 46.02 46.09 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 1.34 -1.11 1.61 -0.05 -1.26 -4.58 135.00 130.95 1o0l n PRO 91 Ca 0.00 -0.37 -0.32 0.00 -0.05 0.00 0.00 63.50 62.76 1o0l n PRO 91 Cb 0.00 -1.42 0.12 0.00 -0.05 0.00 0.00 33.50 32.15 1o0l n PRO 91 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 175.50 174.65 1o0l s ASN 92 N 0.23 3.81 0.60 3.54 -0.87 -1.26 -4.49 114.94 116.51 1o0l s ASN 92 Ca 0.07 2.13 0.28 0.00 -1.57 0.00 0.00 52.86 53.77 1o0l s ASN 92 Cb 0.05 -2.56 1.38 0.00 -0.02 0.00 0.00 41.25 40.10 1o0l s ASN 92 CO 0.02 -2.51 1.79 -0.50 -2.57 0.00 0.00 177.10 173.33 1o0l h TRP 93 N -1.12 0.00 -0.01 2.20 4.06 -1.97 0.41 115.95 119.53 1o0l h TRP 93 Ca -0.45 0.00 -0.00 0.00 2.06 0.00 0.00 58.89 60.50 1o0l h TRP 93 Cb 1.27 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.42 1o0l h TRP 93 CO 0.52 0.00 0.00 0.78 -3.56 0.00 0.00 178.44 176.18 1o0l h GLY 94 N 0.00 0.01 1.33 1.49 0.00 -1.89 -3.02 103.07 100.99 1o0l h GLY 94 Ca 0.23 -0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.55 1o0l h GLY 94 CO -0.00 0.00 -0.62 3.21 0.00 0.00 0.00 176.54 179.13 1o0l h ARG 95 N -0.15 0.00 -0.48 4.80 3.08 -1.28 -3.32 114.38 117.02 1o0l h ARG 95 Ca 0.00 0.00 0.11 0.00 0.07 0.00 0.00 59.98 60.16 1o0l h ARG 95 Cb 0.16 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.19 1o0l h ARG 95 CO -0.00 0.00 0.33 1.25 -1.07 0.00 0.00 179.97 180.48 1o0l h LEU 96 N 0.00 0.15 0.26 3.04 7.12 -0.15 -0.32 115.31 125.41 1o0l h LEU 96 Ca 0.00 0.00 -0.01 0.00 0.13 0.00 0.00 57.88 58.00 1o0l h LEU 96 Cb 0.93 -0.03 0.00 0.00 -0.53 0.00 0.00 40.66 41.04 1o0l h LEU 96 CO 0.00 0.09 -0.12 0.58 -0.13 0.00 0.00 178.44 178.86 1o0l h VAL 97 N 0.17 0.77 0.00 1.05 2.07 -1.64 -2.39 116.25 116.27 1o0l h VAL 97 Ca 0.23 -0.10 -0.03 0.00 0.82 0.00 0.00 66.70 67.61 1o0l h VAL 97 Cb 0.67 0.82 -0.00 0.00 -1.52 0.00 0.00 31.29 31.26 1o0l h VAL 97 CO -0.03 0.02 -0.16 0.00 0.02 0.00 0.00 177.57 177.42 1o0l h ALA 98 N 0.34 1.50 0.32 1.67 0.00 -1.37 0.10 119.26 121.81 1o0l h ALA 98 Ca -0.04 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 1o0l h ALA 98 Cb 0.30 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 1o0l h ALA 98 CO 0.06 0.20 -0.27 0.74 0.00 0.00 0.00 179.25 179.98 1o0l h PHE 99 N 0.00 -0.73 0.04 0.00 0.04 -0.60 0.32 116.94 116.01 1o0l h PHE 99 Ca -0.00 0.00 -0.26 0.00 2.80 0.00 0.00 57.97 60.51 1o0l h PHE 99 Cb 0.34 0.28 0.02 0.00 2.20 0.00 0.00 35.95 38.78 1o0l h PHE 99 CO 0.00 -0.40 -1.08 0.74 -0.60 0.00 0.00 178.31 176.97 1o0l h PHE 100 N -0.61 0.86 -0.57 -0.55 -1.00 -1.33 -3.24 116.94 110.50 1o0l h PHE 100 Ca -0.02 -0.50 0.00 0.00 2.81 0.00 0.00 57.97 60.27 1o0l h PHE 100 Cb 0.54 -0.09 -0.03 0.00 3.61 0.00 0.00 35.95 39.98 1o0l h PHE 100 CO -0.16 1.34 0.38 0.28 -1.61 0.00 0.00 178.31 178.54 1o0l h VAL 101 N 0.29 1.15 0.27 -0.55 2.07 -0.88 -1.25 116.25 117.35 1o0l h VAL 101 Ca -0.13 -0.28 0.00 0.00 0.82 0.00 0.00 66.70 67.12 1o0l h VAL 101 Cb 1.73 0.31 -0.03 0.00 -1.52 0.00 0.00 31.29 31.78 1o0l h VAL 101 CO 0.20 0.14 -0.49 -0.26 0.02 0.00 0.00 177.57 177.19 1o0l h PHE 102 N 0.78 -1.38 -0.16 1.57 -1.00 -0.38 0.13 116.94 116.49 1o0l h PHE 102 Ca 0.21 0.03 -0.14 0.00 2.81 0.00 0.00 57.97 60.88 1o0l h PHE 102 Cb -0.08 0.57 -0.01 0.00 3.61 0.00 0.00 35.95 40.03 1o0l h PHE 102 CO 0.00 -0.59 -0.48 0.78 -1.61 0.00 0.00 178.31 176.41 1o0l h GLY 103 N -0.81 0.46 0.95 -1.45 0.00 -1.65 -1.56 103.07 99.01 1o0l h GLY 103 Ca -0.03 -0.49 -0.01 0.00 0.00 0.00 0.00 47.33 46.80 1o0l h GLY 103 CO -0.18 0.44 0.17 0.00 0.00 0.00 0.00 176.54 176.97 1o0l h ALA 104 N 1.15 0.45 -0.50 3.60 0.00 -1.00 0.32 119.26 123.28 1o0l h ALA 104 Ca 0.02 -0.10 -0.13 0.00 0.00 0.00 0.00 54.91 54.70 1o0l h ALA 104 Cb 0.96 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 1o0l h ALA 104 CO 0.08 0.00 -0.20 0.00 0.00 0.00 0.00 179.25 179.14 1o0l h ALA 105 N 1.02 0.70 -0.49 0.00 0.00 -0.73 -0.92 119.26 118.84 1o0l h ALA 105 Ca 0.12 -0.39 -0.00 0.00 0.00 0.00 0.00 54.91 54.64 1o0l h ALA 105 Cb 0.11 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1o0l h ALA 105 CO -0.02 0.68 0.31 1.25 0.00 0.00 0.00 179.25 181.47 1o0l h LEU 106 N 0.87 0.58 -0.55 0.00 6.46 -0.94 -2.46 115.31 119.27 1o0l h LEU 106 Ca 0.12 -0.04 -0.10 0.00 -0.12 0.00 0.00 57.88 57.74 1o0l h LEU 106 Cb 0.78 -0.15 -0.02 0.00 -0.73 0.00 0.00 40.66 40.54 1o0l h LEU 106 CO 0.06 0.45 -0.03 0.00 -0.62 0.00 0.00 178.44 178.31 1o0l h ALA 108 N 0.95 -0.47 0.00 0.00 0.00 -0.84 -1.25 119.26 117.64 1o0l h ALA 108 Ca 0.15 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1o0l h ALA 108 Cb 0.58 0.42 0.00 0.00 0.00 0.00 0.00 17.79 18.79 1o0l h ALA 108 CO 0.03 -0.81 0.00 0.93 0.00 0.00 0.00 179.25 179.40 1o0l h GLU 109 N -0.49 0.00 0.05 0.00 5.08 -1.45 -2.55 114.58 115.21 1o0l h GLU 109 Ca 0.02 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 58.15 1o0l h GLU 109 Cb 0.50 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.75 1o0l h GLU 109 CO -0.13 0.00 -1.04 0.77 -1.00 0.00 0.00 179.01 177.61 1o0l h SER 110 N 0.00 0.27 0.64 1.42 0.02 -0.65 -3.03 113.55 112.22 1o0l h SER 110 Ca 0.00 -0.26 -0.18 0.00 -0.84 0.00 0.00 61.79 60.51 1o0l h SER 110 Cb 0.42 -0.09 -0.02 0.00 0.14 0.00 0.00 62.40 62.86 1o0l h SER 110 CO 0.00 1.14 -0.81 0.58 -1.14 0.00 0.00 176.83 176.60 1o0l h VAL 111 N 0.08 1.51 0.00 2.27 2.07 -0.90 -2.87 116.25 118.41 1o0l h VAL 111 Ca -0.07 -2.57 0.00 0.00 0.82 0.00 0.00 66.70 64.88 1o0l h VAL 111 Cb 1.73 2.41 0.00 0.00 -1.52 0.00 0.00 31.29 33.91 1o0l h VAL 111 CO 0.16 0.74 0.00 0.59 0.02 0.00 0.00 177.57 179.08 1o0l n ASN 112 N -3.66 0.00 0.00 0.57 3.02 -0.99 -4.81 115.26 109.38 1o0l n ASN 112 Ca -0.02 -0.92 0.00 0.00 -0.03 0.00 0.00 54.58 53.61 1o0l n ASN 112 Cb 0.77 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.94 1o0l n ASN 112 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1o0l n LYS 113 N -0.96 1.49 -2.23 3.52 5.02 -1.09 -5.06 118.16 118.85 1o0l n LYS 113 Ca 0.19 0.00 -0.34 0.00 -2.02 0.00 0.00 58.31 56.14 1o0l n LYS 113 Cb 0.09 0.00 0.02 0.00 -0.02 0.00 0.00 35.03 35.12 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 0.00 3.20 -2.76 1.97 1.02 -1.26 -4.58 120.64 118.24 1o0l n GLU 114 Ca 0.00 -4.04 -0.02 0.00 -0.02 0.00 0.00 57.16 53.08 1o0l n GLU 114 Cb 0.00 -2.27 0.07 0.00 -0.02 0.00 0.00 31.44 29.22 1o0l n GLU 114 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1o0l n MET 115 N -0.47 1.51 -0.13 3.49 0.00 -1.15 -4.96 117.12 115.40 1o0l n MET 115 Ca 0.47 -2.73 -0.08 0.00 0.00 0.00 0.00 57.70 55.36 1o0l n MET 115 Cb 0.41 -0.89 -0.00 0.00 0.00 0.00 0.00 33.22 32.73 1o0l n MET 115 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 175.97 176.90 1o0l h GLU 116 N 2.19 0.54 0.00 3.17 3.07 -1.80 -2.63 114.58 119.13 1o0l h GLU 116 Ca -0.23 -0.05 0.00 0.00 -0.50 0.00 0.00 59.36 58.59 1o0l h GLU 116 Cb 1.27 -0.12 0.00 0.00 -0.84 0.00 0.00 28.75 29.06 1o0l h GLU 116 CO 0.11 0.39 0.08 -1.35 -1.40 0.00 0.00 179.01 176.84 1o0l h PRO 117 N 0.53 0.00 0.00 2.33 0.11 -1.92 0.59 132.00 133.64 1o0l h PRO 117 Ca 0.14 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.20 1o0l h PRO 117 Cb -0.01 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.09 1o0l h PRO 117 CO -0.03 0.00 -0.47 -0.07 -0.21 0.00 0.00 178.00 177.22 1o0l h LEU 118 N 0.00 0.00 0.19 2.35 4.07 -1.87 -3.34 115.31 116.72 1o0l h LEU 118 Ca 0.00 0.00 0.01 0.00 0.08 0.00 0.00 57.88 57.97 1o0l h LEU 118 Cb 0.16 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 41.87 1o0l h LEU 118 CO 0.00 0.25 -0.27 0.58 -1.08 0.00 0.00 178.44 177.92 1o0l h VAL 119 N 0.00 0.42 -0.13 1.22 2.07 -0.93 0.51 116.25 119.41 1o0l h VAL 119 Ca -0.02 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.48 1o0l h VAL 119 Cb 1.21 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 31.39 1o0l h VAL 119 CO 0.03 0.00 0.00 1.23 0.02 0.00 0.00 177.57 178.85 1o0l h GLY 120 N -0.52 0.19 0.63 2.17 0.00 -1.70 -0.94 103.07 102.91 1o0l h GLY 120 Ca 0.01 -0.09 -0.00 0.00 0.00 0.00 0.00 47.33 47.25 1o0l h GLY 120 CO -0.11 0.08 -0.03 1.46 0.00 0.00 0.00 176.54 177.95 1o0l h GLN 121 N 0.18 -0.08 -0.52 4.80 1.08 -1.49 -0.25 115.11 118.84 1o0l h GLN 121 Ca 0.04 0.01 0.06 0.00 -1.45 0.00 0.00 58.65 57.31 1o0l h GLN 121 Cb 0.12 0.02 -0.03 0.00 -0.05 0.00 0.00 27.48 27.54 1o0l h GLN 121 CO 0.00 0.28 0.35 0.28 -0.95 0.00 0.00 178.83 178.79 1o0l h VAL 122 N -0.45 0.98 -0.21 -0.54 2.07 -0.50 0.66 116.25 118.26 1o0l h VAL 122 Ca -0.01 -0.16 -0.03 0.00 0.82 0.00 0.00 66.70 67.32 1o0l h VAL 122 Cb 0.39 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 30.62 1o0l h VAL 122 CO 0.01 0.09 0.03 -0.61 0.02 0.00 0.00 177.57 177.11 1o0l h GLN 123 N 0.47 0.36 -0.08 1.57 4.15 -0.90 -1.52 115.11 119.17 1o0l h GLN 123 Ca 0.23 -0.10 -0.19 0.00 0.77 0.00 0.00 58.65 59.36 1o0l h GLN 123 Cb 0.29 -0.04 -0.00 0.00 0.21 0.00 0.00 27.48 27.94 1o0l h GLN 123 CO -0.06 0.51 -0.74 1.05 -1.93 0.00 0.00 178.83 177.66 1o0l h GLU 124 N 0.15 0.41 -0.94 1.69 4.11 0.19 0.11 114.58 120.29 1o0l h GLU 124 Ca 0.06 -0.34 0.03 0.00 0.07 0.00 0.00 59.36 59.19 1o0l h GLU 124 Cb 0.33 0.07 -0.05 0.00 0.50 0.00 0.00 28.75 29.60 1o0l h GLU 124 CO 0.01 0.98 0.61 -1.49 0.07 0.00 0.00 179.01 179.19 1o0l h TRP 125 N 0.28 1.16 0.11 2.06 6.55 0.36 0.18 115.95 126.64 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 1.31 -0.39 0.00 0.00 -0.86 0.00 0.00 29.16 29.23 1o0l h TRP 125 CO 0.05 0.68 -0.05 1.98 -1.05 0.00 0.00 178.44 180.04 1o0l h MET 126 N 1.20 -0.14 -0.20 0.49 4.05 -1.15 -2.79 114.93 116.40 1o0l h MET 126 Ca 0.37 0.01 -0.02 0.00 -0.28 0.00 0.00 59.70 59.78 1o0l h MET 126 Cb -0.02 0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 30.80 1o0l h MET 126 CO -0.11 0.36 0.02 -0.24 0.23 0.00 0.00 176.91 177.17 1o0l h VAL 127 N -0.77 1.11 0.16 -5.77 3.04 -0.80 -0.82 116.25 112.40 1o0l h VAL 127 Ca -0.01 -0.42 -0.01 0.00 -1.01 0.00 0.00 66.70 65.25 1o0l h VAL 127 Cb 0.56 0.94 0.00 0.00 -2.01 0.00 0.00 31.29 30.79 1o0l h VAL 127 CO 0.02 0.14 -0.08 -0.08 -1.01 0.00 0.00 177.57 176.57 1o0l h GLU 128 N 0.28 -0.21 -0.66 4.17 4.22 -0.70 0.18 114.58 121.87 1o0l h GLU 128 Ca 0.07 0.01 0.09 0.00 0.08 0.00 0.00 59.36 59.61 1o0l h GLU 128 Cb 0.15 0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.41 1o0l h GLU 128 CO 0.00 0.16 0.43 -0.92 -2.18 0.00 0.00 179.01 176.50 1o0l h TYR 129 N -0.62 0.56 0.06 0.92 5.03 -1.26 -0.16 116.97 121.50 1o0l h TYR 129 Ca -0.02 0.01 -0.00 0.00 2.58 0.00 0.00 58.73 61.30 1o0l h TYR 129 Cb 0.46 -0.18 0.00 0.00 1.55 0.00 0.00 36.73 38.56 1o0l h TYR 129 CO 0.05 0.27 -0.03 -0.07 -1.32 0.00 0.00 178.16 177.06 1o0l h LEU 130 N 0.54 -0.07 -1.56 2.82 4.07 -1.01 -0.75 115.31 119.35 1o0l h LEU 130 Ca 0.30 -0.54 -0.03 0.00 0.08 0.00 0.00 57.88 57.69 1o0l h LEU 130 Cb 0.46 0.02 -0.01 0.00 1.08 0.00 0.00 40.66 42.21 1o0l h LEU 130 CO -0.09 0.63 -0.03 -0.33 -1.08 0.00 0.00 178.44 177.55 1o0l h GLU 131 N -0.90 0.25 0.11 1.13 5.08 -0.43 0.58 114.58 120.39 1o0l h GLU 131 Ca -0.01 -0.04 -0.29 0.00 -1.00 0.00 0.00 59.36 58.03 1o0l h GLU 131 Cb 0.61 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.81 1o0l h GLU 131 CO 0.01 0.30 -1.48 1.15 -1.00 0.00 0.00 179.01 177.99 1o0l h THR 132 N 0.24 0.97 0.00 1.13 2.02 -1.14 -3.41 112.91 112.73 1o0l h THR 132 Ca 0.06 -2.38 -0.12 0.00 0.77 0.00 0.00 66.41 64.74 1o0l h THR 132 Cb 0.21 2.66 -0.02 0.00 -1.74 0.00 0.00 68.15 69.26 1o0l h THR 132 CO 0.01 0.70 -1.43 0.54 0.37 0.00 0.00 175.52 175.71 1o0l n ARG 133 N -3.90 0.18 -0.28 6.66 1.74 -0.35 -4.64 116.66 116.06 1o0l n ARG 133 Ca -0.26 0.06 -0.04 0.00 -0.77 0.00 0.00 57.85 56.83 1o0l n ARG 133 Cb 0.91 -0.98 0.07 0.00 -1.02 0.00 0.00 32.46 31.43 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 -0.13 0.89 -1.89 0.55 -0.00 -0.44 -1.97 115.31 112.33 1o0l h LEU 134 Ca -0.18 -0.02 0.16 0.00 -0.00 0.00 0.00 57.88 57.84 1o0l h LEU 134 Cb 1.22 -0.22 -0.03 0.00 -0.00 0.00 0.00 40.66 41.63 1o0l h LEU 134 CO -0.07 0.65 0.43 0.00 -0.00 0.00 0.00 178.44 179.45 1o0l h ALA 135 N 1.29 2.43 0.23 1.53 0.00 -0.14 0.80 119.26 125.39 1o0l h ALA 135 Ca 0.29 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 1o0l h ALA 135 Cb -0.12 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1o0l h ALA 135 CO -0.06 -0.60 -0.11 0.22 0.00 0.00 0.00 179.25 178.69 1o0l h ASP 136 N 0.11 -0.26 -0.34 0.00 3.58 -1.62 0.13 116.42 118.02 1o0l h ASP 136 Ca 0.30 -0.21 0.02 0.00 0.42 0.00 0.00 57.03 57.55 1o0l h ASP 136 Cb 1.02 0.07 -0.02 0.00 1.72 0.00 0.00 39.33 42.12 1o0l h ASP 136 CO -0.03 0.09 0.20 -0.25 -2.88 0.00 0.00 179.24 176.36 1o0l h TRP 137 N -0.64 0.37 -0.42 0.28 7.01 -1.33 -1.39 115.95 119.83 1o0l h TRP 137 Ca -0.03 0.01 0.04 0.00 2.11 0.00 0.00 58.89 61.02 1o0l h TRP 137 Cb 0.46 -0.12 -0.04 0.00 -2.10 0.00 0.00 29.16 27.36 1o0l h TRP 137 CO 0.03 0.21 0.18 0.82 -2.79 0.00 0.00 178.44 176.89 1o0l h ILE 138 N 0.40 0.92 0.00 2.65 2.04 -0.82 0.26 117.51 122.96 1o0l h ILE 138 Ca 0.14 -0.13 -0.07 0.00 1.00 0.00 0.00 64.86 65.80 1o0l h ILE 138 Cb 0.01 0.52 -0.01 0.00 -0.74 0.00 0.00 36.82 36.60 1o0l h ILE 138 CO -0.07 0.07 -0.35 0.45 0.00 0.00 0.00 178.15 178.25 1o0l h HIS 139 N 0.37 0.00 -0.02 1.37 3.86 -0.43 0.31 115.15 120.61 1o0l h HIS 139 Ca 0.19 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.40 1o0l h HIS 139 Cb 0.13 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.60 1o0l h HIS 139 CO -0.12 0.35 -0.15 0.43 0.86 0.00 0.00 177.93 179.30 1o0l n SER 140 N -4.02 1.88 -2.50 2.45 7.64 -0.55 -4.26 113.62 114.25 1o0l n SER 140 Ca -0.02 -1.49 -0.21 0.00 1.01 0.00 0.00 58.87 58.16 1o0l n SER 140 Cb 0.40 0.12 0.01 0.00 -1.01 0.00 0.00 64.21 63.73 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 0.25 3.69 0.00 6.43 2.88 0.86 -4.99 113.62 122.75 1o0l n SER 141 Ca 0.14 -3.37 0.00 0.00 -1.33 0.00 0.00 58.87 54.31 1o0l n SER 141 Cb 0.44 -0.47 0.00 0.00 -0.75 0.00 0.00 64.21 63.43 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 -0.39 2.05 0.00 0.46 0.00 -1.21 -4.88 105.19 101.21 1o0l n GLY 142 Ca 0.30 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.80 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 1.41 0.26 -0.02 0.00 0.06 -4.61 105.19 102.29 1o0l n GLY 143 Ca 0.00 -2.19 0.09 0.00 0.00 0.00 0.00 46.02 43.92 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 -0.00 1.61 4.06 -1.91 0.07 115.95 119.77 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 -0.01 0.00 -1.00 0.00 0.00 29.16 28.15 1o0l h TRP 144 CO 0.00 0.04 -0.37 0.00 -3.56 0.00 0.00 178.44 174.55 1o0l h ALA 145 N 1.96 1.38 -0.42 1.49 0.00 -1.86 -1.96 119.26 119.85 1o0l h ALA 145 Ca -0.00 -0.34 -0.14 0.00 0.00 0.00 0.00 54.91 54.43 1o0l h ALA 145 Cb 0.08 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1o0l h ALA 145 CO 0.01 0.47 -0.28 1.49 0.00 0.00 0.00 179.25 180.94 1o0l h GLU 146 N 0.01 0.89 -0.69 0.00 4.57 -1.24 -2.30 114.58 115.81 1o0l h GLU 146 Ca -0.00 -0.40 -0.04 0.00 -1.18 0.00 0.00 59.36 57.74 1o0l h GLU 146 Cb 0.66 -0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 29.20 1o0l h GLU 146 CO 0.05 1.05 0.28 0.35 -1.18 0.00 0.00 179.01 179.56 1o0l h PHE 147 N 0.76 1.05 -0.06 0.92 3.57 -1.25 0.15 116.94 122.07 1o0l h PHE 147 Ca 0.09 -0.08 -0.05 0.00 3.53 0.00 0.00 57.97 61.47 1o0l h PHE 147 Cb 0.84 -0.32 -0.01 0.00 2.79 0.00 0.00 35.95 39.25 1o0l h PHE 147 CO 0.05 0.81 -0.17 1.15 -2.23 0.00 0.00 178.31 177.92 1o0l h THR 148 N 0.99 1.16 0.00 4.41 2.02 -1.15 -1.50 112.91 118.84 1o0l h THR 148 Ca 0.23 -0.74 0.00 0.00 0.77 0.00 0.00 66.41 66.67 1o0l h THR 148 Cb 0.20 1.31 0.00 0.00 -1.74 0.00 0.00 68.15 67.92 1o0l h THR 148 CO -0.02 0.22 -0.59 0.00 0.37 0.00 0.00 175.52 175.50 1o0l h ALA 149 N 1.73 0.64 0.06 6.16 0.00 -0.83 0.11 119.26 127.13 1o0l h ALA 149 Ca 0.02 0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.78 1o0l h ALA 149 Cb 0.37 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.17 1o0l h ALA 149 CO 0.02 0.00 -0.61 -0.07 0.00 0.00 0.00 179.25 178.59 1o0l h LEU 150 N 0.00 0.43 -2.96 0.00 -0.00 0.26 -3.39 115.31 109.65 1o0l h LEU 150 Ca 0.00 -0.86 -0.18 0.00 -0.00 0.00 0.00 57.88 56.84 1o0l h LEU 150 Cb 0.81 -0.14 -0.36 0.00 -0.00 0.00 0.00 40.66 40.98 1o0l h LEU 150 CO 0.00 1.25 -0.95 -1.22 -0.00 0.00 0.00 178.44 177.52 1o0l n TYR 151 N -4.24 0.03 0.00 1.13 4.02 -0.78 -4.23 117.16 113.09 1o0l n TYR 151 Ca -0.12 -0.55 0.00 0.00 -0.01 0.00 0.00 57.90 57.22 1o0l n TYR 151 Cb 0.71 -0.07 0.00 0.00 -0.02 0.00 0.00 39.34 39.95 1o0l n TYR 151 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1o0l n GLY 152 N 0.41 0.40 0.08 2.72 0.00 0.38 -4.66 105.19 104.52 1o0l n GLY 152 Ca 0.02 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.04 -1.80 1.61 3.58 -1.89 -3.35 116.42 114.54 1o0l h ASP 153 Ca 0.00 -0.63 -0.77 0.00 0.42 0.00 0.00 57.03 56.04 1o0l h ASP 153 Cb 0.00 0.01 -0.19 0.00 1.72 0.00 0.00 39.33 40.86 1o0l h ASP 153 CO 0.00 0.65 1.69 0.61 -2.88 0.00 0.00 179.24 179.31 1o0l n GLY 154 N 0.82 5.31 2.93 -0.78 0.00 -1.26 -4.88 105.19 107.34 1o0l n GLY 154 Ca -0.09 -2.30 -0.43 0.00 0.00 0.00 0.00 46.02 43.20 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 1.78 5.15 -1.08 4.61 0.00 -1.26 -4.65 120.51 125.06 1o0l n ALA 155 Ca 0.46 -4.13 -0.32 0.00 0.00 0.00 0.00 53.44 49.45 1o0l n ALA 155 Cb 0.29 -3.22 0.12 0.00 0.00 0.00 0.00 19.45 16.64 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 1.13 3.06 0.49 0.00 2.34 -1.26 -4.70 118.68 119.73 1o0l s LEU 156 Ca 0.43 2.12 0.23 0.00 0.06 0.00 0.00 54.13 56.96 1o0l s LEU 156 Cb 0.09 -4.56 1.28 0.00 -0.56 0.00 0.00 46.19 42.44 1o0l s LEU 156 CO -0.02 -2.49 1.95 -0.08 -1.06 0.00 0.00 176.35 174.64 1o0l h GLU 157 N -1.13 0.16 -0.05 1.48 4.57 -1.98 0.29 114.58 117.92 1o0l h GLU 157 Ca -0.45 -0.01 -0.01 0.00 -1.18 0.00 0.00 59.36 57.71 1o0l h GLU 157 Cb 1.26 -0.04 -0.00 0.00 -0.16 0.00 0.00 28.75 29.82 1o0l h GLU 157 CO 0.47 0.10 -0.02 0.93 -1.18 0.00 0.00 179.01 179.31 1o0l h GLU 158 N 0.16 0.11 -0.47 1.92 4.39 -1.99 -1.87 114.58 116.83 1o0l h GLU 158 Ca 0.33 -0.05 -0.06 0.00 0.34 0.00 0.00 59.36 59.93 1o0l h GLU 158 Cb 1.07 -0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.69 1o0l h GLU 158 CO -0.05 0.49 0.06 0.00 -1.16 0.00 0.00 179.01 178.35 1o0l h ALA 159 N 0.62 1.23 0.61 3.43 0.00 -1.58 0.77 119.26 124.34 1o0l h ALA 159 Ca 0.01 -0.22 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 1o0l h ALA 159 Cb 0.45 -0.19 0.01 0.00 0.00 0.00 0.00 17.79 18.05 1o0l h ALA 159 CO 0.01 0.52 -0.30 0.00 0.00 0.00 0.00 179.25 179.48 1o0l h ARG 160 N 0.70 -0.80 0.00 0.00 3.08 -0.89 -0.84 114.38 115.64 1o0l h ARG 160 Ca 0.15 0.05 -0.09 0.00 0.07 0.00 0.00 59.98 60.16 1o0l h ARG 160 Cb 0.34 0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.56 1o0l h ARG 160 CO 0.01 -0.53 -0.43 0.07 -1.07 0.00 0.00 179.97 178.01 1o0l h ARG 161 N -0.83 0.00 -0.76 0.04 0.11 -1.24 -2.62 114.38 109.08 1o0l h ARG 161 Ca -0.08 0.00 -0.06 0.00 0.10 0.00 0.00 59.98 59.94 1o0l h ARG 161 Cb 0.64 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.69 1o0l h ARG 161 CO 0.13 0.43 0.25 1.25 0.10 0.00 0.00 179.97 182.14 1o0l h LEU 162 N 0.00 1.09 -0.45 0.08 6.46 -0.59 0.04 115.31 121.94 1o0l h LEU 162 Ca -0.00 -0.20 -0.16 0.00 -0.12 0.00 0.00 57.88 57.40 1o0l h LEU 162 Cb 0.80 -0.29 -0.01 0.00 -0.73 0.00 0.00 40.66 40.44 1o0l h LEU 162 CO 0.06 1.00 -0.43 -0.09 -0.62 0.00 0.00 178.44 178.36 1o0l h ARG 163 N 1.13 0.82 -0.33 1.25 2.43 -0.93 -0.62 114.38 118.13 1o0l h ARG 163 Ca 0.25 -0.45 -0.02 0.00 -0.81 0.00 0.00 59.98 58.96 1o0l h ARG 163 Cb 0.29 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 29.85 1o0l h ARG 163 CO -0.01 1.08 0.14 0.93 -1.51 0.00 0.00 179.97 180.60 1o0l h GLU 164 N 0.66 0.48 0.00 0.20 5.08 -1.11 -1.13 114.58 118.77 1o0l h GLU 164 Ca 0.05 -0.08 -0.05 0.00 -1.00 0.00 0.00 59.36 58.27 1o0l h GLU 164 Cb 1.00 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.16 1o0l h GLU 164 CO 0.10 0.46 -0.24 0.78 -1.00 0.00 0.00 179.01 179.11 1o0l h GLY 165 N 0.38 0.00 0.62 -3.84 0.00 -0.94 -2.14 103.07 97.16 1o0l h GLY 165 Ca 0.11 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.42 1o0l h GLY 165 CO -0.01 0.00 -0.20 -0.57 0.00 0.00 0.00 176.54 175.76 1o0l h ASN 166 N 0.00 -0.48 0.72 0.19 -0.73 -0.39 -3.15 115.58 111.74 1o0l h ASN 166 Ca -0.00 -0.11 -0.01 0.00 1.87 0.00 0.00 56.30 58.05 1o0l h ASN 166 Cb 0.65 0.12 -0.00 0.00 0.27 0.00 0.00 38.32 39.36 1o0l h ASN 166 CO 0.03 -0.09 -0.06 4.11 -0.37 0.00 0.00 177.43 181.06 1o0l h TRP 167 N -0.95 0.00 -0.19 0.67 5.08 -1.21 -2.37 115.95 116.98 1o0l h TRP 167 Ca -0.06 0.00 0.05 0.00 1.08 0.00 0.00 58.89 59.97 1o0l h TRP 167 Cb 0.56 0.00 -0.06 0.00 -3.00 0.00 0.00 29.16 26.66 1o0l h TRP 167 CO 0.02 0.06 -0.21 0.00 -1.28 0.00 0.00 178.44 177.02 1o0l h ALA 168 N 1.94 -0.12 0.00 0.11 0.00 -1.34 0.23 119.26 120.09 1o0l h ALA 168 Ca -0.00 0.06 -0.19 0.00 0.00 0.00 0.00 54.91 54.78 1o0l h ALA 168 Cb 0.43 0.44 -0.03 0.00 0.00 0.00 0.00 17.79 18.63 1o0l h ALA 168 CO 0.01 -0.65 -1.32 0.77 0.00 0.00 0.00 179.25 178.05 1o0l h SER 169 N -0.24 0.00 1.53 0.00 0.02 -1.61 -3.30 113.55 109.95 1o0l h SER 169 Ca 0.12 0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 60.97 1o0l h SER 169 Cb 0.42 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.95 1o0l h SER 169 CO -0.34 0.69 -0.47 -0.37 -1.14 0.00 0.00 176.83 175.21 1o0l h VAL 170 N 0.00 0.80 0.00 2.27 -1.51 -1.22 -1.24 116.25 115.34 1o0l h VAL 170 Ca -0.16 -2.13 -0.07 0.00 -1.23 0.00 0.00 66.70 63.12 1o0l h VAL 170 Cb 1.67 2.39 -0.01 0.00 -2.13 0.00 0.00 31.29 33.21 1o0l h VAL 170 CO 0.06 0.45 -0.40 -0.09 -1.23 0.00 0.00 177.57 176.36 1o0l h ARG 171 N 0.00 0.00 0.07 5.19 2.43 -0.70 -3.27 114.38 118.10 1o0l h ARG 171 Ca -0.01 0.00 -0.33 0.00 -0.81 0.00 0.00 59.98 58.83 1o0l h ARG 171 Cb 1.36 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.88 1o0l h ARG 171 CO 0.06 0.29 -1.87 0.25 -1.51 0.00 0.00 179.97 177.19 1o0l n THR 172 N -3.13 1.71 0.22 0.20 -2.24 -1.19 -3.30 114.28 106.55 1o0l n THR 172 Ca 0.02 -0.72 0.06 0.00 -2.27 0.00 0.00 64.05 61.14 1o0l n THR 172 Cb 0.66 -1.43 0.53 0.00 -2.10 0.00 0.00 70.33 67.99 1o0l n THR 172 CO 0.00 0.00 0.00 1.62 -0.57 0.00 0.00 175.07 176.12 1o0l h VAL 173 N 0.04 1.10 -0.78 2.28 3.04 -1.32 -2.72 116.25 117.90 1o0l h VAL 173 Ca -0.36 -0.48 -0.56 0.00 -1.01 0.00 0.00 66.70 64.29 1o0l h VAL 173 Cb 2.03 1.24 -0.42 0.00 -2.01 0.00 0.00 31.29 32.13 1o0l h VAL 173 CO 0.09 0.14 -0.69 0.18 -1.01 0.00 0.00 177.57 176.27 1o0l n LEU 174 N -4.37 5.13 0.28 3.16 4.77 -1.23 -4.78 117.00 119.95 1o0l n LEU 174 Ca -0.02 -4.72 0.13 0.00 -0.03 0.00 0.00 56.01 51.36 1o0l n LEU 174 Cb 0.21 -0.39 0.81 0.00 -2.33 0.00 0.00 43.42 41.72 1o0l n LEU 174 CO 0.36 2.07 1.06 0.71 -1.33 0.00 0.00 177.39 180.25 1o0l h THR 175 N 2.10 0.62 -0.05 -5.08 1.35 -1.47 -2.20 112.91 108.18 1o0l h THR 175 Ca 0.39 -0.20 0.00 0.00 -0.55 0.00 0.00 66.41 66.04 1o0l h THR 175 Cb 1.48 1.13 0.00 0.00 -1.73 0.00 0.00 68.15 69.03 1o0l h THR 175 CO 0.82 0.05 0.00 0.61 -0.25 0.00 0.00 175.52 176.75 1o0l n GLY 176 N -1.13 -0.77 0.00 5.82 0.00 -1.26 -3.81 105.19 104.04 1o0l n GLY 176 Ca -0.03 -0.07 0.09 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.39 1.92 -1.56 4.61 0.00 -0.83 -4.25 120.51 120.02 1o0l n ALA 177 Ca 0.03 -0.08 -0.41 0.00 0.00 0.00 0.00 53.44 52.99 1o0l n ALA 177 Cb 0.05 -1.30 -0.01 0.00 0.00 0.00 0.00 19.45 18.19 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 -1.38 3.60 -0.35 0.00 0.31 -1.25 -4.56 118.33 114.70 1o0l n VAL 178 Ca 0.07 -2.79 0.10 0.00 -0.01 0.00 0.00 64.34 61.71 1o0l n VAL 178 Cb 0.18 -2.59 0.32 0.00 -0.91 0.00 0.00 33.84 30.84 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 5.42 2.76 0.62 3.52 0.00 -1.26 -4.14 120.51 127.43 1o0l n ALA 179 Ca 0.59 -1.36 0.10 0.00 0.00 0.00 0.00 53.44 52.78 1o0l n ALA 179 Cb 0.34 -0.99 -0.14 0.00 0.00 0.00 0.00 19.45 18.66 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 1.27 0.62 -4.57 0.00 4.77 -1.26 -4.81 117.00 113.03 1o0l n LEU 180 Ca 0.24 -0.32 -0.32 0.00 -0.03 0.00 0.00 56.01 55.58 1o0l n LEU 180 Cb 0.73 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.78 1o0l n LEU 180 CO 0.20 0.16 1.48 -0.83 -1.33 0.00 0.00 177.39 177.06 1o0l s GLY 181 N -3.53 0.58 -0.35 -0.72 0.00 -1.26 -3.64 107.32 98.40 1o0l s GLY 181 Ca 0.02 -1.97 -0.17 0.00 0.00 0.00 0.00 44.72 42.60 1o0l s GLY 181 CO 0.87 3.24 0.44 0.00 0.00 0.00 0.00 173.10 177.65 1o0l s ALA 182 N 8.51 3.48 -0.21 3.20 0.00 -1.26 -5.07 121.76 130.41 1o0l s ALA 182 Ca 0.63 -1.14 0.02 0.00 0.00 0.00 0.00 51.96 51.46 1o0l s ALA 182 Cb -0.03 -2.93 0.01 0.00 0.00 0.00 0.00 23.12 20.18 1o0l s ALA 182 CO 0.01 -1.18 0.55 1.28 0.00 0.00 0.00 175.76 176.43