#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aia n PHE 6 N 0.00 0.00 -0.30 1.12 3.72 -1.26 -4.74 117.46 116.00 1aia n PHE 6 Ca 0.00 0.00 0.14 0.00 -0.05 0.00 0.00 57.45 57.54 1aia n PHE 6 Cb 0.00 -0.07 0.30 0.00 -0.94 0.00 0.00 39.48 38.77 1aia n PHE 6 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 1aia h GLU 7 N 0.14 0.18 -0.43 -1.08 3.07 -2.12 -2.33 114.58 112.01 1aia h GLU 7 Ca 0.00 -0.01 -0.29 0.00 -0.50 0.00 0.00 59.36 58.55 1aia h GLU 7 Cb 0.00 -0.04 -0.21 0.00 -0.84 0.00 0.00 28.75 27.66 1aia h GLU 7 CO 0.00 0.12 -0.45 0.09 -1.40 0.00 0.00 179.01 177.37 1aia n ASN 8 N -5.25 3.49 -4.71 1.42 5.03 -1.26 -4.99 115.26 108.99 1aia n ASN 8 Ca 0.22 -3.82 -0.42 0.00 0.87 0.00 0.00 54.58 51.43 1aia n ASN 8 Cb 0.71 -0.51 -0.03 0.00 -1.02 0.00 0.00 39.78 38.93 1aia n ASN 8 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 1aia s ILE 9 N -3.87 3.86 0.39 2.41 1.01 -0.88 -5.02 121.20 119.10 1aia s ILE 9 Ca 0.46 1.31 -0.19 0.00 0.00 0.00 0.00 60.65 62.23 1aia s ILE 9 Cb 0.40 -3.84 -0.10 0.00 0.01 0.00 0.00 42.46 38.93 1aia s ILE 9 CO -0.01 0.08 0.88 0.42 0.00 0.00 0.00 174.94 176.31 1aia s THR 10 N 1.34 4.47 0.52 2.92 -4.23 -1.26 -5.03 115.64 114.36 1aia s THR 10 Ca 0.60 1.35 -0.22 0.00 -1.18 0.00 0.00 61.69 62.24 1aia s THR 10 Cb -0.31 -3.63 -0.06 0.00 1.34 0.00 0.00 72.50 69.85 1aia s THR 10 CO 0.28 -0.25 1.33 0.00 -0.54 0.00 0.00 174.62 175.45 1aia s ALA 11 N -2.08 2.88 0.33 3.99 0.00 -1.26 -4.98 121.76 120.64 1aia s ALA 11 Ca 0.59 1.27 -0.27 0.00 0.00 0.00 0.00 51.96 53.56 1aia s ALA 11 Cb -0.10 -3.54 -0.09 0.00 0.00 0.00 0.00 23.12 19.39 1aia s ALA 11 CO 0.15 -1.24 1.01 0.00 0.00 0.00 0.00 175.76 175.68 1aia s ALA 12 N -1.34 3.22 0.37 0.00 0.00 -1.26 -5.01 121.76 117.75 1aia s ALA 12 Ca 0.69 0.66 -0.27 0.00 0.00 0.00 0.00 51.96 53.04 1aia s ALA 12 Cb -0.39 -3.24 -0.10 0.00 0.00 0.00 0.00 23.12 19.39 1aia s ALA 12 CO 0.46 -0.01 1.36 -1.25 0.00 0.00 0.00 175.76 176.33 1aia s PRO 13 N -1.98 4.12 0.25 0.00 0.04 -1.26 -4.96 135.00 131.21 1aia s PRO 13 Ca 0.50 2.31 -0.31 0.00 0.04 0.00 0.00 61.00 63.54 1aia s PRO 13 Cb -0.23 -2.92 -0.12 0.00 0.04 0.00 0.00 34.50 31.27 1aia s PRO 13 CO 0.29 -0.42 1.65 0.00 0.04 0.00 0.00 177.00 178.56 1aia n ALA 14 N 0.43 2.61 -1.99 8.56 0.00 -1.26 -4.94 120.51 123.91 1aia n ALA 14 Ca 0.02 0.39 -0.42 0.00 0.00 0.00 0.00 53.44 53.43 1aia n ALA 14 Cb 0.42 -2.48 -0.03 0.00 0.00 0.00 0.00 19.45 17.35 1aia n ALA 14 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1aia s ASP 15 N 0.82 6.66 0.22 0.00 -1.08 -1.26 -4.88 116.67 117.14 1aia s ASP 15 Ca 0.70 2.54 -0.09 0.00 -0.52 0.00 0.00 52.55 55.18 1aia s ASP 15 Cb -0.51 -2.59 0.22 0.00 -1.46 0.00 0.00 42.92 38.58 1aia s ASP 15 CO 0.41 -0.76 1.85 -0.65 0.52 0.00 0.00 175.17 176.53 1aia h PRO 16 N 6.62 0.87 0.05 4.34 0.11 -1.99 0.50 132.00 142.50 1aia h PRO 16 Ca -0.43 -0.05 -0.07 0.00 0.11 0.00 0.00 66.00 65.56 1aia h PRO 16 Cb 1.21 -0.20 0.01 0.00 0.11 0.00 0.00 31.00 32.13 1aia h PRO 16 CO 0.89 0.58 -0.30 0.82 -0.21 0.00 0.00 178.00 179.77 1aia h ILE 17 N 0.90 1.67 0.00 4.15 1.08 -1.94 -3.35 117.51 120.02 1aia h ILE 17 Ca 0.30 -2.35 -0.09 0.00 -0.39 0.00 0.00 64.86 62.33 1aia h ILE 17 Cb 0.05 3.25 -0.01 0.00 -3.07 0.00 0.00 36.82 37.03 1aia h ILE 17 CO -0.12 0.63 -0.42 -0.07 -0.69 0.00 0.00 178.15 177.48 1aia h LEU 18 N -0.72 0.00 -1.12 1.44 3.38 -1.90 -3.26 115.31 113.12 1aia h LEU 18 Ca -0.05 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.85 1aia h LEU 18 Cb 1.21 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.95 1aia h LEU 18 CO 0.06 0.42 -0.15 1.23 0.09 0.00 0.00 178.44 180.09 1aia h GLY 19 N 3.47 0.47 2.00 0.83 0.00 -0.15 -2.46 103.07 107.23 1aia h GLY 19 Ca -0.00 -0.33 -0.04 0.00 0.00 0.00 0.00 47.33 46.96 1aia h GLY 19 CO 0.06 0.30 -0.19 -2.00 0.00 0.00 0.00 176.54 174.71 1aia h LEU 20 N 0.40 0.00 -1.01 3.11 7.12 -1.69 -3.18 115.31 120.05 1aia h LEU 20 Ca 0.07 0.00 0.01 0.00 0.13 0.00 0.00 57.88 58.09 1aia h LEU 20 Cb 0.50 0.00 -0.05 0.00 -0.53 0.00 0.00 40.66 40.58 1aia h LEU 20 CO 0.03 0.19 0.67 0.00 -0.13 0.00 0.00 178.44 179.19 1aia h ALA 21 N 1.81 1.29 -0.00 1.25 0.00 -1.60 -1.57 119.26 120.45 1aia h ALA 21 Ca -0.00 -0.07 -0.17 0.00 0.00 0.00 0.00 54.91 54.67 1aia h ALA 21 Cb 0.37 -0.41 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1aia h ALA 21 CO 0.02 0.66 -0.78 -0.44 0.00 0.00 0.00 179.25 178.71 1aia h ASP 22 N 1.36 0.01 0.32 0.00 3.32 -1.70 -1.74 116.42 117.99 1aia h ASP 22 Ca 0.37 -0.01 -0.09 0.00 0.02 0.00 0.00 57.03 57.32 1aia h ASP 22 Cb -0.15 -0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.38 1aia h ASP 22 CO -0.08 0.79 -0.39 0.25 -1.72 0.00 0.00 179.24 178.09 1aia h LEU 23 N 0.01 0.11 0.04 1.55 6.46 -1.58 -2.99 115.31 118.90 1aia h LEU 23 Ca -0.01 -0.04 -0.00 0.00 -0.12 0.00 0.00 57.88 57.71 1aia h LEU 23 Cb 1.38 -0.03 0.00 0.00 -0.73 0.00 0.00 40.66 41.28 1aia h LEU 23 CO 0.10 0.49 -0.02 0.15 -0.62 0.00 0.00 178.44 178.55 1aia h PHE 24 N 0.09 -0.04 -2.33 1.25 3.57 -0.94 -3.07 116.94 115.46 1aia h PHE 24 Ca 0.01 -0.00 -0.76 0.00 3.53 0.00 0.00 57.97 60.75 1aia h PHE 24 Cb 0.73 0.01 -0.20 0.00 2.79 0.00 0.00 35.95 39.29 1aia h PHE 24 CO 0.01 0.48 1.28 2.89 -2.23 0.00 0.00 178.31 180.74 1aia n ARG 25 N -4.86 3.57 0.00 1.11 1.85 -0.69 -2.57 116.66 115.08 1aia n ARG 25 Ca -0.09 -3.96 0.00 0.00 -1.00 0.00 0.00 57.85 52.80 1aia n ARG 25 Cb 0.27 -2.87 0.00 0.00 -1.05 0.00 0.00 32.46 28.82 1aia n ARG 25 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1aia n ALA 26 N 4.24 0.00 0.12 2.89 0.00 -1.23 -4.86 120.51 121.67 1aia n ALA 26 Ca 0.34 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.68 1aia n ALA 26 Cb 0.40 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.78 1aia n ALA 26 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 1aia h ASP 27 N 0.00 -0.32 -6.89 0.00 1.82 -1.39 -3.47 116.42 106.17 1aia h ASP 27 Ca 0.00 -0.19 -0.20 0.00 -0.39 0.00 0.00 57.03 56.25 1aia h ASP 27 Cb 0.00 0.08 -0.02 0.00 0.68 0.00 0.00 39.33 40.07 1aia h ASP 27 CO 0.00 0.17 -0.33 -0.62 -1.61 0.00 0.00 179.24 176.85 1aia n GLU 28 N -5.04 -0.83 -4.45 0.28 4.71 -1.26 -4.96 120.64 109.10 1aia n GLU 28 Ca -0.08 -0.25 -0.26 0.00 -0.01 0.00 0.00 57.16 56.56 1aia n GLU 28 Cb 0.25 -0.40 -0.10 0.00 -1.01 0.00 0.00 31.44 30.18 1aia n GLU 28 CO 0.00 0.00 0.00 1.03 0.09 0.00 0.00 177.13 178.25 1aia s ARG 29 N -5.46 2.02 0.00 3.49 3.00 -1.26 -5.13 118.95 115.61 1aia s ARG 29 Ca 0.12 -1.96 0.00 0.00 0.00 0.00 0.00 55.73 53.89 1aia s ARG 29 Cb -0.07 -1.78 0.00 0.00 0.00 0.00 0.00 34.95 33.10 1aia s ARG 29 CO 0.32 -0.01 0.27 -0.35 0.00 0.00 0.00 175.30 175.53 1aia n PRO 30 N -1.00 0.00 -1.43 3.54 -0.04 -1.26 -4.15 135.00 130.65 1aia n PRO 30 Ca -0.04 0.13 -0.28 0.00 -0.04 0.00 0.00 63.50 63.27 1aia n PRO 30 Cb 0.65 -0.85 -0.00 0.00 -0.04 0.00 0.00 33.50 33.26 1aia n PRO 30 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1aia n GLY 31 N 1.08 4.72 3.67 0.55 0.00 -1.26 -4.99 105.19 108.95 1aia n GLY 31 Ca 0.00 -1.89 -0.46 0.00 0.00 0.00 0.00 46.02 43.67 1aia n GLY 31 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1aia n LYS 32 N 0.26 2.11 -4.31 1.61 5.02 -1.26 -4.89 118.16 116.70 1aia n LYS 32 Ca 0.48 0.76 -0.34 0.00 -2.02 0.00 0.00 58.31 57.19 1aia n LYS 32 Cb 0.51 -2.52 -0.13 0.00 -0.02 0.00 0.00 35.03 32.86 1aia n LYS 32 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1aia s ILE 33 N 0.88 3.48 -0.43 -0.18 1.01 -1.17 -4.99 121.20 119.79 1aia s ILE 33 Ca 0.79 -0.49 -0.13 0.00 0.00 0.00 0.00 60.65 60.82 1aia s ILE 33 Cb -0.69 -2.53 0.06 0.00 0.01 0.00 0.00 42.46 39.31 1aia s ILE 33 CO 0.38 0.47 0.31 0.21 0.00 0.00 0.00 174.94 176.31 1aia s ASN 34 N 0.80 5.92 0.00 3.58 3.84 -1.26 -0.64 114.94 127.18 1aia s ASN 34 Ca -0.02 -1.26 0.23 0.00 0.21 0.00 0.00 52.86 52.02 1aia s ASN 34 Cb -0.15 -2.10 0.48 0.00 -0.55 0.00 0.00 41.25 38.94 1aia s ASN 34 CO 0.02 -0.54 1.44 0.18 -2.79 0.00 0.00 177.10 175.40 1aia n LEU 35 N 5.08 3.61 -0.95 3.21 4.77 0.51 -4.36 117.00 128.87 1aia n LEU 35 Ca -0.11 -1.61 0.06 0.00 -0.03 0.00 0.00 56.01 54.32 1aia n LEU 35 Cb 0.44 -0.31 0.21 0.00 -2.33 0.00 0.00 43.42 41.43 1aia n LEU 35 CO 0.42 0.81 0.65 0.61 -1.33 0.00 0.00 177.39 178.55 1aia n GLY 36 N 1.56 1.41 3.86 -0.72 0.00 -1.09 -0.68 105.19 109.53 1aia n GLY 36 Ca 0.21 -0.50 -0.31 0.00 0.00 0.00 0.00 46.02 45.42 1aia n GLY 36 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1aia s ILE 37 N -1.58 4.62 -0.19 -0.61 -0.00 -1.26 -4.86 121.20 117.32 1aia s ILE 37 Ca 0.30 0.96 0.16 0.00 -0.00 0.00 0.00 60.65 62.08 1aia s ILE 37 Cb 0.18 -3.80 0.55 0.00 -0.00 0.00 0.00 42.46 39.39 1aia s ILE 37 CO 0.17 -1.00 1.45 0.61 -0.00 0.00 0.00 174.94 176.17 1aia n GLY 38 N -2.37 3.98 3.29 6.27 0.00 -1.26 -4.72 105.19 110.38 1aia n GLY 38 Ca 0.06 -1.04 -0.18 0.00 0.00 0.00 0.00 46.02 44.86 1aia n GLY 38 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1aia s VAL 39 N -2.84 1.51 0.28 1.61 1.01 -1.26 -5.08 120.40 115.62 1aia s VAL 39 Ca 0.43 -1.96 -0.29 0.00 0.00 0.00 0.00 61.98 60.16 1aia s VAL 39 Cb 0.35 -1.79 -0.10 0.00 0.00 0.00 0.00 36.38 34.84 1aia s VAL 39 CO 0.09 -0.51 1.26 -0.47 0.00 0.00 0.00 175.10 175.47 1aia s TYR 40 N -2.57 3.25 0.20 5.22 5.04 -1.26 -4.86 117.35 122.37 1aia s TYR 40 Ca 0.15 1.42 0.11 0.00 -2.44 0.00 0.00 57.07 56.31 1aia s TYR 40 Cb -0.03 -3.56 -0.04 0.00 0.35 0.00 0.00 41.96 38.68 1aia s TYR 40 CO 0.04 -1.54 -0.21 0.15 -1.34 0.00 0.00 175.55 172.65 1aia s LYS 41 N -1.16 1.48 0.06 4.97 1.02 -1.24 -4.53 119.74 120.34 1aia s LYS 41 Ca 0.50 -1.54 0.01 0.00 0.02 0.00 0.00 55.97 54.96 1aia s LYS 41 Cb -0.37 -1.67 0.01 0.00 -0.52 0.00 0.00 37.83 35.28 1aia s LYS 41 CO 0.45 0.34 0.08 -0.40 -0.92 0.00 0.00 175.35 174.90 1aia n ASP 42 N 0.08 0.18 0.17 2.83 5.68 0.42 -4.80 116.55 121.11 1aia n ASP 42 Ca -0.11 -1.13 0.11 0.00 -0.50 0.00 0.00 54.79 53.16 1aia n ASP 42 Cb 0.57 -0.04 0.60 0.00 -1.14 0.00 0.00 41.12 41.11 1aia n ASP 42 CO 0.00 0.00 0.00 -1.84 -1.33 0.00 0.00 177.20 174.03 1aia n GLU 43 N -1.13 0.14 0.07 0.11 0.00 -1.26 -0.86 120.64 117.71 1aia n GLU 43 Ca 0.01 0.64 0.01 0.00 0.00 0.00 0.00 57.16 57.83 1aia n GLU 43 Cb 0.05 -1.98 -0.05 0.00 0.00 0.00 0.00 31.44 29.47 1aia n GLU 43 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.13 178.28 1aia h THR 44 N 0.00 0.58 0.00 3.84 2.02 -1.99 -3.46 112.91 113.90 1aia h THR 44 Ca 0.00 -2.01 0.00 0.00 0.77 0.00 0.00 66.41 65.17 1aia h THR 44 Cb 0.02 2.11 0.00 0.00 -1.74 0.00 0.00 68.15 68.54 1aia h THR 44 CO 0.00 0.33 0.00 0.61 0.37 0.00 0.00 175.52 176.83 1aia n GLY 45 N 1.33 1.27 3.45 2.16 0.00 -0.04 -5.09 105.19 108.27 1aia n GLY 45 Ca -0.06 -0.30 -0.24 0.00 0.00 0.00 0.00 46.02 45.42 1aia n GLY 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1aia s LYS 46 N -1.50 1.60 -0.68 1.61 1.02 -1.26 -4.79 119.74 115.74 1aia s LYS 46 Ca 0.00 -1.68 0.01 0.00 0.02 0.00 0.00 55.97 54.32 1aia s LYS 46 Cb 0.00 -1.74 0.17 0.00 -0.52 0.00 0.00 37.83 35.74 1aia s LYS 46 CO 0.00 0.34 0.49 0.99 -0.92 0.00 0.00 175.35 176.25 1aia s THR 47 N -2.29 3.46 0.77 2.17 2.01 -1.26 -0.44 115.64 120.06 1aia s THR 47 Ca 0.27 -3.54 -0.11 0.00 0.31 0.00 0.00 61.69 58.62 1aia s THR 47 Cb -0.06 -3.25 0.06 0.00 0.01 0.00 0.00 72.50 69.26 1aia s THR 47 CO 0.13 -0.94 1.09 -2.84 -0.69 0.00 0.00 174.62 171.37 1aia s PRO 48 N -0.72 2.25 -0.03 4.92 0.02 -1.26 -5.02 135.00 135.16 1aia s PRO 48 Ca 0.21 1.15 -0.28 0.00 0.02 0.00 0.00 61.00 62.11 1aia s PRO 48 Cb -0.15 -1.90 -0.03 0.00 0.02 0.00 0.00 34.50 32.44 1aia s PRO 48 CO -0.07 -1.64 0.90 0.08 -0.33 0.00 0.00 177.00 175.93 1aia s VAL 49 N -2.91 4.91 0.62 3.83 1.01 -1.26 -4.93 120.40 121.67 1aia s VAL 49 Ca 0.61 1.88 -0.19 0.00 0.00 0.00 0.00 61.98 64.28 1aia s VAL 49 Cb -0.17 -4.24 -0.03 0.00 0.00 0.00 0.00 36.38 31.94 1aia s VAL 49 CO 0.56 0.17 1.16 0.18 0.00 0.00 0.00 175.10 177.17 1aia n LEU 50 N 3.99 5.00 0.13 3.92 4.32 -1.26 -4.87 117.00 128.23 1aia n LEU 50 Ca 0.04 0.84 0.01 0.00 -0.02 0.00 0.00 56.01 56.88 1aia n LEU 50 Cb 0.51 -1.49 0.06 0.00 -1.62 0.00 0.00 43.42 40.88 1aia n LEU 50 CO 0.51 -1.31 0.45 0.71 -1.22 0.00 0.00 177.39 176.52 1aia h THR 51 N 0.62 1.05 -0.99 -5.08 1.35 -1.97 -2.20 112.91 105.69 1aia h THR 51 Ca -0.50 -2.32 0.06 0.00 -0.55 0.00 0.00 66.41 63.10 1aia h THR 51 Cb 1.35 2.40 -0.06 0.00 -1.73 0.00 0.00 68.15 70.11 1aia h THR 51 CO 0.53 0.57 0.64 0.77 -0.25 0.00 0.00 175.52 177.78 1aia h SER 52 N 0.00 1.04 -0.05 5.36 4.64 -1.91 -0.48 113.55 122.17 1aia h SER 52 Ca -0.01 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 1aia h SER 52 Cb 1.36 -0.22 -0.00 0.00 -0.31 0.00 0.00 62.40 63.22 1aia h SER 52 CO 0.08 0.68 -0.01 0.58 -0.87 0.00 0.00 176.83 177.29 1aia h VAL 53 N 1.19 1.28 -0.87 0.95 2.07 -1.90 -0.96 116.25 118.02 1aia h VAL 53 Ca 0.42 -0.87 0.13 0.00 0.82 0.00 0.00 66.70 67.21 1aia h VAL 53 Cb 0.11 1.77 -0.09 0.00 -1.52 0.00 0.00 31.29 31.56 1aia h VAL 53 CO -0.16 0.24 0.48 0.11 0.02 0.00 0.00 177.57 178.25 1aia h LYS 54 N -0.24 0.69 -0.47 1.57 1.79 -1.13 -0.21 116.57 118.57 1aia h LYS 54 Ca 0.01 -0.04 -0.09 0.00 -2.18 0.00 0.00 60.65 58.35 1aia h LYS 54 Cb 0.38 -0.15 -0.02 0.00 -1.58 0.00 0.00 32.23 30.86 1aia h LYS 54 CO 0.00 0.45 -0.05 0.87 -1.08 0.00 0.00 179.45 179.65 1aia h LYS 55 N 0.71 0.86 -0.08 3.15 1.57 -0.99 -2.59 116.57 119.20 1aia h LYS 55 Ca 0.46 -0.30 -0.12 0.00 -1.87 0.00 0.00 60.65 58.82 1aia h LYS 55 Cb 0.59 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.82 1aia h LYS 55 CO -0.33 0.93 -0.50 0.00 -0.57 0.00 0.00 179.45 178.98 1aia h ALA 56 N 0.90 0.99 0.00 3.86 0.00 -0.44 -2.86 119.26 121.71 1aia h ALA 56 Ca 0.13 -0.48 -0.05 0.00 0.00 0.00 0.00 54.91 54.52 1aia h ALA 56 Cb 0.57 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1aia h ALA 56 CO 0.03 0.66 -0.22 0.93 0.00 0.00 0.00 179.25 180.65 1aia h GLU 57 N 0.18 0.00 0.24 0.00 5.08 -0.80 -2.50 114.58 116.79 1aia h GLU 57 Ca 0.01 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 58.03 1aia h GLU 57 Cb 0.95 0.00 0.03 0.00 0.50 0.00 0.00 28.75 30.24 1aia h GLU 57 CO 0.08 0.22 -1.49 0.37 -1.00 0.00 0.00 179.01 177.19 1aia h GLN 58 N 0.00 0.51 -0.84 2.33 4.15 -1.36 -1.55 115.11 118.35 1aia h GLN 58 Ca -0.00 -0.87 0.11 0.00 0.77 0.00 0.00 58.65 58.66 1aia h GLN 58 Cb 0.57 0.32 -0.08 0.00 0.21 0.00 0.00 27.48 28.50 1aia h GLN 58 CO 0.03 1.41 0.48 -0.92 -1.93 0.00 0.00 178.83 177.90 1aia h TYR 59 N 0.14 0.86 -0.44 3.99 3.20 -1.31 -1.50 116.97 121.91 1aia h TYR 59 Ca -0.25 0.03 -0.15 0.00 3.14 0.00 0.00 58.73 61.50 1aia h TYR 59 Cb 2.15 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 40.15 1aia h TYR 59 CO 0.12 0.32 -0.30 -0.07 -1.64 0.00 0.00 178.16 176.59 1aia h LEU 60 N 0.77 1.02 -0.61 2.82 4.07 -1.40 -0.92 115.31 121.06 1aia h LEU 60 Ca 0.42 -0.43 0.07 0.00 0.08 0.00 0.00 57.88 58.02 1aia h LEU 60 Cb 0.44 -0.28 -0.06 0.00 1.08 0.00 0.00 40.66 41.84 1aia h LEU 60 CO -0.28 1.23 0.31 0.25 -1.08 0.00 0.00 178.44 178.87 1aia h LEU 61 N 0.82 0.42 -0.32 1.67 6.46 -0.74 -1.24 115.31 122.38 1aia h LEU 61 Ca 0.09 0.04 -0.12 0.00 -0.12 0.00 0.00 57.88 57.77 1aia h LEU 61 Cb 0.89 -0.03 -0.02 0.00 -0.73 0.00 0.00 40.66 40.77 1aia h LEU 61 CO 0.08 0.27 -0.55 -0.33 -0.62 0.00 0.00 178.44 177.29 1aia h GLU 62 N 0.57 0.00 0.00 1.25 5.08 -1.21 -3.38 114.58 116.89 1aia h GLU 62 Ca 0.28 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.64 1aia h GLU 62 Cb 0.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.48 1aia h GLU 62 CO -0.21 0.55 -1.19 0.09 -1.00 0.00 0.00 179.01 177.26 1aia n ASN 63 N -3.36 1.48 -4.72 1.42 4.13 -0.36 -4.98 115.26 108.88 1aia n ASN 63 Ca 0.01 -0.32 -0.42 0.00 1.68 0.00 0.00 54.58 55.54 1aia n ASN 63 Cb 0.70 1.35 -0.03 0.00 -1.54 0.00 0.00 39.78 40.25 1aia n ASN 63 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 1aia s GLU 64 N -2.60 4.55 0.00 3.52 2.02 -0.49 -4.90 118.70 120.80 1aia s GLU 64 Ca -0.01 1.60 0.10 0.00 0.02 0.00 0.00 54.97 56.68 1aia s GLU 64 Cb 0.09 -3.37 -0.05 0.00 0.10 0.00 0.00 34.13 30.90 1aia s GLU 64 CO 0.52 -0.05 0.52 0.25 0.02 0.00 0.00 175.26 176.53 1aia n THR 66 N 3.40 0.00 -3.63 3.63 -2.24 -1.26 -5.00 114.28 109.17 1aia n THR 66 Ca 0.06 -0.34 -0.14 0.00 -2.27 0.00 0.00 64.05 61.35 1aia n THR 66 Cb 0.48 1.06 -0.06 0.00 -2.10 0.00 0.00 70.33 69.71 1aia n THR 66 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1aia s THR 67 N -1.61 0.04 -0.32 4.28 -1.32 -1.26 -5.00 115.64 110.44 1aia s THR 67 Ca 0.06 -0.32 0.08 0.00 -1.21 0.00 0.00 61.69 60.30 1aia s THR 67 Cb 0.08 -0.89 0.50 0.00 -1.51 0.00 0.00 72.50 70.68 1aia s THR 67 CO 0.32 -0.18 1.49 0.29 -2.21 0.00 0.00 174.62 174.33 1aia n LYS 68 N 0.72 2.07 -2.23 7.08 5.02 -1.26 -5.06 118.16 124.50 1aia n LYS 68 Ca -0.19 -3.30 -0.34 0.00 -2.02 0.00 0.00 58.31 52.45 1aia n LYS 68 Cb 0.59 -1.90 0.00 0.00 -0.02 0.00 0.00 35.03 33.69 1aia n LYS 68 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1aia s ASN 69 N -2.58 5.76 0.12 4.39 3.04 -1.26 -4.88 114.94 119.53 1aia s ASN 69 Ca 0.47 2.08 -0.34 0.00 0.04 0.00 0.00 52.86 55.10 1aia s ASN 69 Cb 0.42 -2.57 -0.17 0.00 -1.54 0.00 0.00 41.25 37.39 1aia s ASN 69 CO 0.00 -1.19 1.04 -1.22 -3.04 0.00 0.00 177.10 172.69 1aia n TYR 70 N -1.44 0.82 -1.43 0.43 4.01 -1.26 -5.00 117.16 113.27 1aia n TYR 70 Ca 0.11 0.83 -0.30 0.00 -0.16 0.00 0.00 57.90 58.38 1aia n TYR 70 Cb 0.52 -2.17 0.10 0.00 -0.31 0.00 0.00 39.34 37.47 1aia n TYR 70 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1aia s LEU 71 N 0.88 2.53 1.03 7.72 1.43 -1.26 -5.05 118.68 125.95 1aia s LEU 71 Ca 0.77 1.39 -0.12 0.00 -1.03 0.00 0.00 54.13 55.14 1aia s LEU 71 Cb -0.99 -3.96 0.21 0.00 0.03 0.00 0.00 46.19 41.49 1aia s LEU 71 CO 0.54 -2.16 1.07 -0.83 0.23 0.00 0.00 176.35 175.20 1aia s GLY 72 N -3.73 1.57 0.35 -3.19 0.00 -1.26 -4.83 107.32 96.22 1aia s GLY 72 Ca 0.61 -0.17 0.06 0.00 0.00 0.00 0.00 44.72 45.22 1aia s GLY 72 CO 0.55 0.44 1.92 -2.22 0.00 0.00 0.00 173.10 173.79 1aia h ILE 73 N -2.08 0.97 -0.09 0.90 1.08 -1.97 -0.67 117.51 115.65 1aia h ILE 73 Ca -0.55 -0.27 0.00 0.00 -0.39 0.00 0.00 64.86 63.64 1aia h ILE 73 Cb 1.32 0.10 0.00 0.00 -3.07 0.00 0.00 36.82 35.17 1aia h ILE 73 CO 0.54 0.15 0.00 -0.90 -0.69 0.00 0.00 178.15 177.24 1aia n ASP 74 N -4.51 1.84 0.00 1.72 5.75 -1.26 -4.28 116.55 115.81 1aia n ASP 74 Ca 0.14 -1.65 0.00 0.00 -0.01 0.00 0.00 54.79 53.26 1aia n ASP 74 Cb 0.30 -0.05 0.00 0.00 -1.03 0.00 0.00 41.12 40.34 1aia n ASP 74 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1aia n GLY 75 N 1.20 -1.61 3.67 6.12 0.00 -0.26 -0.52 105.19 113.80 1aia n GLY 75 Ca 0.18 -1.55 -0.42 0.00 0.00 0.00 0.00 46.02 44.22 1aia n GLY 75 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1aia s ILE 76 N 0.00 3.72 0.16 -0.61 1.01 -1.26 -4.28 121.20 119.94 1aia s ILE 76 Ca 0.00 0.94 -0.25 0.00 0.00 0.00 0.00 60.65 61.35 1aia s ILE 76 Cb 0.00 -3.61 0.04 0.00 0.01 0.00 0.00 42.46 38.90 1aia s ILE 76 CO 0.00 -0.06 1.58 -0.65 0.00 0.00 0.00 174.94 175.81 1aia h PRO 77 N 8.84 -0.27 -0.86 2.79 0.11 -1.97 -2.48 132.00 138.16 1aia h PRO 77 Ca -0.36 0.02 0.08 0.00 0.11 0.00 0.00 66.00 65.84 1aia h PRO 77 Cb 1.16 0.06 -0.06 0.00 0.11 0.00 0.00 31.00 32.28 1aia h PRO 77 CO 0.95 -0.18 0.56 0.93 -0.21 0.00 0.00 178.00 180.04 1aia h GLU 78 N -0.28 0.88 -0.72 1.05 4.39 -1.99 -0.14 114.58 117.77 1aia h GLU 78 Ca 0.16 -0.05 -0.00 0.00 0.34 0.00 0.00 59.36 59.81 1aia h GLU 78 Cb 0.56 -0.20 -0.03 0.00 -0.10 0.00 0.00 28.75 28.98 1aia h GLU 78 CO -0.57 0.58 0.43 0.35 -1.16 0.00 0.00 179.01 178.64 1aia h PHE 79 N 0.91 0.94 -0.48 4.33 3.57 -1.79 -1.69 116.94 122.73 1aia h PHE 79 Ca 0.38 -0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.84 1aia h PHE 79 Cb 0.30 -0.31 -0.02 0.00 2.79 0.00 0.00 35.95 38.71 1aia h PHE 79 CO -0.00 0.64 0.13 0.78 -2.23 0.00 0.00 178.31 177.62 1aia h GLY 80 N 0.98 0.81 1.02 2.40 0.00 -0.81 -2.13 103.07 105.35 1aia h GLY 80 Ca 0.26 -0.50 -0.08 0.00 0.00 0.00 0.00 47.33 47.01 1aia h GLY 80 CO -0.05 0.47 0.01 3.21 0.00 0.00 0.00 176.54 180.17 1aia h ARG 81 N 0.64 0.91 -0.18 4.80 3.08 -0.96 -2.10 114.38 120.58 1aia h ARG 81 Ca 0.15 -0.29 -0.13 0.00 0.07 0.00 0.00 59.98 59.79 1aia h ARG 81 Cb 0.30 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.26 1aia h ARG 81 CO -0.00 0.93 -0.43 0.00 -1.07 0.00 0.00 179.97 179.40 1aia h THR 83 N 0.35 1.20 -0.55 0.00 2.02 -1.26 -0.98 112.91 113.69 1aia h THR 83 Ca 0.03 -0.63 -0.09 0.00 0.77 0.00 0.00 66.41 66.49 1aia h THR 83 Cb 0.90 0.96 -0.02 0.00 -1.74 0.00 0.00 68.15 68.25 1aia h THR 83 CO 0.08 0.22 -0.01 1.56 0.37 0.00 0.00 175.52 177.74 1aia h GLN 84 N 0.41 0.98 -0.37 6.66 4.20 -1.05 -1.01 115.11 124.93 1aia h GLN 84 Ca 0.11 -0.32 -0.09 0.00 0.06 0.00 0.00 58.65 58.42 1aia h GLN 84 Cb 0.22 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 27.90 1aia h GLN 84 CO -0.01 0.99 -0.15 0.93 -0.67 0.00 0.00 178.83 179.92 1aia h GLU 85 N 0.86 0.67 -0.38 1.46 5.08 -1.23 -0.21 114.58 120.83 1aia h GLU 85 Ca 0.16 -0.23 -0.02 0.00 -1.00 0.00 0.00 59.36 58.27 1aia h GLU 85 Cb 0.55 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.73 1aia h GLU 85 CO 0.03 0.79 0.16 -0.07 -1.00 0.00 0.00 179.01 178.92 1aia h LEU 86 N 0.60 0.51 0.30 1.33 3.38 -0.68 -0.66 115.31 120.09 1aia h LEU 86 Ca 0.10 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 1aia h LEU 86 Cb 0.61 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.23 1aia h LEU 86 CO 0.04 0.52 -0.14 -0.07 0.09 0.00 0.00 178.44 178.88 1aia h LEU 87 N 0.46 -0.34 0.00 1.67 4.07 -1.12 -3.37 115.31 116.69 1aia h LEU 87 Ca 0.13 -0.20 0.00 0.00 0.08 0.00 0.00 57.88 57.89 1aia h LEU 87 Cb 0.16 0.09 0.00 0.00 1.08 0.00 0.00 40.66 41.99 1aia h LEU 87 CO -0.01 0.11 -0.75 0.49 -1.08 0.00 0.00 178.44 177.20 1aia n PHE 88 N -5.07 0.02 0.00 1.13 3.72 -0.10 -4.76 117.46 112.40 1aia n PHE 88 Ca -0.09 0.01 0.00 0.00 -0.05 0.00 0.00 57.45 57.32 1aia n PHE 88 Cb 0.26 -0.16 0.00 0.00 -0.94 0.00 0.00 39.48 38.65 1aia n PHE 88 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1aia n GLY 89 N 1.49 0.68 0.35 1.37 0.00 -0.25 -4.47 105.19 104.36 1aia n GLY 89 Ca 0.05 -1.64 0.12 0.00 0.00 0.00 0.00 46.02 44.55 1aia n GLY 89 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1aia h LYS 90 N 0.00 0.00 0.00 1.61 2.10 -1.91 -3.08 116.57 115.29 1aia h LYS 90 Ca 0.00 -0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1aia h LYS 90 Cb 0.00 -0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.33 1aia h LYS 90 CO 0.00 0.00 -0.09 0.41 -2.00 0.00 0.00 179.45 177.78 1aia n GLY 91 N -1.54 4.59 3.63 0.07 0.00 -1.26 -5.00 105.19 105.68 1aia n GLY 91 Ca 0.21 -1.08 -0.44 0.00 0.00 0.00 0.00 46.02 44.71 1aia n GLY 91 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1aia n SER 92 N -1.30 1.86 -0.25 1.61 2.88 -1.16 -4.78 113.62 112.47 1aia n SER 92 Ca 0.15 1.19 0.12 0.00 -1.33 0.00 0.00 58.87 59.00 1aia n SER 92 Cb 0.65 -1.36 0.40 0.00 -0.75 0.00 0.00 64.21 63.15 1aia n SER 92 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1aia h ALA 93 N 2.32 1.88 -0.99 -1.46 0.00 -1.94 -1.69 119.26 117.38 1aia h ALA 93 Ca -0.42 0.01 0.14 0.00 0.00 0.00 0.00 54.91 54.65 1aia h ALA 93 Cb 1.32 -0.11 -0.09 0.00 0.00 0.00 0.00 17.79 18.90 1aia h ALA 93 CO 0.62 -0.11 0.62 -0.07 0.00 0.00 0.00 179.25 180.31 1aia h LEU 94 N 0.65 0.86 0.23 0.00 3.38 -1.94 0.57 115.31 119.05 1aia h LEU 94 Ca 0.43 0.06 -0.33 0.00 0.09 0.00 0.00 57.88 58.14 1aia h LEU 94 Cb 0.74 -0.11 0.03 0.00 0.09 0.00 0.00 40.66 41.42 1aia h LEU 94 CO -0.19 0.41 -1.44 0.40 0.09 0.00 0.00 178.44 177.71 1aia h ILE 95 N 0.89 1.31 0.00 1.22 2.04 -1.68 -1.30 117.51 119.99 1aia h ILE 95 Ca 0.52 -2.73 -0.08 0.00 1.00 0.00 0.00 64.86 63.57 1aia h ILE 95 Cb 0.64 3.01 -0.01 0.00 -0.74 0.00 0.00 36.82 39.72 1aia h ILE 95 CO -0.29 0.82 -0.36 0.78 0.00 0.00 0.00 178.15 179.09 1aia h ASN 96 N 0.15 0.00 0.09 1.72 2.35 -0.59 -2.26 115.58 117.03 1aia h ASN 96 Ca -0.24 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.51 1aia h ASN 96 Cb 2.13 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.50 1aia h ASN 96 CO 0.27 0.36 -0.09 0.47 -1.65 0.00 0.00 177.43 176.79 1aia n ASP 97 N -3.45 1.24 -3.37 5.81 9.92 0.19 -4.94 116.55 121.96 1aia n ASP 97 Ca 0.00 -1.23 -0.24 0.00 -0.53 0.00 0.00 54.79 52.79 1aia n ASP 97 Cb 0.53 0.04 0.05 0.00 -0.64 0.00 0.00 41.12 41.10 1aia n ASP 97 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 1aia n LYS 98 N -0.19 -6.21 0.01 -1.24 4.76 -0.85 -4.31 118.16 110.13 1aia n LYS 98 Ca 0.17 0.83 0.13 0.00 -2.87 0.00 0.00 58.31 56.56 1aia n LYS 98 Cb 0.34 -5.77 0.44 0.00 -1.84 0.00 0.00 35.03 28.20 1aia n LYS 98 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1aia n ARG 99 N -4.50 0.03 -4.91 1.97 1.74 -0.50 -3.97 116.66 106.52 1aia n ARG 99 Ca -0.04 0.02 -0.33 0.00 -0.77 0.00 0.00 57.85 56.73 1aia n ARG 99 Cb 0.58 -1.53 -0.13 0.00 -1.02 0.00 0.00 32.46 30.36 1aia n ARG 99 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1aia s ALA 100 N -3.02 2.64 -0.04 7.54 0.00 -1.25 -1.88 121.76 125.75 1aia s ALA 100 Ca 0.12 -0.99 0.02 0.00 0.00 0.00 0.00 51.96 51.12 1aia s ALA 100 Cb 0.18 -0.94 0.01 0.00 0.00 0.00 0.00 23.12 22.36 1aia s ALA 100 CO 0.61 0.56 -0.10 1.03 0.00 0.00 0.00 175.76 177.86 1aia s ARG 101 N -0.74 1.24 -0.09 0.00 1.81 -0.72 -4.99 118.95 115.46 1aia s ARG 101 Ca 0.11 -0.33 0.03 0.00 -1.72 0.00 0.00 55.73 53.83 1aia s ARG 101 Cb -0.11 -1.10 -0.01 0.00 -0.45 0.00 0.00 34.95 33.28 1aia s ARG 101 CO 0.00 0.07 -0.20 0.99 -0.68 0.00 0.00 175.30 175.48 1aia s THR 102 N 0.44 2.44 -0.16 0.02 2.01 -1.26 -1.38 115.64 117.75 1aia s THR 102 Ca -0.08 -0.90 -0.03 0.00 0.31 0.00 0.00 61.69 60.98 1aia s THR 102 Cb -0.12 -1.95 -0.02 0.00 0.01 0.00 0.00 72.50 70.41 1aia s THR 102 CO 0.02 0.56 -0.04 0.00 -0.69 0.00 0.00 174.62 174.46 1aia s ALA 103 N 0.10 2.96 0.39 7.40 0.00 -0.58 -4.87 121.76 127.16 1aia s ALA 103 Ca -0.10 -0.86 -0.26 0.00 0.00 0.00 0.00 51.96 50.74 1aia s ALA 103 Cb -0.16 -1.55 -0.09 0.00 0.00 0.00 0.00 23.12 21.32 1aia s ALA 103 CO 0.06 0.15 1.23 -1.14 0.00 0.00 0.00 175.76 176.06 1aia s GLN 104 N 0.48 4.06 0.05 0.00 0.74 0.33 -1.24 119.66 124.08 1aia s GLN 104 Ca -0.04 2.00 -0.02 0.00 0.05 0.00 0.00 55.36 57.35 1aia s GLN 104 Cb -0.14 -2.76 -0.03 0.00 1.10 0.00 0.00 33.01 31.17 1aia s GLN 104 CO 0.03 -0.36 0.01 0.99 -0.55 0.00 0.00 175.29 175.40 1aia s THR 105 N -1.32 0.20 -1.15 -0.34 2.01 -0.61 -4.65 115.64 109.78 1aia s THR 105 Ca 0.56 -1.62 -0.23 0.00 0.31 0.00 0.00 61.69 60.71 1aia s THR 105 Cb -0.35 -1.36 -0.11 0.00 0.01 0.00 0.00 72.50 70.70 1aia s THR 105 CO 0.44 -0.89 1.94 -0.81 -0.69 0.00 0.00 174.62 174.61 1aia n PRO 106 N 0.25 1.48 0.00 4.92 -0.05 -1.26 -2.72 135.00 137.61 1aia n PRO 106 Ca -0.15 -2.37 0.00 0.00 -0.05 0.00 0.00 63.50 60.92 1aia n PRO 106 Cb 0.61 -3.70 0.00 0.00 -0.05 0.00 0.00 33.50 30.36 1aia n PRO 106 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 175.50 175.86 1aia n GLY 107 N 5.73 -1.28 0.28 0.55 0.00 -1.15 -2.55 105.19 106.77 1aia n GLY 107 Ca 0.45 -1.60 -0.01 0.00 0.00 0.00 0.00 46.02 44.86 1aia n GLY 107 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1aia h GLY 108 N 0.00 0.64 1.14 -0.02 0.00 -1.76 -2.78 103.07 100.29 1aia h GLY 108 Ca 0.00 -0.38 -0.05 0.00 0.00 0.00 0.00 47.33 46.90 1aia h GLY 108 CO 0.00 0.36 0.26 -0.84 0.00 0.00 0.00 176.54 176.32 1aia h THR 109 N 0.57 1.25 -0.12 4.70 2.02 -1.91 -2.38 112.91 117.04 1aia h THR 109 Ca 0.12 -0.82 -0.08 0.00 0.77 0.00 0.00 66.41 66.40 1aia h THR 109 Cb 0.35 0.41 -0.01 0.00 -1.74 0.00 0.00 68.15 67.16 1aia h THR 109 CO 0.01 0.33 -0.28 1.23 0.37 0.00 0.00 175.52 177.17 1aia h GLY 110 N 1.10 0.25 1.11 2.16 0.00 -1.36 -1.99 103.07 104.34 1aia h GLY 110 Ca 0.24 -0.19 -0.14 0.00 0.00 0.00 0.00 47.33 47.24 1aia h GLY 110 CO -0.02 0.18 -0.23 0.00 0.00 0.00 0.00 176.54 176.47 1aia h ALA 111 N 1.51 0.67 -0.27 3.60 0.00 -1.20 -1.21 119.26 122.35 1aia h ALA 111 Ca 0.03 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.53 1aia h ALA 111 Cb 0.61 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1aia h ALA 111 CO 0.04 0.68 0.11 -0.07 0.00 0.00 0.00 179.25 180.01 1aia h LEU 112 N 0.86 0.37 -0.27 0.00 4.07 -1.23 -1.25 115.31 117.86 1aia h LEU 112 Ca 0.11 -0.16 -0.08 0.00 0.08 0.00 0.00 57.88 57.82 1aia h LEU 112 Cb 0.82 -0.10 -0.01 0.00 1.08 0.00 0.00 40.66 42.46 1aia h LEU 112 CO 0.07 0.43 -0.16 -0.09 -1.08 0.00 0.00 178.44 177.61 1aia h ARG 113 N 0.29 0.59 -0.00 1.13 9.65 -1.36 -0.53 114.38 124.15 1aia h ARG 113 Ca 0.09 -0.27 -0.08 0.00 -1.10 0.00 0.00 59.98 58.62 1aia h ARG 113 Cb 0.17 -0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 28.73 1aia h ARG 113 CO -0.01 0.84 -0.40 -0.39 2.80 0.00 0.00 179.97 182.82 1aia h VAL 114 N 0.33 1.29 -0.60 0.20 -1.51 -1.17 -0.84 116.25 113.94 1aia h VAL 114 Ca 0.06 -1.38 -0.09 0.00 -1.23 0.00 0.00 66.70 64.06 1aia h VAL 114 Cb 0.68 1.74 -0.02 0.00 -2.13 0.00 0.00 31.29 31.56 1aia h VAL 114 CO 0.04 0.39 0.01 0.00 -1.23 0.00 0.00 177.57 176.79 1aia h ALA 115 N 1.60 0.80 -0.58 5.19 0.00 -1.07 -1.45 119.26 123.76 1aia h ALA 115 Ca -0.00 -0.31 -0.04 0.00 0.00 0.00 0.00 54.91 54.56 1aia h ALA 115 Cb 0.71 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 1aia h ALA 115 CO 0.05 0.64 0.22 0.00 0.00 0.00 0.00 179.25 180.16 1aia h ALA 116 N 0.98 0.75 -0.06 0.00 0.00 -0.60 -0.63 119.26 119.70 1aia h ALA 116 Ca 0.17 -0.17 -0.17 0.00 0.00 0.00 0.00 54.91 54.74 1aia h ALA 116 Cb 0.55 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 1aia h ALA 116 CO 0.03 0.37 -0.69 -0.44 0.00 0.00 0.00 179.25 178.52 1aia h ASP 117 N 0.80 0.34 -0.21 0.00 3.32 -1.05 -0.22 116.42 119.38 1aia h ASP 117 Ca 0.19 -0.22 -0.01 0.00 0.02 0.00 0.00 57.03 57.02 1aia h ASP 117 Cb 0.22 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.66 1aia h ASP 117 CO -0.01 0.93 0.10 0.15 -1.72 0.00 0.00 179.24 178.68 1aia h PHE 118 N 0.20 0.31 0.19 4.55 3.57 -1.15 -2.12 116.94 122.48 1aia h PHE 118 Ca -0.02 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.45 1aia h PHE 118 Cb 1.24 -0.10 0.00 0.00 2.79 0.00 0.00 35.95 39.89 1aia h PHE 118 CO 0.03 0.32 -0.09 -0.07 -2.23 0.00 0.00 178.31 176.28 1aia h LEU 119 N 0.21 -0.21 -1.69 0.59 4.07 -1.04 -1.31 115.31 115.93 1aia h LEU 119 Ca 0.07 -0.19 0.02 0.00 0.08 0.00 0.00 57.88 57.86 1aia h LEU 119 Cb 0.13 0.05 -0.02 0.00 1.08 0.00 0.00 40.66 41.91 1aia h LEU 119 CO -0.01 0.08 0.24 0.00 -1.08 0.00 0.00 178.44 177.68 1aia h ALA 120 N 0.24 1.83 0.00 1.53 0.00 -1.04 -3.00 119.26 118.82 1aia h ALA 120 Ca -0.03 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.74 1aia h ALA 120 Cb 0.39 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1aia h ALA 120 CO 0.04 0.13 -1.42 1.63 0.00 0.00 0.00 179.25 179.63 1aia n LYS 121 N -4.48 0.62 0.00 0.00 5.02 -0.80 -4.52 118.16 114.00 1aia n LYS 121 Ca 0.03 0.15 0.00 0.00 -2.02 0.00 0.00 58.31 56.47 1aia n LYS 121 Cb 0.13 -1.77 0.00 0.00 -0.02 0.00 0.00 35.03 33.37 1aia n LYS 121 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1aia n ASN 122 N -2.77 1.69 -3.92 4.39 3.02 -0.50 -5.06 115.26 112.11 1aia n ASN 122 Ca -0.08 -1.81 -0.09 0.00 -0.03 0.00 0.00 54.58 52.57 1aia n ASN 122 Cb 0.76 0.00 -0.07 0.00 -0.61 0.00 0.00 39.78 39.86 1aia n ASN 122 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1aia s THR 123 N -0.81 0.11 -2.06 3.41 2.01 -1.14 -5.02 115.64 112.14 1aia s THR 123 Ca 0.00 -1.33 0.18 0.00 0.31 0.00 0.00 61.69 60.86 1aia s THR 123 Cb 0.00 -1.59 0.49 0.00 0.01 0.00 0.00 72.50 71.41 1aia s THR 123 CO 0.00 -0.51 1.64 -1.54 -0.69 0.00 0.00 174.62 173.52 1aia n SER 124 N -0.12 0.38 -4.72 3.53 3.41 -1.26 -4.81 113.62 110.03 1aia n SER 124 Ca -0.11 -1.51 -0.42 0.00 -0.26 0.00 0.00 58.87 56.56 1aia n SER 124 Cb 0.63 -0.02 -0.03 0.00 -0.26 0.00 0.00 64.21 64.52 1aia n SER 124 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1aia s VAL 125 N -1.95 2.38 0.00 -3.33 1.01 -1.26 -4.88 120.40 112.37 1aia s VAL 125 Ca 0.27 0.25 0.00 0.00 0.00 0.00 0.00 61.98 62.50 1aia s VAL 125 Cb 0.13 -3.16 0.00 0.00 0.00 0.00 0.00 36.38 33.35 1aia s VAL 125 CO 0.21 0.02 0.00 1.17 0.00 0.00 0.00 175.10 176.50 1aia n LYS 126 N 4.12 2.88 -4.10 2.72 4.81 -1.26 -4.75 118.16 122.58 1aia n LYS 126 Ca 0.15 0.00 -0.14 0.00 -0.87 0.00 0.00 58.31 57.45 1aia n LYS 126 Cb 0.37 -0.73 -0.12 0.00 0.02 0.00 0.00 35.03 34.57 1aia n LYS 126 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 1aia s ARG 129 N -1.39 0.58 -0.02 1.64 3.00 -1.26 -1.44 118.95 120.07 1aia s ARG 129 Ca 0.00 -0.75 0.02 0.00 0.00 0.00 0.00 55.73 55.00 1aia s ARG 129 Cb 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 34.95 34.54 1aia s ARG 129 CO 0.00 0.08 -0.07 0.54 0.00 0.00 0.00 175.30 175.85 1aia s VAL 133 N -1.25 0.65 -0.25 3.52 0.11 0.92 -2.49 120.40 121.61 1aia s VAL 133 Ca -0.07 -0.30 -0.15 0.00 -2.93 0.00 0.00 61.98 58.53 1aia s VAL 133 Cb -0.09 -0.59 -0.04 0.00 -1.53 0.00 0.00 36.38 34.13 1aia s VAL 133 CO 0.01 0.21 0.37 0.26 -3.33 0.00 0.00 175.10 172.62 1aia s TRP 134 N 0.19 3.29 0.28 1.54 0.52 0.04 -1.03 118.94 123.77 1aia s TRP 134 Ca -0.03 0.47 0.11 0.00 0.02 0.00 0.00 56.10 56.67 1aia s TRP 134 Cb -0.07 -2.55 -0.05 0.00 -1.15 0.00 0.00 33.47 29.65 1aia s TRP 134 CO 0.00 -0.15 -0.11 0.14 0.02 0.00 0.00 176.95 176.85 1aia s VAL 135 N 1.80 2.84 0.83 4.03 -7.23 0.15 -0.65 120.40 122.18 1aia s VAL 135 Ca 0.16 -2.19 -0.12 0.00 -1.81 0.00 0.00 61.98 58.02 1aia s VAL 135 Cb -0.15 -2.55 0.09 0.00 0.56 0.00 0.00 36.38 34.33 1aia s VAL 135 CO 0.09 -0.37 1.11 -0.94 -0.31 0.00 0.00 175.10 174.68 1aia s SER 136 N -3.59 4.20 -0.19 4.85 1.04 -1.26 -1.97 113.70 116.79 1aia s SER 136 Ca 0.31 1.16 0.01 0.00 0.48 0.00 0.00 55.95 57.91 1aia s SER 136 Cb -0.05 -1.84 0.04 0.00 0.10 0.00 0.00 66.02 64.27 1aia s SER 136 CO 0.17 -2.13 -0.11 0.21 0.98 0.00 0.00 173.24 172.36 1aia s ASN 137 N -3.99 3.31 0.85 7.02 3.84 0.30 -3.29 114.94 122.97 1aia s ASN 137 Ca 0.62 -0.84 -0.13 0.00 0.21 0.00 0.00 52.86 52.72 1aia s ASN 137 Cb -0.14 -1.23 0.11 0.00 -0.55 0.00 0.00 41.25 39.43 1aia s ASN 137 CO 0.54 -0.13 1.21 -2.16 -2.79 0.00 0.00 177.10 173.77 1aia s PRO 138 N 1.40 1.64 0.25 0.43 0.04 -1.26 -3.01 135.00 134.49 1aia s PRO 138 Ca -0.00 -0.03 -0.06 0.00 0.04 0.00 0.00 61.00 60.95 1aia s PRO 138 Cb -0.16 -1.93 -0.02 0.00 0.04 0.00 0.00 34.50 32.44 1aia s PRO 138 CO -0.09 -1.80 0.35 0.45 0.04 0.00 0.00 177.00 175.96 1aia s SER 139 N -4.66 0.24 -0.03 6.66 0.15 -1.21 -4.64 113.70 110.22 1aia s SER 139 Ca 0.65 -1.22 -0.35 0.00 0.70 0.00 0.00 55.95 55.73 1aia s SER 139 Cb -0.09 0.53 -0.13 0.00 -1.71 0.00 0.00 66.02 64.61 1aia s SER 139 CO 0.50 -1.06 1.72 1.87 1.20 0.00 0.00 173.24 177.47 1aia n TRP 140 N -0.39 2.19 0.03 3.44 -0.00 -1.08 -4.58 117.44 117.05 1aia n TRP 140 Ca 0.00 0.22 0.20 0.00 -0.00 0.00 0.00 57.50 57.92 1aia n TRP 140 Cb 0.63 -2.57 0.71 0.00 -0.00 0.00 0.00 31.31 30.08 1aia n TRP 140 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 177.69 176.34 1aia h PRO 141 N 7.52 0.00 0.00 5.87 0.11 -2.00 -1.45 132.00 142.05 1aia h PRO 141 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1aia h PRO 141 Cb 1.28 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 1aia h PRO 141 CO 0.92 0.00 0.00 -1.71 -0.21 0.00 0.00 178.00 177.00 1aia n ASN 142 N -4.26 0.00 -0.16 -2.05 5.15 -1.26 -3.40 115.26 109.28 1aia n ASN 142 Ca 0.09 -0.22 -0.09 0.00 -0.60 0.00 0.00 54.58 53.76 1aia n ASN 142 Cb 0.58 -0.25 0.00 0.00 -0.53 0.00 0.00 39.78 39.58 1aia n ASN 142 CO 0.00 0.00 0.00 0.45 1.40 0.00 0.00 177.26 179.11 1aia h HIS 143 N 0.00 0.72 -0.35 1.20 3.86 -1.63 -2.46 115.15 116.49 1aia h HIS 143 Ca 0.00 -0.07 0.03 0.00 -1.16 0.00 0.00 60.37 59.17 1aia h HIS 143 Cb 0.23 -0.21 -0.03 0.00 1.06 0.00 0.00 27.41 28.46 1aia h HIS 143 CO 0.00 0.63 0.16 -0.22 0.86 0.00 0.00 177.93 179.37 1aia h LYS 144 N 0.60 0.33 -0.62 2.45 3.64 -1.78 -2.89 116.57 118.29 1aia h LYS 144 Ca 0.15 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.46 1aia h LYS 144 Cb 0.24 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 31.96 1aia h LYS 144 CO -0.01 0.22 0.19 0.77 -2.27 0.00 0.00 179.45 178.35 1aia h SER 145 N 0.34 0.90 0.61 4.20 0.02 -1.69 0.12 113.55 118.06 1aia h SER 145 Ca 0.15 -0.21 -0.15 0.00 -0.84 0.00 0.00 61.79 60.74 1aia h SER 145 Cb 0.07 -0.24 -0.02 0.00 0.14 0.00 0.00 62.40 62.36 1aia h SER 145 CO -0.11 0.87 -0.69 -0.37 -1.14 0.00 0.00 176.83 175.39 1aia h VAL 146 N 0.89 1.47 -0.06 2.27 -1.51 -1.36 -0.52 116.25 117.42 1aia h VAL 146 Ca 0.20 -2.31 -0.24 0.00 -1.23 0.00 0.00 66.70 63.12 1aia h VAL 146 Cb 0.29 2.24 0.01 0.00 -2.13 0.00 0.00 31.29 31.70 1aia h VAL 146 CO -0.01 0.66 -0.92 -0.26 -1.23 0.00 0.00 177.57 175.82 1aia h PHE 147 N 0.05 0.96 -0.65 5.19 0.04 -1.29 -3.09 116.94 118.14 1aia h PHE 147 Ca -0.01 -0.48 -0.06 0.00 2.80 0.00 0.00 57.97 60.22 1aia h PHE 147 Cb 1.23 -0.13 -0.03 0.00 2.20 0.00 0.00 35.95 39.22 1aia h PHE 147 CO 0.01 1.31 0.18 -0.91 -0.60 0.00 0.00 178.31 178.30 1aia h ASN 148 N 0.41 0.97 0.36 2.17 -0.26 -0.70 -1.71 115.58 116.84 1aia h ASN 148 Ca -0.09 -0.22 0.00 0.00 -0.56 0.00 0.00 56.30 55.43 1aia h ASN 148 Cb 1.55 -0.26 0.00 0.00 -1.06 0.00 0.00 38.32 38.56 1aia h ASN 148 CO 0.18 0.94 0.00 0.77 -1.06 0.00 0.00 177.43 178.26 1aia h SER 149 N 0.96 0.00 0.29 5.81 4.64 -1.04 0.10 113.55 124.31 1aia h SER 149 Ca 0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 1aia h SER 149 Cb 0.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 1aia h SER 149 CO -0.00 0.00 -0.37 0.00 -0.87 0.00 0.00 176.83 175.58 1aia n ALA 150 N -1.96 3.32 -0.79 5.18 0.00 -0.83 -4.94 120.51 120.49 1aia n ALA 150 Ca -0.01 -0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.02 1aia n ALA 150 Cb 0.14 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 18.50 1aia n ALA 150 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1aia n GLY 151 N 1.40 1.26 3.54 0.00 0.00 0.36 -4.82 105.19 106.93 1aia n GLY 151 Ca 0.10 -0.38 -0.33 0.00 0.00 0.00 0.00 46.02 45.41 1aia n GLY 151 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1aia s LEU 152 N 0.00 2.97 0.11 0.99 1.02 -0.70 -5.02 118.68 118.05 1aia s LEU 152 Ca 0.00 -0.16 -0.26 0.00 0.02 0.00 0.00 54.13 53.73 1aia s LEU 152 Cb 0.00 -1.67 -0.07 0.00 0.02 0.00 0.00 46.19 44.48 1aia s LEU 152 CO 0.00 0.32 0.82 -0.70 0.02 0.00 0.00 176.35 176.81 1aia s GLU 154 N -1.04 4.58 -0.10 1.70 2.12 -0.52 -3.76 118.70 121.68 1aia s GLU 154 Ca 0.14 1.20 0.02 0.00 0.36 0.00 0.00 54.97 56.69 1aia s GLU 154 Cb -0.11 -3.33 -0.01 0.00 0.26 0.00 0.00 34.13 30.94 1aia s GLU 154 CO 0.03 0.38 -0.18 0.14 -0.54 0.00 0.00 175.26 175.09 1aia s VAL 155 N -0.46 2.67 0.20 3.70 -7.23 -1.26 -0.05 120.40 117.96 1aia s VAL 155 Ca 0.39 -0.82 0.09 0.00 -1.81 0.00 0.00 61.98 59.84 1aia s VAL 155 Cb -0.22 -2.07 -0.04 0.00 0.56 0.00 0.00 36.38 34.61 1aia s VAL 155 CO 0.26 0.55 -0.06 -0.13 -0.31 0.00 0.00 175.10 175.40 1aia s ARG 156 N 0.14 2.16 -0.12 4.82 1.81 -0.20 -4.96 118.95 122.60 1aia s ARG 156 Ca -0.09 -1.27 0.00 0.00 -1.72 0.00 0.00 55.73 52.65 1aia s ARG 156 Cb -0.15 -2.19 -0.02 0.00 -0.45 0.00 0.00 34.95 32.14 1aia s ARG 156 CO 0.06 0.42 -0.12 -1.21 -0.68 0.00 0.00 175.30 173.77 1aia s GLU 157 N -3.01 3.26 0.13 3.54 2.02 -1.26 -0.67 118.70 122.71 1aia s GLU 157 Ca 0.27 -0.67 0.03 0.00 0.02 0.00 0.00 54.97 54.61 1aia s GLU 157 Cb -0.08 -2.62 -0.04 0.00 0.10 0.00 0.00 34.13 31.49 1aia s GLU 157 CO 0.17 0.29 0.21 1.52 0.02 0.00 0.00 175.26 177.46 1aia s TYR 158 N 0.16 3.37 0.54 1.61 -0.85 -0.83 -4.94 117.35 116.40 1aia s TYR 158 Ca -0.07 0.10 -0.18 0.00 -0.52 0.00 0.00 57.07 56.41 1aia s TYR 158 Cb -0.15 -1.64 -0.06 0.00 0.38 0.00 0.00 41.96 40.49 1aia s TYR 158 CO 0.05 0.53 1.04 0.00 -1.52 0.00 0.00 175.55 175.65 1aia s ALA 159 N -1.66 2.82 0.08 9.51 0.00 -1.26 -0.54 121.76 130.71 1aia s ALA 159 Ca 0.33 0.48 0.00 0.00 0.00 0.00 0.00 51.96 52.77 1aia s ALA 159 Cb -0.11 -3.23 0.00 0.00 0.00 0.00 0.00 23.12 19.77 1aia s ALA 159 CO 0.26 -0.54 0.00 0.98 0.00 0.00 0.00 175.76 176.47 1aia n TYR 160 N -1.50 -1.62 -3.73 0.00 9.36 -1.16 -3.97 117.16 114.54 1aia n TYR 160 Ca 0.09 0.21 -0.32 0.00 3.32 0.00 0.00 57.90 61.20 1aia n TYR 160 Cb 0.53 0.85 -0.05 0.00 -0.63 0.00 0.00 39.34 40.04 1aia n TYR 160 CO 0.00 0.00 0.00 -0.47 0.22 0.00 0.00 176.86 176.61 1aia s TYR 161 N -2.00 3.49 -0.45 2.98 5.04 -1.21 -0.48 117.35 124.72 1aia s TYR 161 Ca 0.00 0.49 -0.07 0.00 -2.44 0.00 0.00 57.07 55.05 1aia s TYR 161 Cb 0.00 -1.95 0.12 0.00 0.35 0.00 0.00 41.96 40.47 1aia s TYR 161 CO 0.00 0.48 0.30 0.34 -1.34 0.00 0.00 175.55 175.32 1aia s ASP 162 N -2.41 5.56 0.53 4.32 -1.08 0.79 -4.66 116.67 119.71 1aia s ASP 162 Ca 0.39 -1.94 0.23 0.00 -0.52 0.00 0.00 52.55 50.71 1aia s ASP 162 Cb -0.12 -1.95 1.45 0.00 -1.46 0.00 0.00 42.92 40.84 1aia s ASP 162 CO 0.25 -0.64 2.14 0.00 0.52 0.00 0.00 175.17 177.44 1aia h ALA 163 N 8.32 1.61 0.00 3.66 0.00 -1.97 0.55 119.26 131.43 1aia h ALA 163 Ca -0.19 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 1aia h ALA 163 Cb 1.07 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.84 1aia h ALA 163 CO 0.81 0.08 -0.09 0.93 0.00 0.00 0.00 179.25 180.98 1aia h GLU 164 N 0.00 0.00 -0.00 0.00 5.08 -1.97 -3.39 114.58 114.29 1aia h GLU 164 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1aia h GLU 164 Cb 0.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.39 1aia h GLU 164 CO 0.01 0.01 -0.27 0.09 -1.00 0.00 0.00 179.01 177.85 1aia n ASN 165 N -4.75 0.35 -3.54 1.42 3.02 -1.17 -4.97 115.26 105.63 1aia n ASN 165 Ca -0.01 -0.08 -0.22 0.00 -0.03 0.00 0.00 54.58 54.24 1aia n ASN 165 Cb 0.05 -0.05 0.05 0.00 -0.61 0.00 0.00 39.78 39.22 1aia n ASN 165 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1aia n HIS 166 N -1.39 -2.10 -4.22 3.10 8.25 0.19 -5.02 115.22 114.04 1aia n HIS 166 Ca 0.08 0.74 -0.17 0.00 -0.26 0.00 0.00 57.72 58.10 1aia n HIS 166 Cb 0.33 -4.09 -0.07 0.00 1.12 0.00 0.00 29.99 27.27 1aia n HIS 166 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1aia s THR 167 N -3.50 0.00 -0.42 1.59 2.01 -1.19 -4.93 115.64 109.19 1aia s THR 167 Ca 0.28 -1.90 -0.27 0.00 0.31 0.00 0.00 61.69 60.11 1aia s THR 167 Cb -0.07 -2.53 0.02 0.00 0.01 0.00 0.00 72.50 69.94 1aia s THR 167 CO 0.80 0.00 1.01 -0.22 -0.69 0.00 0.00 174.62 175.52 1aia s LEU 168 N -3.30 3.87 -1.07 4.42 0.20 -1.26 -0.15 118.68 121.39 1aia s LEU 168 Ca 0.38 0.47 -0.21 0.00 0.69 0.00 0.00 54.13 55.46 1aia s LEU 168 Cb 0.02 -3.37 0.07 0.00 -0.43 0.00 0.00 46.19 42.48 1aia s LEU 168 CO 0.23 -1.04 1.47 -0.62 -0.29 0.00 0.00 176.35 176.10 1aia s ASP 169 N 2.15 6.61 0.21 3.68 -1.08 0.36 -4.82 116.67 123.77 1aia s ASP 169 Ca 0.42 -1.79 -0.05 0.00 -0.52 0.00 0.00 52.55 50.61 1aia s ASP 169 Cb -0.10 -2.54 0.17 0.00 -1.46 0.00 0.00 42.92 38.99 1aia s ASP 169 CO 0.25 -1.36 1.64 0.15 0.52 0.00 0.00 175.17 176.37 1aia h PHE 170 N 9.12 0.96 -0.16 -5.34 3.57 -1.93 -0.97 116.94 122.19 1aia h PHE 170 Ca 0.25 -0.20 -0.05 0.00 3.53 0.00 0.00 57.97 61.50 1aia h PHE 170 Cb 0.98 -0.24 -0.00 0.00 2.79 0.00 0.00 35.95 39.48 1aia h PHE 170 CO 1.29 0.94 -0.11 -0.44 -2.23 0.00 0.00 178.31 177.76 1aia h ASP 171 N 0.77 0.37 0.39 0.41 3.32 -1.99 -0.95 116.42 118.74 1aia h ASP 171 Ca 0.12 -0.45 -0.03 0.00 0.02 0.00 0.00 57.03 56.69 1aia h ASP 171 Cb 0.66 -0.10 -0.00 0.00 0.22 0.00 0.00 39.33 40.11 1aia h ASP 171 CO 0.05 0.74 -0.14 0.00 -1.72 0.00 0.00 179.24 178.17 1aia h ALA 172 N 0.64 1.30 0.02 3.45 0.00 -1.93 -1.56 119.26 121.17 1aia h ALA 172 Ca 0.03 -0.12 -0.14 0.00 0.00 0.00 0.00 54.91 54.68 1aia h ALA 172 Cb 0.62 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.40 1aia h ALA 172 CO 0.03 0.17 -0.56 1.25 0.00 0.00 0.00 179.25 180.14 1aia h LEU 173 N 0.00 0.46 -0.52 0.00 5.85 -0.60 -2.04 115.31 118.46 1aia h LEU 173 Ca -0.00 -0.79 0.06 0.00 0.84 0.00 0.00 57.88 57.99 1aia h LEU 173 Cb 0.37 -0.14 -0.05 0.00 0.37 0.00 0.00 40.66 41.20 1aia h LEU 173 CO 0.02 1.20 0.23 0.40 -0.34 0.00 0.00 178.44 179.95 1aia h ILE 174 N -0.22 0.90 -0.47 4.05 1.08 -1.16 -1.37 117.51 120.32 1aia h ILE 174 Ca -0.07 -0.15 -0.03 0.00 -0.39 0.00 0.00 64.86 64.21 1aia h ILE 174 Cb 1.30 0.41 -0.02 0.00 -3.07 0.00 0.00 36.82 35.44 1aia h ILE 174 CO 0.11 0.08 0.16 0.78 -0.69 0.00 0.00 178.15 178.59 1aia h ASN 175 N 0.45 0.66 0.32 1.72 2.35 -1.32 -2.04 115.58 117.74 1aia h ASN 175 Ca 0.24 -0.19 -0.09 0.00 -0.55 0.00 0.00 56.30 55.71 1aia h ASN 175 Cb 0.20 -0.17 -0.01 0.00 0.05 0.00 0.00 38.32 38.38 1aia h ASN 175 CO -0.20 0.68 -0.39 0.77 -1.65 0.00 0.00 177.43 176.64 1aia h SER 176 N 0.61 0.10 0.41 5.81 4.64 -1.14 -2.53 113.55 121.46 1aia h SER 176 Ca 0.15 -0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 1aia h SER 176 Cb 0.24 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 62.30 1aia h SER 176 CO -0.01 0.48 0.00 0.18 -0.87 0.00 0.00 176.83 176.62 1aia n LEU 177 N -4.06 0.00 0.21 5.97 4.77 -0.54 -2.18 117.00 121.17 1aia n LEU 177 Ca -0.02 0.23 0.09 0.00 -0.03 0.00 0.00 56.01 56.28 1aia n LEU 177 Cb 0.44 -0.23 0.37 0.00 -2.33 0.00 0.00 43.42 41.67 1aia n LEU 177 CO 0.40 -0.02 0.75 0.78 -1.33 0.00 0.00 177.39 177.96 1aia h ASN 178 N 0.00 0.00 0.56 -1.43 -0.26 -0.92 -2.90 115.58 110.62 1aia h ASN 178 Ca 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 1aia h ASN 178 Cb 0.21 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.47 1aia h ASN 178 CO 0.00 0.25 0.00 -0.62 -1.06 0.00 0.00 177.43 176.00 1aia n GLU 179 N -3.33 0.13 -2.65 0.81 -0.58 -0.93 -4.72 120.64 109.36 1aia n GLU 179 Ca 0.01 0.40 -0.42 0.00 -0.42 0.00 0.00 57.16 56.73 1aia n GLU 179 Cb 0.49 -1.76 -0.03 0.00 -0.57 0.00 0.00 31.44 29.57 1aia n GLU 179 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1aia s ALA 180 N -3.24 3.26 0.85 0.62 0.00 -1.10 -5.05 121.76 117.10 1aia s ALA 180 Ca 0.04 0.55 -0.13 0.00 0.00 0.00 0.00 51.96 52.43 1aia s ALA 180 Cb 0.09 -3.38 0.11 0.00 0.00 0.00 0.00 23.12 19.94 1aia s ALA 180 CO 0.32 -0.36 1.21 -0.65 0.00 0.00 0.00 175.76 176.28 1aia s GLN 181 N 1.28 1.60 0.10 0.00 -0.21 -1.26 -5.02 119.66 116.14 1aia s GLN 181 Ca 0.52 -0.07 -0.30 0.00 0.02 0.00 0.00 55.36 55.53 1aia s GLN 181 Cb -0.22 -1.94 -0.05 0.00 1.00 0.00 0.00 33.01 31.80 1aia s GLN 181 CO 0.26 -1.81 0.98 0.00 -2.12 0.00 0.00 175.29 172.60 1aia s ALA 182 N -3.64 3.24 0.00 6.09 0.00 -1.25 -3.01 121.76 123.19 1aia s ALA 182 Ca 0.65 0.60 0.00 0.00 0.00 0.00 0.00 51.96 53.21 1aia s ALA 182 Cb -0.09 -3.30 0.00 0.00 0.00 0.00 0.00 23.12 19.73 1aia s ALA 182 CO 0.50 -0.09 0.00 0.41 0.00 0.00 0.00 175.76 176.58 1aia n GLY 183 N 2.37 0.73 3.84 0.00 0.00 -0.65 -5.02 105.19 106.47 1aia n GLY 183 Ca 0.03 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.70 1aia n GLY 183 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1aia s ASP 184 N -2.57 6.82 -0.15 1.61 1.01 -1.17 -4.30 116.67 117.93 1aia s ASP 184 Ca 0.00 1.07 -0.11 0.00 0.71 0.00 0.00 52.55 54.22 1aia s ASP 184 Cb 0.00 -2.29 -0.05 0.00 1.01 0.00 0.00 42.92 41.60 1aia s ASP 184 CO 0.00 0.11 0.20 0.68 0.21 0.00 0.00 175.17 176.37 1aia s VAL 185 N -1.46 5.38 -0.19 -1.27 -7.23 -1.04 -0.47 120.40 114.12 1aia s VAL 185 Ca 0.38 0.35 -0.07 0.00 -1.81 0.00 0.00 61.98 60.83 1aia s VAL 185 Cb -0.15 -3.51 -0.04 0.00 0.56 0.00 0.00 36.38 33.24 1aia s VAL 185 CO 0.19 0.50 0.05 -0.69 -0.31 0.00 0.00 175.10 174.84 1aia s VAL 186 N -0.19 4.56 -0.21 1.32 1.01 -0.33 -0.78 120.40 125.78 1aia s VAL 186 Ca 0.14 -0.11 -0.14 0.00 0.00 0.00 0.00 61.98 61.86 1aia s VAL 186 Cb -0.12 -3.06 -0.04 0.00 0.00 0.00 0.00 36.38 33.15 1aia s VAL 186 CO 0.03 0.44 0.33 -0.22 0.00 0.00 0.00 175.10 175.68 1aia s LEU 187 N 0.63 4.14 -0.16 3.92 0.20 0.18 -1.03 118.68 126.56 1aia s LEU 187 Ca 0.02 0.40 -0.02 0.00 0.69 0.00 0.00 54.13 55.23 1aia s LEU 187 Cb -0.13 -2.40 -0.02 0.00 -0.43 0.00 0.00 46.19 43.21 1aia s LEU 187 CO 0.02 -0.04 -0.08 -0.36 -0.29 0.00 0.00 176.35 175.60 1aia s PHE 188 N 1.25 2.92 -0.13 5.38 0.08 -0.04 -4.48 117.98 122.96 1aia s PHE 188 Ca 0.16 -0.59 -0.29 0.00 0.12 0.00 0.00 56.93 56.32 1aia s PHE 188 Cb -0.14 -1.94 -0.02 0.00 -0.57 0.00 0.00 43.02 40.34 1aia s PHE 188 CO 0.07 -0.22 1.32 -1.01 -0.10 0.00 0.00 175.22 175.27 1aia s HIS 189 N 0.60 2.77 0.28 0.36 3.76 -1.26 -0.72 115.29 121.07 1aia s HIS 189 Ca -0.05 0.91 -0.03 0.00 -0.15 0.00 0.00 55.06 55.74 1aia s HIS 189 Cb -0.15 -3.56 0.39 0.00 1.11 0.00 0.00 32.58 30.37 1aia s HIS 189 CO 0.03 -1.99 1.89 0.78 -0.85 0.00 0.00 174.74 174.60 1aia h GLY 190 N 9.54 1.09 -2.83 -2.22 0.00 -1.19 -3.46 103.07 104.00 1aia h GLY 190 Ca -0.30 -0.51 0.08 0.00 0.00 0.00 0.00 47.33 46.61 1aia h GLY 190 CO 0.95 0.48 0.37 0.00 0.00 0.00 0.00 176.54 178.34 1aia n HIS 193 N -3.64 1.78 -3.62 0.00 -0.00 -1.26 -4.78 115.22 103.70 1aia n HIS 193 Ca -0.10 0.65 -0.37 0.00 0.46 0.00 0.00 57.72 58.37 1aia n HIS 193 Cb 0.59 -2.38 -0.10 0.00 -0.12 0.00 0.00 29.99 27.99 1aia n HIS 193 CO 0.00 0.00 0.00 1.21 0.46 0.00 0.00 176.34 178.01 1aia s ASN 194 N 2.35 6.11 0.00 0.26 2.47 -1.26 0.40 114.94 125.27 1aia s ASN 194 Ca 0.94 0.10 0.23 0.00 0.42 0.00 0.00 52.86 54.55 1aia s ASN 194 Cb -1.09 -2.12 0.04 0.00 -1.45 0.00 0.00 41.25 36.64 1aia s ASN 194 CO 0.61 0.01 1.12 -0.81 -3.72 0.00 0.00 177.10 174.31 1aia n PRO 195 N 4.57 1.52 0.07 0.43 -0.04 -1.26 -2.64 135.00 137.65 1aia n PRO 195 Ca -0.14 -1.24 -0.18 0.00 -0.04 0.00 0.00 63.50 61.91 1aia n PRO 195 Cb 0.52 -1.46 -0.09 0.00 -0.04 0.00 0.00 33.50 32.42 1aia n PRO 195 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 1aia h THR 196 N 3.00 1.35 -0.04 0.52 2.02 -1.77 -3.14 112.91 114.85 1aia h THR 196 Ca 0.00 -2.47 -0.02 0.00 0.77 0.00 0.00 66.41 64.69 1aia h THR 196 Cb 0.81 2.55 -0.01 0.00 -1.74 0.00 0.00 68.15 69.76 1aia h THR 196 CO 0.00 0.75 -0.02 0.61 0.37 0.00 0.00 175.52 177.23 1aia n GLY 197 N 1.16 0.28 3.63 2.16 0.00 0.16 -4.32 105.19 108.27 1aia n GLY 197 Ca -0.10 -0.03 -0.37 0.00 0.00 0.00 0.00 46.02 45.52 1aia n GLY 197 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1aia s ILE 198 N -1.48 5.31 0.14 -0.61 1.01 -1.26 -0.01 121.20 124.30 1aia s ILE 198 Ca 0.00 0.26 0.11 0.00 0.00 0.00 0.00 60.65 61.02 1aia s ILE 198 Cb 0.00 -3.55 -0.04 0.00 0.01 0.00 0.00 42.46 38.88 1aia s ILE 198 CO 0.00 0.28 -0.25 -1.81 0.00 0.00 0.00 174.94 173.17 1aia s ASP 199 N 1.36 3.44 0.63 3.58 1.01 -1.26 -4.46 116.67 120.96 1aia s ASP 199 Ca 0.09 -0.75 -0.18 0.00 0.71 0.00 0.00 52.55 52.42 1aia s ASP 199 Cb -0.15 -0.28 -0.02 0.00 1.01 0.00 0.00 42.92 43.49 1aia s ASP 199 CO 0.08 0.16 1.23 -2.84 0.21 0.00 0.00 175.17 174.01 1aia s PRO 200 N -2.23 2.75 0.83 8.23 0.02 -1.26 -5.00 135.00 138.33 1aia s PRO 200 Ca 0.16 1.87 -0.12 0.00 0.02 0.00 0.00 61.00 62.93 1aia s PRO 200 Cb -0.10 -1.89 0.09 0.00 0.02 0.00 0.00 34.50 32.62 1aia s PRO 200 CO 0.08 -1.39 1.15 0.95 -0.33 0.00 0.00 177.00 177.45 1aia s THR 201 N -1.61 2.32 0.41 0.99 -4.23 -1.26 -4.80 115.64 107.46 1aia s THR 201 Ca 0.78 0.10 0.13 0.00 -1.18 0.00 0.00 61.69 61.53 1aia s THR 201 Cb -0.32 -3.00 0.14 0.00 1.34 0.00 0.00 72.50 70.67 1aia s THR 201 CO 0.37 -0.13 1.92 0.25 -0.54 0.00 0.00 174.62 176.48 1aia h LEU 202 N -1.15 0.01 -0.54 4.79 5.85 -1.99 0.03 115.31 122.32 1aia h LEU 202 Ca -0.47 -0.00 -0.11 0.00 0.84 0.00 0.00 57.88 58.13 1aia h LEU 202 Cb 1.31 -0.00 -0.02 0.00 0.37 0.00 0.00 40.66 42.32 1aia h LEU 202 CO 0.64 0.27 -0.10 -0.33 -0.34 0.00 0.00 178.44 178.58 1aia h GLU 203 N 0.01 1.02 -0.23 1.25 5.08 -1.99 -1.31 114.58 118.40 1aia h GLU 203 Ca -0.00 -0.38 -0.10 0.00 -1.00 0.00 0.00 59.36 57.88 1aia h GLU 203 Cb 0.46 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.64 1aia h GLU 203 CO 0.03 1.06 -0.30 1.96 -1.00 0.00 0.00 179.01 180.77 1aia h GLN 204 N 0.90 0.46 -0.21 2.33 4.20 -1.77 -2.67 115.11 118.35 1aia h GLN 204 Ca 0.14 -0.19 -0.01 0.00 0.06 0.00 0.00 58.65 58.65 1aia h GLN 204 Cb 0.67 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.42 1aia h GLN 204 CO 0.05 0.71 0.09 -1.49 -0.67 0.00 0.00 178.83 177.52 1aia h TRP 205 N 0.40 0.31 -0.43 2.96 -0.00 -0.62 -0.71 115.95 117.87 1aia h TRP 205 Ca 0.05 -0.02 0.03 0.00 -0.00 0.00 0.00 58.89 58.95 1aia h TRP 205 Cb 0.73 -0.09 -0.02 0.00 -0.00 0.00 0.00 29.16 29.77 1aia h TRP 205 CO 0.02 0.34 0.28 1.96 -0.00 0.00 0.00 178.44 181.05 1aia h GLN 206 N 0.20 0.47 0.08 0.49 4.20 -1.25 0.13 115.11 119.43 1aia h GLN 206 Ca 0.07 -0.03 -0.00 0.00 0.06 0.00 0.00 58.65 58.75 1aia h GLN 206 Cb 0.15 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 27.83 1aia h GLN 206 CO -0.01 0.31 -0.04 1.15 -0.67 0.00 0.00 178.83 179.58 1aia h THR 207 N 0.48 1.14 -0.28 -0.54 2.02 -1.10 -2.43 112.91 112.21 1aia h THR 207 Ca 0.17 -0.82 -0.00 0.00 0.77 0.00 0.00 66.41 66.53 1aia h THR 207 Cb 0.08 1.66 -0.01 0.00 -1.74 0.00 0.00 68.15 68.14 1aia h THR 207 CO -0.04 0.20 0.16 -0.07 0.37 0.00 0.00 175.52 176.14 1aia h LEU 208 N -0.48 0.33 -0.26 2.58 3.38 -0.48 -1.44 115.31 118.93 1aia h LEU 208 Ca -0.01 -0.01 -0.10 0.00 0.09 0.00 0.00 57.88 57.85 1aia h LEU 208 Cb 0.41 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 41.07 1aia h LEU 208 CO 0.02 0.26 -0.22 0.00 0.09 0.00 0.00 178.44 178.59 1aia h ALA 209 N 1.80 0.38 -0.30 1.53 0.00 -0.66 -1.38 119.26 120.63 1aia h ALA 209 Ca 0.10 -0.37 -0.07 0.00 0.00 0.00 0.00 54.91 54.58 1aia h ALA 209 Cb -0.00 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1aia h ALA 209 CO -0.02 0.34 -0.07 0.37 0.00 0.00 0.00 179.25 179.88 1aia h GLN 210 N 0.34 0.58 -0.54 0.00 5.75 -1.05 -2.08 115.11 118.12 1aia h GLN 210 Ca 0.05 -0.22 -0.02 0.00 -0.15 0.00 0.00 58.65 58.31 1aia h GLN 210 Cb 0.77 -0.03 -0.03 0.00 1.07 0.00 0.00 27.48 29.26 1aia h GLN 210 CO 0.06 0.76 0.24 1.25 -2.65 0.00 0.00 178.83 178.49 1aia h LEU 211 N 0.34 0.69 -0.77 -2.39 5.85 -1.32 -2.73 115.31 114.98 1aia h LEU 211 Ca 0.08 -0.07 -0.07 0.00 0.84 0.00 0.00 57.88 58.65 1aia h LEU 211 Cb 0.55 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.38 1aia h LEU 211 CO 0.03 0.60 0.11 -1.28 -0.34 0.00 0.00 178.44 177.56 1aia h SER 212 N 0.76 0.99 -0.59 1.25 0.87 -0.78 -2.50 113.55 113.56 1aia h SER 212 Ca 0.19 -0.23 -0.04 0.00 -1.23 0.00 0.00 61.79 60.48 1aia h SER 212 Cb 0.11 -0.26 -0.03 0.00 -0.44 0.00 0.00 62.40 61.78 1aia h SER 212 CO -0.02 0.98 0.22 0.58 -0.53 0.00 0.00 176.83 178.06 1aia h VAL 213 N 0.98 1.23 0.00 2.23 2.07 -1.17 -2.42 116.25 119.17 1aia h VAL 213 Ca 0.20 -0.75 -0.07 0.00 0.82 0.00 0.00 66.70 66.89 1aia h VAL 213 Cb 0.41 0.62 -0.01 0.00 -1.52 0.00 0.00 31.29 30.79 1aia h VAL 213 CO 0.01 0.29 -0.71 1.05 0.02 0.00 0.00 177.57 178.23 1aia h GLU 214 N 0.82 0.00 0.00 1.57 4.11 -1.43 -3.29 114.58 116.36 1aia h GLU 214 Ca 0.19 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.62 1aia h GLU 214 Cb 0.23 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.48 1aia h GLU 214 CO -0.01 0.24 -0.68 1.63 0.07 0.00 0.00 179.01 180.26 1aia n LYS 215 N -3.01 0.15 -2.15 1.06 4.01 -0.95 -5.01 118.16 112.27 1aia n LYS 215 Ca -0.01 0.02 -0.02 0.00 -0.51 0.00 0.00 58.31 57.79 1aia n LYS 215 Cb 0.68 -1.57 0.00 0.00 -0.51 0.00 0.00 35.03 33.62 1aia n LYS 215 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1aia n GLY 216 N 1.42 0.37 3.79 0.72 0.00 -0.95 -3.86 105.19 106.69 1aia n GLY 216 Ca 0.04 -0.76 -0.33 0.00 0.00 0.00 0.00 46.02 44.97 1aia n GLY 216 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1aia s TRP 217 N -2.28 2.86 -0.35 1.61 0.23 -0.97 -1.63 118.94 118.41 1aia s TRP 217 Ca 0.01 1.53 -0.13 0.00 -2.03 0.00 0.00 56.10 55.48 1aia s TRP 217 Cb -0.01 -3.08 -0.01 0.00 0.03 0.00 0.00 33.47 30.41 1aia s TRP 217 CO 0.01 -1.30 0.23 -1.17 0.96 0.00 0.00 176.95 175.68 1aia s LEU 218 N -4.51 4.54 0.12 2.99 2.96 0.38 -4.86 118.68 120.30 1aia s LEU 218 Ca 0.65 -0.53 -0.31 0.00 -0.22 0.00 0.00 54.13 53.72 1aia s LEU 218 Cb -0.18 -2.11 -0.09 0.00 0.50 0.00 0.00 46.19 44.31 1aia s LEU 218 CO 0.37 -0.26 1.53 -2.84 -1.32 0.00 0.00 176.35 173.83 1aia s PRO 219 N 1.69 4.24 -0.21 0.98 0.02 -1.26 -1.19 135.00 139.27 1aia s PRO 219 Ca 0.05 2.26 0.01 0.00 0.02 0.00 0.00 61.00 63.34 1aia s PRO 219 Cb -0.18 -3.31 0.05 0.00 0.02 0.00 0.00 34.50 31.08 1aia s PRO 219 CO 0.10 -0.59 -0.10 -1.17 -0.33 0.00 0.00 177.00 174.91 1aia s LEU 220 N 1.56 2.46 -0.10 -5.54 2.96 -0.20 -2.14 118.68 117.68 1aia s LEU 220 Ca 0.69 -1.00 -0.15 0.00 -0.22 0.00 0.00 54.13 53.46 1aia s LEU 220 Cb -0.40 -1.26 -0.05 0.00 0.50 0.00 0.00 46.19 44.98 1aia s LEU 220 CO 0.31 -0.16 0.37 -0.36 -1.32 0.00 0.00 176.35 175.18 1aia s PHE 221 N 1.36 3.57 -0.24 5.38 0.40 -0.04 -0.86 117.98 127.55 1aia s PHE 221 Ca -0.03 0.79 -0.05 0.00 -0.60 0.00 0.00 56.93 57.05 1aia s PHE 221 Cb -0.17 -2.35 -0.01 0.00 0.51 0.00 0.00 43.02 41.00 1aia s PHE 221 CO -0.08 0.38 -0.01 0.34 0.70 0.00 0.00 175.22 176.56 1aia s ASP 222 N -0.08 4.54 -0.72 1.36 -1.08 0.10 -0.87 116.67 119.92 1aia s ASP 222 Ca 0.21 -0.43 0.05 0.00 -0.52 0.00 0.00 52.55 51.86 1aia s ASP 222 Cb -0.15 -1.78 0.17 0.00 -1.46 0.00 0.00 42.92 39.71 1aia s ASP 222 CO 0.08 -0.05 0.51 0.12 0.52 0.00 0.00 175.17 176.36 1aia s PHE 223 N 1.49 3.61 -0.79 -5.34 2.19 0.32 -0.55 117.98 118.92 1aia s PHE 223 Ca 0.05 -3.33 0.23 0.00 0.33 0.00 0.00 56.93 54.21 1aia s PHE 223 Cb -0.15 -2.74 0.06 0.00 -1.31 0.00 0.00 43.02 38.88 1aia s PHE 223 CO -0.02 -0.55 1.06 0.00 1.83 0.00 0.00 175.22 177.54 1aia n ALA 224 N 1.96 3.80 -2.31 11.12 0.00 -1.26 -2.07 120.51 131.76 1aia n ALA 224 Ca 0.20 -0.45 -0.15 0.00 0.00 0.00 0.00 53.44 53.04 1aia n ALA 224 Cb 0.35 -0.94 0.03 0.00 0.00 0.00 0.00 19.45 18.90 1aia n ALA 224 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1aia n TYR 225 N -1.74 2.17 -1.99 0.00 4.01 -1.26 -4.45 117.16 113.90 1aia n TYR 225 Ca 0.03 -2.17 -0.42 0.00 -0.16 0.00 0.00 57.90 55.18 1aia n TYR 225 Cb 0.39 -0.30 -0.03 0.00 -0.31 0.00 0.00 39.34 39.09 1aia n TYR 225 CO 0.00 0.00 0.00 -1.14 -0.46 0.00 0.00 176.86 175.26 1aia s GLN 226 N -3.64 4.11 0.00 -0.72 0.74 -1.26 -2.36 119.66 116.53 1aia s GLN 226 Ca 0.42 2.14 0.00 0.00 0.05 0.00 0.00 55.36 57.97 1aia s GLN 226 Cb 0.38 -4.01 0.00 0.00 1.10 0.00 0.00 33.01 30.48 1aia s GLN 226 CO 0.01 -0.94 0.00 0.41 -0.55 0.00 0.00 175.29 174.22 1aia n GLY 227 N 4.25 0.83 0.72 2.59 0.00 -1.26 -4.73 105.19 107.60 1aia n GLY 227 Ca 0.18 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.30 1aia n GLY 227 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1aia n PHE 228 N -0.70 0.00 -3.98 1.61 3.01 -0.99 -4.42 117.46 111.99 1aia n PHE 228 Ca 0.00 0.00 -0.29 0.00 1.01 0.00 0.00 57.45 58.17 1aia n PHE 228 Cb 0.00 0.00 -0.16 0.00 -0.01 0.00 0.00 39.48 39.31 1aia n PHE 228 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1aia s ALA 229 N -1.81 1.72 0.00 4.37 0.00 -1.26 -3.44 121.76 121.34 1aia s ALA 229 Ca 0.22 -0.86 0.00 0.00 0.00 0.00 0.00 51.96 51.32 1aia s ALA 229 Cb 0.17 -1.06 0.00 0.00 0.00 0.00 0.00 23.12 22.22 1aia s ALA 229 CO 0.31 -0.50 0.00 0.54 0.00 0.00 0.00 175.76 176.11 1aia n ARG 230 N 4.81 0.00 0.00 0.00 1.74 -1.26 -4.63 116.66 117.32 1aia n ARG 230 Ca -0.15 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.93 1aia n ARG 230 Cb 0.49 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.93 1aia n ARG 230 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1aia n GLY 231 N 0.00 0.57 0.18 -0.13 0.00 -1.26 -4.95 105.19 99.60 1aia n GLY 231 Ca 0.00 -1.06 -0.07 0.00 0.00 0.00 0.00 46.02 44.90 1aia n GLY 231 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1aia h LEU 233 N 0.00 -0.43 0.18 0.99 4.07 -1.89 -0.56 115.31 117.68 1aia h LEU 233 Ca 0.00 0.11 -0.25 0.00 0.08 0.00 0.00 57.88 57.82 1aia h LEU 233 Cb 0.00 0.25 0.03 0.00 1.08 0.00 0.00 40.66 42.01 1aia h LEU 233 CO 0.00 -0.16 -1.14 -0.33 -1.08 0.00 0.00 178.44 175.73 1aia h GLU 234 N -0.07 0.39 -0.43 1.13 4.39 -1.96 -3.30 114.58 114.73 1aia h GLU 234 Ca 0.16 -0.66 0.03 0.00 0.34 0.00 0.00 59.36 59.23 1aia h GLU 234 Cb 0.31 0.25 -0.02 0.00 -0.10 0.00 0.00 28.75 29.18 1aia h GLU 234 CO -0.35 1.32 0.29 0.93 -1.16 0.00 0.00 179.01 180.03 1aia h GLU 235 N -0.17 0.46 0.00 2.33 3.07 -1.90 -0.92 114.58 117.45 1aia h GLU 235 Ca -0.21 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.63 1aia h GLU 235 Cb 1.86 -0.10 0.00 0.00 -0.84 0.00 0.00 28.75 29.67 1aia h GLU 235 CO 0.19 0.30 0.00 -0.44 -1.40 0.00 0.00 179.01 177.66 1aia h ASP 236 N 0.47 0.00 -0.30 1.42 5.19 -1.19 -2.90 116.42 119.11 1aia h ASP 236 Ca 0.18 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.59 1aia h ASP 236 Cb 0.12 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.63 1aia h ASP 236 CO -0.04 0.00 0.00 0.00 -3.12 0.00 0.00 179.24 176.08 1aia n ALA 237 N -2.02 2.44 -0.29 3.45 0.00 -0.36 -4.49 120.51 119.23 1aia n ALA 237 Ca 0.03 -0.91 0.05 0.00 0.00 0.00 0.00 53.44 52.61 1aia n ALA 237 Cb 0.40 -0.88 0.20 0.00 0.00 0.00 0.00 19.45 19.17 1aia n ALA 237 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1aia h GLU 238 N 4.42 0.67 -0.44 0.00 4.81 -1.39 0.17 114.58 122.82 1aia h GLU 238 Ca 0.00 -0.04 -0.10 0.00 -0.13 0.00 0.00 59.36 59.09 1aia h GLU 238 Cb 0.96 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 30.18 1aia h GLU 238 CO 0.00 0.44 -0.11 0.78 -0.73 0.00 0.00 179.01 179.40 1aia h GLY 239 N 0.69 0.92 0.99 1.92 0.00 -1.81 -2.25 103.07 103.53 1aia h GLY 239 Ca 0.43 -0.76 -0.00 0.00 0.00 0.00 0.00 47.33 47.00 1aia h GLY 239 CO -0.31 0.69 0.32 -2.00 0.00 0.00 0.00 176.54 175.24 1aia h LEU 240 N 0.68 0.65 -1.18 3.11 6.46 -1.56 -2.93 115.31 120.55 1aia h LEU 240 Ca 0.11 -0.07 -0.07 0.00 -0.12 0.00 0.00 57.88 57.74 1aia h LEU 240 Cb 0.65 -0.16 -0.01 0.00 -0.73 0.00 0.00 40.66 40.40 1aia h LEU 240 CO 0.04 0.53 -0.32 0.03 -0.62 0.00 0.00 178.44 178.11 1aia h ARG 241 N 0.72 0.00 -0.19 1.25 3.08 -0.64 0.05 114.38 118.64 1aia h ARG 241 Ca 0.19 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.18 1aia h ARG 241 Cb 0.00 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.05 1aia h ARG 241 CO -0.03 0.32 -0.12 0.00 -1.07 0.00 0.00 179.97 179.06 1aia h ALA 242 N 1.68 0.27 -0.37 0.04 0.00 -1.23 -2.18 119.26 117.47 1aia h ALA 242 Ca -0.00 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1aia h ALA 242 Cb 0.75 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.46 1aia h ALA 242 CO 0.04 0.13 0.24 0.74 0.00 0.00 0.00 179.25 180.39 1aia h PHE 243 N 0.10 0.48 0.00 0.00 -1.00 -1.31 -2.97 116.94 112.24 1aia h PHE 243 Ca 0.04 0.00 -0.01 0.00 2.81 0.00 0.00 57.97 60.82 1aia h PHE 243 Cb 0.63 -0.16 -0.00 0.00 3.61 0.00 0.00 35.95 40.02 1aia h PHE 243 CO 0.07 0.33 -0.03 0.00 -1.61 0.00 0.00 178.31 177.07 1aia h ALA 244 N 1.11 1.55 -0.19 2.45 0.00 -0.95 -0.60 119.26 122.63 1aia h ALA 244 Ca 0.14 -0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.89 1aia h ALA 244 Cb -0.02 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1aia h ALA 244 CO -0.03 0.04 -0.43 0.00 0.00 0.00 0.00 179.25 178.83 1aia h ALA 245 N 1.97 0.91 -0.00 0.00 0.00 -1.22 -3.34 119.26 117.57 1aia h ALA 245 Ca -0.00 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1aia h ALA 245 Cb 0.08 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1aia h ALA 245 CO 0.00 0.64 -0.34 0.00 0.00 0.00 0.00 179.25 179.55 1aia n MET 246 N -4.01 3.12 -3.98 0.00 -0.00 -0.85 -5.00 117.12 106.40 1aia n MET 246 Ca -0.02 -0.26 -0.35 0.00 -0.00 0.00 0.00 57.70 57.08 1aia n MET 246 Cb 0.52 -1.00 -0.06 0.00 -0.00 0.00 0.00 33.22 32.68 1aia n MET 246 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 175.97 174.96 1aia s HIS 247 N -1.66 3.48 -0.03 3.17 4.02 -0.29 -4.95 115.29 119.03 1aia s HIS 247 Ca 0.06 0.38 -0.23 0.00 1.02 0.00 0.00 55.06 56.29 1aia s HIS 247 Cb 0.08 -1.85 -0.22 0.00 -1.02 0.00 0.00 32.58 29.56 1aia s HIS 247 CO 0.33 0.65 1.09 0.87 1.02 0.00 0.00 174.74 178.70 1aia h LYS 248 N 4.45 0.24 -5.31 1.40 1.79 -1.90 -3.46 116.57 113.78 1aia h LYS 248 Ca -0.51 -0.23 -0.43 0.00 -2.18 0.00 0.00 60.65 57.29 1aia h LYS 248 Cb 1.20 0.06 -0.24 0.00 -1.58 0.00 0.00 32.23 31.67 1aia h LYS 248 CO 0.62 0.92 -0.79 -1.21 -1.08 0.00 0.00 179.45 177.91 1aia s GLU 249 N -3.34 0.89 0.02 3.15 2.02 -1.26 -3.07 118.70 117.11 1aia s GLU 249 Ca -0.15 -0.81 -0.29 0.00 0.02 0.00 0.00 54.97 53.74 1aia s GLU 249 Cb 0.02 -0.90 0.10 0.00 0.10 0.00 0.00 34.13 33.45 1aia s GLU 249 CO 0.76 0.22 1.00 -0.48 0.02 0.00 0.00 175.26 176.78 1aia s LEU 250 N -1.31 -0.23 -0.02 1.80 2.34 -1.05 -4.60 118.68 115.61 1aia s LEU 250 Ca 0.00 -0.15 0.04 0.00 0.06 0.00 0.00 54.13 54.09 1aia s LEU 250 Cb -0.08 1.90 -0.01 0.00 -0.56 0.00 0.00 46.19 47.44 1aia s LEU 250 CO 0.02 -0.62 -0.14 -0.63 -1.06 0.00 0.00 176.35 173.91 1aia s ILE 251 N -2.99 1.16 -0.12 1.48 1.01 -0.91 -0.92 121.20 119.90 1aia s ILE 251 Ca 0.09 -0.61 0.02 0.00 0.00 0.00 0.00 60.65 60.15 1aia s ILE 251 Cb -0.00 -0.98 0.01 0.00 0.01 0.00 0.00 42.46 41.50 1aia s ILE 251 CO -0.04 0.33 -0.18 -0.69 0.00 0.00 0.00 174.94 174.36 1aia s VAL 252 N -0.20 1.77 -0.26 2.92 1.01 -0.10 -0.86 120.40 124.68 1aia s VAL 252 Ca 0.03 -0.80 -0.08 0.00 0.00 0.00 0.00 61.98 61.13 1aia s VAL 252 Cb -0.07 -1.59 -0.02 0.00 0.00 0.00 0.00 36.38 34.70 1aia s VAL 252 CO 0.00 0.49 0.08 0.00 0.00 0.00 0.00 175.10 175.67 1aia s ALA 253 N 0.91 3.17 0.26 5.51 0.00 -0.04 -0.33 121.76 131.23 1aia s ALA 253 Ca -0.07 -1.17 0.07 0.00 0.00 0.00 0.00 51.96 50.79 1aia s ALA 253 Cb -0.15 -2.12 -0.05 0.00 0.00 0.00 0.00 23.12 20.80 1aia s ALA 253 CO -0.02 -0.55 -0.08 -1.54 0.00 0.00 0.00 175.76 173.57 1aia s SER 254 N 1.61 2.78 0.03 0.00 1.04 -0.10 -0.52 113.70 118.55 1aia s SER 254 Ca 0.06 -1.15 0.03 0.00 0.48 0.00 0.00 55.95 55.38 1aia s SER 254 Cb -0.15 -0.17 -0.02 0.00 0.10 0.00 0.00 66.02 65.78 1aia s SER 254 CO 0.04 -0.28 -0.10 -0.55 0.98 0.00 0.00 173.24 173.33 1aia s SER 255 N -3.42 1.11 -0.03 7.02 0.15 -0.88 -1.22 113.70 116.43 1aia s SER 255 Ca 0.28 -0.42 0.08 0.00 0.70 0.00 0.00 55.95 56.60 1aia s SER 255 Cb 0.02 -0.04 0.22 0.00 -1.71 0.00 0.00 66.02 64.51 1aia s SER 255 CO 0.11 -0.06 1.17 -1.22 1.20 0.00 0.00 173.24 174.45 1aia n TYR 256 N 1.95 0.31 -0.16 3.44 4.01 -0.54 -4.72 117.16 121.44 1aia n TYR 256 Ca -0.19 -0.58 -0.08 0.00 -0.16 0.00 0.00 57.90 56.89 1aia n TYR 256 Cb 0.55 -0.08 0.01 0.00 -0.31 0.00 0.00 39.34 39.52 1aia n TYR 256 CO 0.00 0.00 0.00 0.77 -0.46 0.00 0.00 176.86 177.17 1aia h SER 257 N 1.10 0.57 0.04 7.72 0.02 -1.85 -3.17 113.55 117.98 1aia h SER 257 Ca 0.00 -0.07 -0.30 0.00 -0.84 0.00 0.00 61.79 60.58 1aia h SER 257 Cb 0.75 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 63.11 1aia h SER 257 CO 0.02 0.47 -1.67 1.41 -1.14 0.00 0.00 176.83 175.93 1aia n HIS 258 N -4.70 0.94 0.63 3.45 8.25 -1.26 -1.67 115.22 120.86 1aia n HIS 258 Ca 0.01 0.32 0.12 0.00 -0.26 0.00 0.00 57.72 57.92 1aia n HIS 258 Cb 0.07 -1.10 0.46 0.00 1.12 0.00 0.00 29.99 30.53 1aia n HIS 258 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1aia n ASN 259 N -4.09 0.43 -0.21 0.41 0.23 -1.26 -3.04 115.26 107.73 1aia n ASN 259 Ca -0.35 0.57 0.04 0.00 -0.53 0.00 0.00 54.58 54.31 1aia n ASN 259 Cb 0.82 -0.67 0.01 0.00 -2.08 0.00 0.00 39.78 37.86 1aia n ASN 259 CO 0.00 0.00 0.00 0.49 -0.93 0.00 0.00 177.26 176.82 1aia n PHE 260 N -1.93 0.00 -2.84 -2.53 3.01 -1.20 -4.79 117.46 107.19 1aia n PHE 260 Ca 0.05 0.00 -0.22 0.00 1.01 0.00 0.00 57.45 58.29 1aia n PHE 260 Cb 0.31 0.00 0.02 0.00 -0.01 0.00 0.00 39.48 39.80 1aia n PHE 260 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1aia n GLY 261 N 0.75 -0.50 1.48 1.37 0.00 -1.03 -4.65 105.19 102.62 1aia n GLY 261 Ca 0.04 0.08 -0.06 0.00 0.00 0.00 0.00 46.02 46.08 1aia n GLY 261 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1aia n LEU 262 N -3.70 4.97 -0.23 0.99 7.94 -0.67 -4.82 117.00 121.47 1aia n LEU 262 Ca -0.15 -3.49 -0.06 0.00 -1.11 0.00 0.00 56.01 51.20 1aia n LEU 262 Cb 0.64 -0.68 -0.06 0.00 0.53 0.00 0.00 43.42 43.85 1aia n LEU 262 CO 0.42 1.01 0.38 -1.22 -1.11 0.00 0.00 177.39 176.88 1aia n TYR 263 N -0.82 -0.24 1.59 1.96 4.01 -1.18 -1.76 117.16 120.72 1aia n TYR 263 Ca 0.37 0.69 0.09 0.00 -0.16 0.00 0.00 57.90 58.89 1aia n TYR 263 Cb 1.20 -0.51 0.39 0.00 -0.31 0.00 0.00 39.34 40.11 1aia n TYR 263 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 1aia n ASN 264 N -4.34 0.83 -0.07 7.72 0.23 -1.26 -3.16 115.26 115.22 1aia n ASN 264 Ca 0.01 -1.64 0.11 0.00 -0.53 0.00 0.00 54.58 52.53 1aia n ASN 264 Cb 0.14 -0.06 0.04 0.00 -2.08 0.00 0.00 39.78 37.82 1aia n ASN 264 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 1aia n GLU 265 N -0.20 0.18 -2.86 -3.83 -0.58 -0.72 -5.02 120.64 107.60 1aia n GLU 265 Ca 0.13 -0.13 -0.08 0.00 -0.42 0.00 0.00 57.16 56.66 1aia n GLU 265 Cb 0.18 -1.50 0.01 0.00 -0.57 0.00 0.00 31.44 29.57 1aia n GLU 265 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1aia n ARG 266 N -1.30 -2.49 -3.95 3.49 5.12 -1.19 -4.52 116.66 111.82 1aia n ARG 266 Ca 0.06 2.17 -0.30 0.00 -1.93 0.00 0.00 57.85 57.85 1aia n ARG 266 Cb 0.35 -5.50 -0.16 0.00 -1.16 0.00 0.00 32.46 25.98 1aia n ARG 266 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1aia s VAL 267 N -2.45 1.51 0.27 1.55 1.01 -1.26 -2.92 120.40 118.11 1aia s VAL 267 Ca 0.23 -1.05 -0.09 0.00 0.00 0.00 0.00 61.98 61.07 1aia s VAL 267 Cb -0.06 -1.69 0.04 0.00 0.00 0.00 0.00 36.38 34.67 1aia s VAL 267 CO 0.77 0.04 0.52 0.61 0.00 0.00 0.00 175.10 177.04 1aia n GLY 268 N 4.71 1.47 3.32 4.51 0.00 -1.10 -1.47 105.19 116.62 1aia n GLY 268 Ca -0.13 -1.24 -0.12 0.00 0.00 0.00 0.00 46.02 44.53 1aia n GLY 268 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aia s ALA 269 N -1.86 -0.97 -0.18 4.61 0.00 -0.35 -1.57 121.76 121.43 1aia s ALA 269 Ca 0.13 0.21 0.01 0.00 0.00 0.00 0.00 51.96 52.30 1aia s ALA 269 Cb -0.03 0.43 0.04 0.00 0.00 0.00 0.00 23.12 23.55 1aia s ALA 269 CO 0.09 -0.50 -0.11 0.00 0.00 0.00 0.00 175.76 175.24 1aia s THR 271 N 1.43 4.06 -0.28 0.00 2.01 0.55 -1.52 115.64 121.89 1aia s THR 271 Ca 0.01 -0.28 -0.11 0.00 0.31 0.00 0.00 61.69 61.62 1aia s THR 271 Cb -0.15 -2.82 -0.04 0.00 0.01 0.00 0.00 72.50 69.50 1aia s THR 271 CO -0.09 0.45 0.18 -0.76 -0.69 0.00 0.00 174.62 173.72 1aia s LEU 272 N 0.70 4.02 0.06 4.42 1.43 -0.48 -0.92 118.68 127.92 1aia s LEU 272 Ca -0.00 -0.09 0.07 0.00 -1.03 0.00 0.00 54.13 53.08 1aia s LEU 272 Cb -0.14 -2.10 -0.04 0.00 0.03 0.00 0.00 46.19 43.94 1aia s LEU 272 CO 0.02 -0.07 -0.14 0.68 0.23 0.00 0.00 176.35 177.07 1aia s VAL 273 N 1.74 3.09 0.39 -1.59 -7.23 -0.10 -1.75 120.40 114.94 1aia s VAL 273 Ca 0.07 -1.16 0.04 0.00 -1.81 0.00 0.00 61.98 59.12 1aia s VAL 273 Cb -0.16 -2.35 -0.02 0.00 0.56 0.00 0.00 36.38 34.41 1aia s VAL 273 CO 0.10 0.27 0.15 0.00 -0.31 0.00 0.00 175.10 175.31 1aia n ALA 274 N 1.28 0.56 0.24 1.32 0.00 -0.79 -2.54 120.51 120.58 1aia n ALA 274 Ca -0.15 -1.99 0.08 0.00 0.00 0.00 0.00 53.44 51.37 1aia n ALA 274 Cb 0.52 1.36 0.58 0.00 0.00 0.00 0.00 19.45 21.90 1aia n ALA 274 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1aia h ALA 275 N 1.67 1.57 -2.96 0.00 0.00 -1.85 -3.44 119.26 114.24 1aia h ALA 275 Ca -0.30 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.39 1aia h ALA 275 Cb 1.17 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.89 1aia h ALA 275 CO 0.48 0.21 0.10 0.16 0.00 0.00 0.00 179.25 180.19 1aia s ASP 276 N -6.73 0.16 0.15 0.00 1.47 -1.26 -4.98 116.67 105.46 1aia s ASP 276 Ca -0.04 -1.10 -0.11 0.00 1.18 0.00 0.00 52.55 52.49 1aia s ASP 276 Cb 0.15 0.75 -0.02 0.00 -0.34 0.00 0.00 42.92 43.45 1aia s ASP 276 CO 0.66 -1.46 1.51 0.77 0.68 0.00 0.00 175.17 177.33 1aia h SER 277 N 2.06 0.99 0.61 2.11 4.64 -1.75 -2.60 113.55 119.62 1aia h SER 277 Ca -0.28 -0.43 -0.08 0.00 -0.47 0.00 0.00 61.79 60.53 1aia h SER 277 Cb 1.25 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 63.05 1aia h SER 277 CO 0.36 1.20 -0.38 1.05 -0.87 0.00 0.00 176.83 178.19 1aia h GLU 278 N 0.78 0.00 -0.14 4.77 -0.00 -1.96 0.40 114.58 118.44 1aia h GLU 278 Ca 0.09 0.00 -0.15 0.00 -0.00 0.00 0.00 59.36 59.29 1aia h GLU 278 Cb 0.87 0.00 0.01 0.00 -0.00 0.00 0.00 28.75 29.62 1aia h GLU 278 CO 0.08 0.38 -0.51 1.15 -0.00 0.00 0.00 179.01 180.11 1aia h THR 279 N 0.00 1.34 0.00 -1.06 2.02 -1.97 -2.23 112.91 111.01 1aia h THR 279 Ca -0.00 -1.79 -0.02 0.00 0.77 0.00 0.00 66.41 65.36 1aia h THR 279 Cb 0.79 2.08 -0.00 0.00 -1.74 0.00 0.00 68.15 69.28 1aia h THR 279 CO 0.05 0.55 -0.11 1.62 0.37 0.00 0.00 175.52 177.99 1aia h VAL 280 N 0.23 0.26 -0.11 3.16 3.04 -0.95 -1.77 116.25 120.11 1aia h VAL 280 Ca -0.03 -0.91 -0.19 0.00 -1.01 0.00 0.00 66.70 64.56 1aia h VAL 280 Cb 1.15 1.73 0.01 0.00 -2.01 0.00 0.00 31.29 32.16 1aia h VAL 280 CO 0.11 0.11 -0.69 0.44 -1.01 0.00 0.00 177.57 176.53 1aia h ASP 281 N 0.00 0.80 -0.54 3.17 5.19 -0.88 -0.99 116.42 123.16 1aia h ASP 281 Ca -0.00 -0.66 -0.11 0.00 -0.62 0.00 0.00 57.03 55.64 1aia h ASP 281 Cb 0.72 -0.24 -0.02 0.00 0.18 0.00 0.00 39.33 39.97 1aia h ASP 281 CO 0.01 1.33 -0.11 -0.09 -3.12 0.00 0.00 179.24 177.26 1aia h ARG 282 N 0.32 1.03 -0.10 3.56 2.43 -1.17 -2.72 114.38 117.73 1aia h ARG 282 Ca -0.06 -0.38 -0.17 0.00 -0.81 0.00 0.00 59.98 58.56 1aia h ARG 282 Cb 1.34 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.82 1aia h ARG 282 CO 0.14 1.07 -0.65 0.00 -1.51 0.00 0.00 179.97 179.02 1aia h ALA 283 N 0.92 0.68 0.00 2.80 0.00 -1.39 -3.19 119.26 119.09 1aia h ALA 283 Ca 0.14 -0.57 -0.06 0.00 0.00 0.00 0.00 54.91 54.42 1aia h ALA 283 Cb 0.68 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1aia h ALA 283 CO 0.05 0.73 -0.31 0.35 0.00 0.00 0.00 179.25 180.07 1aia h PHE 284 N 0.29 0.00 -0.20 0.00 3.57 -1.14 -2.25 116.94 117.22 1aia h PHE 284 Ca -0.02 0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.44 1aia h PHE 284 Cb 1.21 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.93 1aia h PHE 284 CO 0.04 0.31 -0.09 0.66 -2.23 0.00 0.00 178.31 177.00 1aia h SER 285 N 0.00 0.30 1.20 0.41 4.64 -1.46 -0.87 113.55 117.77 1aia h SER 285 Ca -0.00 -0.06 -0.11 0.00 -0.47 0.00 0.00 61.79 61.15 1aia h SER 285 Cb 0.59 -0.08 -0.02 0.00 -0.31 0.00 0.00 62.40 62.58 1aia h SER 285 CO 0.04 0.43 -0.53 1.56 -0.87 0.00 0.00 176.83 177.46 1aia h GLN 286 N 0.30 0.00 -0.32 4.77 1.08 -1.54 -1.54 115.11 117.86 1aia h GLN 286 Ca 0.06 0.00 -0.18 0.00 -1.45 0.00 0.00 58.65 57.08 1aia h GLN 286 Cb 0.35 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 27.78 1aia h GLN 286 CO 0.02 0.53 -0.50 1.98 -0.95 0.00 0.00 178.83 179.91 1aia h MET 287 N 0.00 0.90 -0.34 1.46 4.05 -0.82 -2.76 114.93 117.42 1aia h MET 287 Ca -0.01 -0.54 -0.16 0.00 -0.28 0.00 0.00 59.70 58.71 1aia h MET 287 Cb 1.28 0.05 -0.00 0.00 -0.80 0.00 0.00 31.60 32.12 1aia h MET 287 CO 0.07 1.19 -0.41 0.87 0.23 0.00 0.00 176.91 178.86 1aia h LYS 288 N 0.71 0.88 -0.96 0.39 1.57 -1.10 -2.41 116.57 115.65 1aia h LYS 288 Ca 0.03 -0.49 0.17 0.00 -1.87 0.00 0.00 60.65 58.49 1aia h LYS 288 Cb 1.11 0.03 -0.09 0.00 0.08 0.00 0.00 32.23 33.36 1aia h LYS 288 CO 0.11 1.14 0.61 0.00 -0.57 0.00 0.00 179.45 180.74 1aia h ALA 289 N 0.73 1.81 -0.35 3.86 0.00 -1.31 -1.35 119.26 122.65 1aia h ALA 289 Ca 0.05 0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.88 1aia h ALA 289 Cb 1.01 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 1aia h ALA 289 CO 0.10 -0.12 -0.25 0.00 0.00 0.00 0.00 179.25 178.98 1aia h ALA 290 N 1.61 0.90 -0.16 0.00 0.00 -1.15 -2.99 119.26 117.47 1aia h ALA 290 Ca 0.52 -0.38 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 1aia h ALA 290 Cb 0.87 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.51 1aia h ALA 290 CO -0.28 0.62 0.02 0.82 0.00 0.00 0.00 179.25 180.43 1aia h ILE 291 N 0.62 1.23 -0.44 0.00 2.04 -0.94 -2.82 117.51 117.19 1aia h ILE 291 Ca 0.08 -0.73 0.11 0.00 1.00 0.00 0.00 64.86 65.31 1aia h ILE 291 Cb 0.75 1.40 -0.02 0.00 -0.74 0.00 0.00 36.82 38.20 1aia h ILE 291 CO 0.06 0.22 0.31 -0.09 0.00 0.00 0.00 178.15 178.65 1aia h ARG 292 N 0.05 0.12 -0.01 2.37 9.65 -1.28 0.20 114.38 125.48 1aia h ARG 292 Ca 0.05 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 58.92 1aia h ARG 292 Cb 0.32 -0.03 0.00 0.00 -1.39 0.00 0.00 29.97 28.87 1aia h ARG 292 CO 0.00 0.08 -0.23 0.00 2.80 0.00 0.00 179.97 182.62 1aia n ALA 293 N -2.58 3.04 -0.41 2.80 0.00 -1.13 -3.77 120.51 118.45 1aia n ALA 293 Ca 0.07 -0.49 0.00 0.00 0.00 0.00 0.00 53.44 53.03 1aia n ALA 293 Cb 0.43 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.84 1aia n ALA 293 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1aia n ASN 294 N -0.20 0.00 -0.03 0.00 4.05 0.47 -4.93 115.26 114.62 1aia n ASN 294 Ca 0.13 0.00 0.02 0.00 0.45 0.00 0.00 54.58 55.18 1aia n ASN 294 Cb 0.39 -0.21 0.02 0.00 1.23 0.00 0.00 39.78 41.22 1aia n ASN 294 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1aia n TYR 295 N -2.04 0.00 0.00 1.20 0.18 0.17 -5.04 117.16 111.64 1aia n TYR 295 Ca 0.00 -0.50 0.00 0.00 1.88 0.00 0.00 57.90 59.28 1aia n TYR 295 Cb 0.00 -0.06 0.00 0.00 -0.38 0.00 0.00 39.34 38.90 1aia n TYR 295 CO 0.00 0.00 0.00 0.45 -2.08 0.00 0.00 176.86 175.23 1aia n SER 296 N -0.58 0.00 -3.75 9.48 2.88 -0.92 -4.77 113.62 115.95 1aia n SER 296 Ca 0.03 0.00 -0.10 0.00 -1.33 0.00 0.00 58.87 57.47 1aia n SER 296 Cb 0.37 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.78 1aia n SER 296 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1aia s ASN 297 N 0.00 -0.20 0.40 -3.46 2.20 -1.26 -4.09 114.94 108.52 1aia s ASN 297 Ca 0.00 -0.51 -0.04 0.00 -0.94 0.00 0.00 52.86 51.37 1aia s ASN 297 Cb 0.00 0.53 -0.04 0.00 -2.00 0.00 0.00 41.25 39.74 1aia s ASN 297 CO 0.00 -0.98 0.67 -2.16 -2.94 0.00 0.00 177.10 171.69 1aia s PRO 298 N -3.87 3.57 0.17 3.55 0.04 -1.26 -5.04 135.00 132.16 1aia s PRO 298 Ca 0.09 0.05 -0.32 0.00 0.04 0.00 0.00 61.00 60.87 1aia s PRO 298 Cb 0.00 -2.51 -0.11 0.00 0.04 0.00 0.00 34.50 31.93 1aia s PRO 298 CO -0.04 -0.01 1.68 -1.25 0.04 0.00 0.00 177.00 177.42 1aia s PRO 299 N -4.28 4.17 0.03 0.56 0.04 -1.26 -4.80 135.00 129.45 1aia s PRO 299 Ca 0.45 2.49 -0.04 0.00 0.04 0.00 0.00 61.00 63.94 1aia s PRO 299 Cb -0.10 -3.22 -0.28 0.00 0.04 0.00 0.00 34.50 30.93 1aia s PRO 299 CO 0.38 -0.71 0.97 0.00 0.04 0.00 0.00 177.00 177.68 1aia h ALA 300 N 7.19 0.18 0.27 8.56 0.00 -1.96 -3.38 119.26 130.12 1aia h ALA 300 Ca -0.43 -1.01 0.00 0.00 0.00 0.00 0.00 54.91 53.47 1aia h ALA 300 Cb 1.20 0.17 -0.02 0.00 0.00 0.00 0.00 17.79 19.15 1aia h ALA 300 CO 0.94 1.05 -0.27 1.25 0.00 0.00 0.00 179.25 182.22 1aia h HIS 301 N 0.07 -0.72 -0.15 0.00 -0.00 -1.93 0.87 115.15 113.30 1aia h HIS 301 Ca -0.20 0.00 0.01 0.00 -0.00 0.00 0.00 60.37 60.18 1aia h HIS 301 Cb 2.01 0.28 -0.01 0.00 -0.00 0.00 0.00 27.41 29.69 1aia h HIS 301 CO 0.07 -0.39 0.06 0.78 -0.00 0.00 0.00 177.93 178.45 1aia h GLY 302 N -0.57 0.18 2.00 5.26 0.00 -1.79 0.06 103.07 108.21 1aia h GLY 302 Ca -0.01 -0.04 -0.06 0.00 0.00 0.00 0.00 47.33 47.22 1aia h GLY 302 CO -0.06 0.04 -0.28 0.00 0.00 0.00 0.00 176.54 176.23 1aia h ALA 303 N 1.08 1.17 -0.40 3.60 0.00 -1.70 -1.76 119.26 121.25 1aia h ALA 303 Ca 0.06 -0.26 -0.10 0.00 0.00 0.00 0.00 54.91 54.61 1aia h ALA 303 Cb 0.02 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1aia h ALA 303 CO -0.05 0.36 -0.15 0.77 0.00 0.00 0.00 179.25 180.18 1aia h SER 304 N 0.00 0.81 -0.63 0.00 0.02 0.15 -1.83 113.55 112.07 1aia h SER 304 Ca -0.00 -0.39 0.03 0.00 -0.84 0.00 0.00 61.79 60.59 1aia h SER 304 Cb 0.67 -0.22 -0.04 0.00 0.14 0.00 0.00 62.40 62.94 1aia h SER 304 CO 0.04 1.02 0.39 0.58 -1.14 0.00 0.00 176.83 177.71 1aia h VAL 305 N 0.61 1.07 -0.36 2.27 2.07 -0.60 -1.24 116.25 120.07 1aia h VAL 305 Ca 0.09 -0.26 -0.05 0.00 0.82 0.00 0.00 66.70 67.30 1aia h VAL 305 Cb 0.69 0.24 -0.01 0.00 -1.52 0.00 0.00 31.29 30.69 1aia h VAL 305 CO 0.05 0.14 0.02 0.58 0.02 0.00 0.00 177.57 178.38 1aia h VAL 306 N 0.76 1.25 -0.34 2.57 2.07 -1.09 -2.16 116.25 119.31 1aia h VAL 306 Ca 0.26 -0.92 -0.07 0.00 0.82 0.00 0.00 66.70 66.79 1aia h VAL 306 Cb 0.04 1.15 -0.02 0.00 -1.52 0.00 0.00 31.29 30.94 1aia h VAL 306 CO -0.11 0.31 -0.08 0.00 0.02 0.00 0.00 177.57 177.70 1aia h ALA 307 N 0.88 1.23 0.12 1.67 0.00 -1.25 -1.29 119.26 120.61 1aia h ALA 307 Ca 0.10 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 1aia h ALA 307 Cb 0.42 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1aia h ALA 307 CO 0.01 0.50 -0.06 1.15 0.00 0.00 0.00 179.25 180.86 1aia h THR 308 N 0.53 1.05 -0.17 0.00 2.02 -0.79 -2.07 112.91 113.47 1aia h THR 308 Ca 0.10 -0.72 0.03 0.00 0.77 0.00 0.00 66.41 66.59 1aia h THR 308 Cb 0.46 1.50 -0.03 0.00 -1.74 0.00 0.00 68.15 68.35 1aia h THR 308 CO 0.02 0.17 -0.00 0.40 0.37 0.00 0.00 175.52 176.49 1aia h ILE 309 N -0.50 0.88 0.00 3.11 2.04 -1.37 -2.39 117.51 119.28 1aia h ILE 309 Ca -0.02 -0.02 -0.03 0.00 1.00 0.00 0.00 64.86 65.79 1aia h ILE 309 Cb 0.40 0.82 -0.00 0.00 -0.74 0.00 0.00 36.82 37.30 1aia h ILE 309 CO 0.03 0.01 -0.15 -0.07 0.00 0.00 0.00 178.15 177.97 1aia h LEU 310 N 0.06 0.00 0.00 1.44 3.38 -1.28 -2.82 115.31 116.09 1aia h LEU 310 Ca 0.08 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.88 1aia h LEU 310 Cb 0.10 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.83 1aia h LEU 310 CO -0.14 0.15 -0.83 0.28 0.09 0.00 0.00 178.44 177.99 1aia h SER 311 N 0.00 0.00 -3.45 -0.43 0.02 -0.94 -3.45 113.55 105.29 1aia h SER 311 Ca -0.00 0.00 -0.64 0.00 -0.84 0.00 0.00 61.79 60.31 1aia h SER 311 Cb 0.39 0.00 -0.20 0.00 0.14 0.00 0.00 62.40 62.73 1aia h SER 311 CO 0.02 0.79 -0.62 0.21 -1.14 0.00 0.00 176.83 176.09 1aia s ASN 312 N -6.57 5.19 0.45 3.07 3.84 -0.94 -5.01 114.94 114.97 1aia s ASN 312 Ca 0.02 -0.10 0.21 0.00 0.21 0.00 0.00 52.86 53.19 1aia s ASN 312 Cb 0.09 -1.90 1.08 0.00 -0.55 0.00 0.00 41.25 39.97 1aia s ASN 312 CO 0.79 0.08 1.94 0.44 -2.79 0.00 0.00 177.10 177.56 1aia h ASP 313 N 7.41 0.00 0.03 -4.21 3.32 -1.87 -0.92 116.42 120.18 1aia h ASP 313 Ca -0.36 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.69 1aia h ASP 313 Cb 1.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.73 1aia h ASP 313 CO 0.63 0.23 -0.01 0.00 -1.72 0.00 0.00 179.24 178.36 1aia h ALA 314 N 1.77 -0.04 -0.45 3.45 0.00 -1.95 -2.90 119.26 119.15 1aia h ALA 314 Ca -0.00 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.56 1aia h ALA 314 Cb 0.51 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 1aia h ALA 314 CO 0.03 -0.24 -0.03 -0.07 0.00 0.00 0.00 179.25 178.93 1aia h LEU 315 N -0.59 0.72 -1.56 0.00 3.38 -1.79 -2.42 115.31 113.05 1aia h LEU 315 Ca -0.00 -0.18 -0.00 0.00 0.09 0.00 0.00 57.88 57.78 1aia h LEU 315 Cb 0.55 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 41.10 1aia h LEU 315 CO 0.01 0.81 -0.02 -0.09 0.09 0.00 0.00 178.44 179.24 1aia h ARG 316 N 0.70 0.00 0.19 1.13 2.43 -1.03 -0.85 114.38 116.96 1aia h ARG 316 Ca 0.13 0.00 -0.29 0.00 -0.81 0.00 0.00 59.98 59.02 1aia h ARG 316 Cb 0.48 0.00 0.02 0.00 -0.42 0.00 0.00 29.97 30.05 1aia h ARG 316 CO 0.02 0.02 -1.31 0.00 -1.51 0.00 0.00 179.97 177.19 1aia h ALA 317 N 1.98 -0.05 -0.44 2.80 0.00 -1.22 -2.38 119.26 119.95 1aia h ALA 317 Ca -0.00 -0.89 -0.04 0.00 0.00 0.00 0.00 54.91 53.99 1aia h ALA 317 Cb 0.49 0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 1aia h ALA 317 CO 0.00 0.67 0.14 0.82 0.00 0.00 0.00 179.25 180.88 1aia h ILE 318 N -0.08 1.22 -0.14 0.00 2.04 -1.32 -2.54 117.51 116.68 1aia h ILE 318 Ca -0.24 -0.74 -0.00 0.00 1.00 0.00 0.00 64.86 64.88 1aia h ILE 318 Cb 1.94 0.86 -0.01 0.00 -0.74 0.00 0.00 36.82 38.88 1aia h ILE 318 CO 0.19 0.26 0.09 -0.25 0.00 0.00 0.00 178.15 178.44 1aia h TRP 319 N 0.58 0.18 -0.72 1.37 7.01 -1.21 -1.13 115.95 122.04 1aia h TRP 319 Ca 0.14 0.00 0.09 0.00 2.11 0.00 0.00 58.89 61.23 1aia h TRP 319 Cb 0.27 -0.06 -0.05 0.00 -2.10 0.00 0.00 29.16 27.22 1aia h TRP 319 CO 0.01 0.15 0.48 0.93 -2.79 0.00 0.00 178.44 177.22 1aia h GLU 320 N 0.16 0.64 -0.28 2.65 5.08 -1.39 0.28 114.58 121.73 1aia h GLU 320 Ca 0.05 -0.04 -0.16 0.00 -1.00 0.00 0.00 59.36 58.21 1aia h GLU 320 Cb 0.02 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.12 1aia h GLU 320 CO -0.01 0.42 -0.45 0.37 -1.00 0.00 0.00 179.01 178.34 1aia h GLN 321 N 0.66 0.79 -0.44 2.33 5.75 -0.97 0.40 115.11 123.63 1aia h GLN 321 Ca 0.33 -0.48 -0.04 0.00 -0.15 0.00 0.00 58.65 58.31 1aia h GLN 321 Cb 0.41 0.05 -0.02 0.00 1.07 0.00 0.00 27.48 28.99 1aia h GLN 321 CO -0.11 1.11 0.11 0.93 -2.65 0.00 0.00 178.83 178.22 1aia h GLU 322 N 0.55 0.65 -0.26 1.69 5.08 0.26 -1.33 114.58 121.22 1aia h GLU 322 Ca 0.02 -0.11 -0.19 0.00 -1.00 0.00 0.00 59.36 58.08 1aia h GLU 322 Cb 1.05 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.19 1aia h GLU 322 CO 0.10 0.59 -0.58 1.25 -1.00 0.00 0.00 179.01 179.37 1aia h LEU 323 N 0.64 0.94 -0.63 1.33 5.85 -0.31 -2.38 115.31 120.75 1aia h LEU 323 Ca 0.15 -0.52 0.03 0.00 0.84 0.00 0.00 57.88 58.37 1aia h LEU 323 Cb 0.23 -0.27 -0.04 0.00 0.37 0.00 0.00 40.66 40.95 1aia h LEU 323 CO -0.00 1.31 0.38 0.74 -0.34 0.00 0.00 178.44 180.53 1aia h THR 324 N 0.63 1.08 0.00 1.05 2.02 -0.30 -0.12 112.91 117.27 1aia h THR 324 Ca 0.00 -0.26 -0.09 0.00 0.77 0.00 0.00 66.41 66.84 1aia h THR 324 Cb 1.19 0.25 -0.01 0.00 -1.74 0.00 0.00 68.15 67.84 1aia h THR 324 CO 0.13 0.14 -0.42 0.44 0.37 0.00 0.00 175.52 176.18 1aia h ASP 325 N 0.76 0.00 -0.12 4.18 3.32 -1.20 0.17 116.42 123.53 1aia h ASP 325 Ca 0.25 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.26 1aia h ASP 325 Cb 0.02 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.57 1aia h ASP 325 CO -0.10 0.42 -0.08 0.24 -1.72 0.00 0.00 179.24 177.99 1aia h MET 326 N 0.00 0.26 -0.97 3.56 2.86 -0.87 -0.84 114.93 118.94 1aia h MET 326 Ca -0.00 -0.13 -0.00 0.00 -2.06 0.00 0.00 59.70 57.51 1aia h MET 326 Cb 0.84 -0.00 -0.05 0.00 0.06 0.00 0.00 31.60 32.45 1aia h MET 326 CO 0.05 0.64 0.60 -0.09 1.06 0.00 0.00 176.91 179.17 1aia h ARG 327 N -0.11 1.30 0.00 1.72 2.43 -0.56 -0.97 114.38 118.19 1aia h ARG 327 Ca 0.02 -0.11 -0.10 0.00 -0.81 0.00 0.00 59.98 58.99 1aia h ARG 327 Cb 0.57 -0.28 -0.01 0.00 -0.42 0.00 0.00 29.97 29.83 1aia h ARG 327 CO 0.02 0.89 -0.46 1.96 -1.51 0.00 0.00 179.97 180.88 1aia h GLN 328 N 1.33 0.00 -0.54 0.20 4.20 -0.66 -2.47 115.11 117.17 1aia h GLN 328 Ca 0.35 0.00 -0.11 0.00 0.06 0.00 0.00 58.65 58.95 1aia h GLN 328 Cb -0.09 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.68 1aia h GLN 328 CO -0.07 0.46 -0.08 -0.09 -0.67 0.00 0.00 178.83 178.38 1aia h ARG 329 N 0.00 1.01 -0.35 1.46 2.43 0.17 -2.00 114.38 117.09 1aia h ARG 329 Ca -0.00 -0.36 -0.04 0.00 -0.81 0.00 0.00 59.98 58.76 1aia h ARG 329 Cb 1.14 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 30.61 1aia h ARG 329 CO 0.06 1.05 0.06 0.82 -1.51 0.00 0.00 179.97 180.44 1aia h ILE 330 N 0.88 1.24 -1.01 1.20 2.04 -1.10 -1.86 117.51 118.90 1aia h ILE 330 Ca 0.14 -0.83 0.03 0.00 1.00 0.00 0.00 64.86 65.20 1aia h ILE 330 Cb 0.65 1.10 -0.06 0.00 -0.74 0.00 0.00 36.82 37.77 1aia h ILE 330 CO 0.04 0.28 0.66 1.56 0.00 0.00 0.00 178.15 180.69 1aia h GLN 331 N 0.41 1.27 -0.58 2.37 4.20 -1.41 -1.62 115.11 119.75 1aia h GLN 331 Ca 0.11 -0.08 -0.04 0.00 0.06 0.00 0.00 58.65 58.70 1aia h GLN 331 Cb 0.35 -0.29 -0.03 0.00 0.30 0.00 0.00 27.48 27.82 1aia h GLN 331 CO 0.01 0.84 0.21 0.00 -0.67 0.00 0.00 178.83 179.21 1aia h ARG 332 N 1.31 0.89 -0.26 1.46 3.08 -1.10 -2.70 114.38 117.05 1aia h ARG 332 Ca 0.39 -0.18 -0.12 0.00 0.07 0.00 0.00 59.98 60.15 1aia h ARG 332 Cb -0.05 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 29.85 1aia h ARG 332 CO -0.11 0.78 -0.33 0.52 -1.07 0.00 0.00 179.97 179.76 1aia h MET 333 N 0.81 0.56 -0.50 0.04 2.86 -0.62 0.02 114.93 118.10 1aia h MET 333 Ca 0.19 -0.25 0.04 0.00 -2.06 0.00 0.00 59.70 57.62 1aia h MET 333 Cb 0.24 -0.01 -0.04 0.00 0.06 0.00 0.00 31.60 31.85 1aia h MET 333 CO -0.01 0.82 0.26 0.00 1.06 0.00 0.00 176.91 179.04 1aia h ARG 334 N 0.47 0.49 0.13 1.72 3.08 -1.26 0.12 114.38 119.13 1aia h ARG 334 Ca 0.05 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.07 1aia h ARG 334 Cb 0.81 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.75 1aia h ARG 334 CO 0.07 0.32 -0.06 0.37 -1.07 0.00 0.00 179.97 179.60 1aia h GLN 335 N 0.50 -0.17 0.00 0.04 5.75 -1.17 -2.92 115.11 117.14 1aia h GLN 335 Ca 0.22 0.01 -0.04 0.00 -0.15 0.00 0.00 58.65 58.69 1aia h GLN 335 Cb 0.12 0.04 -0.01 0.00 1.07 0.00 0.00 27.48 28.70 1aia h GLN 335 CO -0.15 0.10 -0.20 1.25 -2.65 0.00 0.00 178.83 177.19 1aia h LEU 336 N -0.44 0.00 -0.15 -2.39 5.85 -0.83 -1.82 115.31 115.53 1aia h LEU 336 Ca -0.02 0.00 -0.07 0.00 0.84 0.00 0.00 57.88 58.63 1aia h LEU 336 Cb 0.35 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.38 1aia h LEU 336 CO 0.03 0.20 -0.17 0.15 -0.34 0.00 0.00 178.44 178.31 1aia h PHE 337 N 0.00 0.47 0.00 1.25 3.57 -0.72 -1.39 116.94 120.12 1aia h PHE 337 Ca -0.00 -0.15 -0.10 0.00 3.53 0.00 0.00 57.97 61.25 1aia h PHE 337 Cb 0.43 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 39.06 1aia h PHE 337 CO 0.00 0.79 -0.49 -0.39 -2.23 0.00 0.00 178.31 175.99 1aia h VAL 338 N 0.02 1.08 -0.16 1.41 -1.51 -1.27 -0.91 116.25 114.90 1aia h VAL 338 Ca 0.02 -1.85 -0.14 0.00 -1.23 0.00 0.00 66.70 63.50 1aia h VAL 338 Cb 0.72 2.08 0.00 0.00 -2.13 0.00 0.00 31.29 31.96 1aia h VAL 338 CO 0.04 0.48 -0.46 0.78 -1.23 0.00 0.00 177.57 177.18 1aia h ASN 339 N 0.00 0.68 -0.01 4.19 2.35 -1.35 -2.16 115.58 119.28 1aia h ASN 339 Ca -0.00 -0.59 -0.10 0.00 -0.55 0.00 0.00 56.30 55.06 1aia h ASN 339 Cb 1.04 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 39.20 1aia h ASN 339 CO 0.06 1.15 -0.27 0.74 -1.65 0.00 0.00 177.43 177.46 1aia h THR 340 N 0.25 1.27 -0.25 2.81 2.02 -1.16 -1.81 112.91 116.05 1aia h THR 340 Ca -0.01 -1.29 -0.00 0.00 0.77 0.00 0.00 66.41 65.87 1aia h THR 340 Cb 1.07 1.40 -0.01 0.00 -1.74 0.00 0.00 68.15 68.87 1aia h THR 340 CO 0.10 0.41 0.14 0.25 0.37 0.00 0.00 175.52 176.78 1aia h LEU 341 N 0.39 0.32 0.23 2.58 5.85 -1.13 0.74 115.31 124.28 1aia h LEU 341 Ca 0.06 -0.08 0.01 0.00 0.84 0.00 0.00 57.88 58.70 1aia h LEU 341 Cb 0.69 -0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.60 1aia h LEU 341 CO 0.05 0.31 -0.46 1.56 -0.34 0.00 0.00 178.44 179.56 1aia h GLN 342 N 0.30 -0.74 0.00 1.25 1.08 -1.05 -1.01 115.11 114.94 1aia h GLN 342 Ca 0.09 0.05 0.00 0.00 -1.45 0.00 0.00 58.65 57.34 1aia h GLN 342 Cb 0.06 0.17 0.00 0.00 -0.05 0.00 0.00 27.48 27.66 1aia h GLN 342 CO -0.01 -0.50 0.00 1.05 -0.95 0.00 0.00 178.83 178.42 1aia h GLU 343 N -0.77 0.00 -0.00 1.46 4.11 -1.30 -2.14 114.58 115.93 1aia h GLU 343 Ca -0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.42 1aia h GLU 343 Cb 0.75 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.00 1aia h GLU 343 CO -0.20 0.00 -0.24 1.17 0.07 0.00 0.00 179.01 179.81 1aia n LYS 344 N -2.70 0.11 0.00 1.06 0.00 0.25 -4.94 118.16 111.94 1aia n LYS 344 Ca 0.03 -0.04 0.00 0.00 0.00 0.00 0.00 58.31 58.30 1aia n LYS 344 Cb 0.36 -1.50 0.00 0.00 0.00 0.00 0.00 35.03 33.89 1aia n LYS 344 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1aia n GLY 345 N 1.47 1.90 3.73 3.14 0.00 -0.80 -5.01 105.19 109.63 1aia n GLY 345 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 1aia n GLY 345 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aia s ALA 346 N -2.00 3.45 -1.92 4.61 0.00 -0.45 -4.92 121.76 120.54 1aia s ALA 346 Ca 0.00 0.97 0.27 0.00 0.00 0.00 0.00 51.96 53.21 1aia s ALA 346 Cb 0.00 -3.43 0.91 0.00 0.00 0.00 0.00 23.12 20.60 1aia s ALA 346 CO 0.00 -0.41 1.66 0.27 0.00 0.00 0.00 175.76 177.28 1aia n ASN 347 N 2.71 1.05 -4.83 0.00 2.04 -1.26 -4.84 115.26 110.12 1aia n ASN 347 Ca 0.05 -0.99 -0.22 0.00 -0.44 0.00 0.00 54.58 52.98 1aia n ASN 347 Cb 0.44 0.07 -0.04 0.00 -2.53 0.00 0.00 39.78 37.72 1aia n ASN 347 CO 0.00 0.00 0.00 -0.13 -0.44 0.00 0.00 177.26 176.69 1aia s ARG 348 N -2.37 2.94 -0.32 -3.83 1.81 -1.26 -5.09 118.95 110.84 1aia s ARG 348 Ca 0.29 -1.05 -0.18 0.00 -1.72 0.00 0.00 55.73 53.07 1aia s ARG 348 Cb 0.20 -2.58 -0.01 0.00 -0.45 0.00 0.00 34.95 32.11 1aia s ARG 348 CO 0.47 0.39 0.50 0.34 -0.68 0.00 0.00 175.30 176.31 1aia s ASP 349 N -3.86 6.34 -0.11 0.23 2.15 -1.26 -4.95 116.67 115.21 1aia s ASP 349 Ca 0.33 0.16 0.16 0.00 0.43 0.00 0.00 52.55 53.63 1aia s ASP 349 Cb -0.08 -2.26 0.60 0.00 -0.30 0.00 0.00 42.92 40.87 1aia s ASP 349 CO 0.25 -0.39 1.51 0.49 -0.17 0.00 0.00 175.17 176.86 1aia n PHE 350 N 5.64 1.17 -0.45 -5.34 3.72 -1.26 -4.66 117.46 116.28 1aia n PHE 350 Ca -0.05 -0.66 0.37 0.00 -0.05 0.00 0.00 57.45 57.06 1aia n PHE 350 Cb 0.49 -0.23 0.66 0.00 -0.94 0.00 0.00 39.48 39.46 1aia n PHE 350 CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 1aia h SER 351 N 3.11 0.22 0.10 4.37 0.02 -1.94 -1.32 113.55 118.13 1aia h SER 351 Ca 0.00 0.11 -0.00 0.00 -0.84 0.00 0.00 61.79 61.05 1aia h SER 351 Cb 1.33 0.09 -0.00 0.00 0.14 0.00 0.00 62.40 63.96 1aia h SER 351 CO 0.19 -0.12 -0.02 2.19 -1.14 0.00 0.00 176.83 177.94 1aia h PHE 352 N 0.11 0.00 -0.86 3.45 -5.15 -1.95 -1.94 116.94 110.60 1aia h PHE 352 Ca 0.79 0.00 0.04 0.00 -0.20 0.00 0.00 57.97 58.60 1aia h PHE 352 Cb 2.55 0.00 -0.05 0.00 0.22 0.00 0.00 35.95 38.67 1aia h PHE 352 CO -0.00 0.02 0.56 0.82 -2.00 0.00 0.00 178.31 177.71 1aia h ILE 353 N 0.00 1.12 0.00 0.88 1.08 -1.60 -1.27 117.51 117.71 1aia h ILE 353 Ca -0.00 -0.35 -0.07 0.00 -0.39 0.00 0.00 64.86 64.05 1aia h ILE 353 Cb 0.08 -0.01 -0.01 0.00 -3.07 0.00 0.00 36.82 33.81 1aia h ILE 353 CO 0.00 0.19 -0.32 0.40 -0.69 0.00 0.00 178.15 177.73 1aia h ILE 354 N 1.03 1.15 0.00 -0.67 2.04 -1.55 -2.90 117.51 116.61 1aia h ILE 354 Ca 0.35 -1.12 -0.06 0.00 1.00 0.00 0.00 64.86 65.03 1aia h ILE 354 Cb 0.08 1.62 -0.01 0.00 -0.74 0.00 0.00 36.82 37.77 1aia h ILE 354 CO -0.11 0.31 -0.34 0.11 0.00 0.00 0.00 178.15 178.12 1aia h LYS 355 N 0.00 0.00 -7.26 2.37 1.57 -1.33 -3.47 116.57 108.45 1aia h LYS 355 Ca -0.00 0.00 -0.48 0.00 -1.87 0.00 0.00 60.65 58.30 1aia h LYS 355 Cb 0.59 0.00 0.07 0.00 0.08 0.00 0.00 32.23 32.97 1aia h LYS 355 CO 0.04 0.26 0.27 -0.65 -0.57 0.00 0.00 179.45 178.79 1aia s GLN 356 N -3.08 2.83 0.03 3.15 -0.21 -1.10 -4.96 119.66 116.32 1aia s GLN 356 Ca 0.05 0.14 0.06 0.00 0.02 0.00 0.00 55.36 55.63 1aia s GLN 356 Cb 0.07 -2.17 -0.02 0.00 1.00 0.00 0.00 33.01 31.88 1aia s GLN 356 CO 0.72 -0.87 -0.19 -0.80 -2.12 0.00 0.00 175.29 172.03 1aia s ASN 357 N -4.34 2.23 0.00 5.90 0.02 0.98 -5.00 114.94 114.72 1aia s ASN 357 Ca 0.56 -0.46 0.00 0.00 -1.02 0.00 0.00 52.86 51.94 1aia s ASN 357 Cb -0.11 -0.19 0.00 0.00 0.02 0.00 0.00 41.25 40.97 1aia s ASN 357 CO 0.47 0.15 0.00 0.61 0.02 0.00 0.00 177.10 178.36 1aia n GLY 358 N 2.06 -1.36 0.16 0.66 0.00 -1.22 -4.47 105.19 101.02 1aia n GLY 358 Ca -0.17 -1.29 0.03 0.00 0.00 0.00 0.00 46.02 44.59 1aia n GLY 358 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1aia h MET 359 N 0.00 0.00 -6.05 1.61 2.86 -1.93 -3.46 114.93 107.95 1aia h MET 359 Ca 0.00 0.00 -0.67 0.00 -2.06 0.00 0.00 59.70 56.97 1aia h MET 359 Cb 0.00 0.00 -0.13 0.00 0.06 0.00 0.00 31.60 31.53 1aia h MET 359 CO 0.00 0.50 -0.62 -0.06 1.06 0.00 0.00 176.91 177.79 1aia s PHE 360 N -3.40 3.16 0.01 -0.22 0.08 -1.26 0.07 117.98 116.42 1aia s PHE 360 Ca 0.01 0.15 -0.10 0.00 0.12 0.00 0.00 56.93 57.12 1aia s PHE 360 Cb 0.10 -1.73 0.01 0.00 -0.57 0.00 0.00 43.02 40.83 1aia s PHE 360 CO 0.72 0.49 0.19 -1.12 -0.10 0.00 0.00 175.22 175.40 1aia s SER 361 N -1.33 -0.01 -0.11 1.36 0.01 -1.00 -3.61 113.70 109.00 1aia s SER 361 Ca 0.18 -0.21 -0.27 0.00 1.31 0.00 0.00 55.95 56.95 1aia s SER 361 Cb -0.12 0.26 -0.02 0.00 0.21 0.00 0.00 66.02 66.35 1aia s SER 361 CO 0.08 -0.46 0.91 -0.36 0.41 0.00 0.00 173.24 173.82 1aia s PHE 362 N -1.82 3.50 0.16 2.43 0.08 -1.24 -1.32 117.98 119.77 1aia s PHE 362 Ca -0.11 1.45 0.33 0.00 0.12 0.00 0.00 56.93 58.71 1aia s PHE 362 Cb -0.05 -3.08 1.39 0.00 -0.57 0.00 0.00 43.02 40.71 1aia s PHE 362 CO 0.00 -0.18 2.00 0.66 -0.10 0.00 0.00 175.22 177.60 1aia h SER 363 N 7.11 0.00 0.00 1.36 4.64 -1.67 -3.47 113.55 121.52 1aia h SER 363 Ca -0.32 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.00 1aia h SER 363 Cb 1.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 1aia h SER 363 CO 0.83 0.04 0.00 0.61 -0.87 0.00 0.00 176.83 177.44 1aia n GLY 364 N -0.06 0.52 3.93 -0.77 0.00 -1.26 -5.07 105.19 102.48 1aia n GLY 364 Ca 0.00 -0.82 -0.29 0.00 0.00 0.00 0.00 46.02 44.91 1aia n GLY 364 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1aia s LEU 365 N 0.00 4.32 0.69 0.99 1.02 -1.26 -5.10 118.68 119.34 1aia s LEU 365 Ca 0.00 0.29 -0.11 0.00 0.02 0.00 0.00 54.13 54.33 1aia s LEU 365 Cb 0.00 -3.02 0.01 0.00 0.02 0.00 0.00 46.19 43.20 1aia s LEU 365 CO 0.00 0.08 1.07 0.42 0.02 0.00 0.00 176.35 177.94 1aia s THR 366 N -1.67 3.55 0.39 5.49 -4.23 -1.26 -4.67 115.64 113.24 1aia s THR 366 Ca 0.36 0.44 0.16 0.00 -1.18 0.00 0.00 61.69 61.47 1aia s THR 366 Cb -0.12 -3.49 0.37 0.00 1.34 0.00 0.00 72.50 70.60 1aia s THR 366 CO 0.28 -0.63 1.82 0.50 -0.54 0.00 0.00 174.62 176.05 1aia h LYS 367 N -0.58 0.45 0.00 3.99 3.64 -1.95 -0.74 116.57 121.38 1aia h LYS 367 Ca -0.45 -0.03 -0.16 0.00 -1.27 0.00 0.00 60.65 58.75 1aia h LYS 367 Cb 1.25 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.95 1aia h LYS 367 CO 0.63 0.30 -0.96 0.93 -2.27 0.00 0.00 179.45 178.08 1aia h GLU 368 N 0.46 0.00 -0.21 1.90 3.07 -1.92 -2.27 114.58 115.61 1aia h GLU 368 Ca 0.52 0.00 -0.21 0.00 -0.50 0.00 0.00 59.36 59.17 1aia h GLU 368 Cb 1.23 0.00 0.01 0.00 -0.84 0.00 0.00 28.75 29.14 1aia h GLU 368 CO -0.24 0.52 -0.69 1.96 -1.40 0.00 0.00 179.01 179.16 1aia h GLN 369 N 0.00 0.82 -0.12 2.33 4.20 -1.60 -2.58 115.11 118.17 1aia h GLN 369 Ca -0.07 -0.61 -0.14 0.00 0.06 0.00 0.00 58.65 57.89 1aia h GLN 369 Cb 1.56 0.11 -0.01 0.00 0.30 0.00 0.00 27.48 29.43 1aia h GLN 369 CO 0.07 1.22 -0.54 -0.39 -0.67 0.00 0.00 178.83 178.53 1aia h VAL 370 N 0.59 1.35 0.06 -0.54 -1.51 -1.16 -1.30 116.25 113.73 1aia h VAL 370 Ca -0.03 -1.81 -0.00 0.00 -1.23 0.00 0.00 66.70 63.63 1aia h VAL 370 Cb 1.31 1.85 0.00 0.00 -2.13 0.00 0.00 31.29 32.32 1aia h VAL 370 CO 0.14 0.55 -0.03 0.25 -1.23 0.00 0.00 177.57 177.25 1aia h LEU 371 N 0.26 -0.06 -0.95 4.19 6.46 -1.44 -2.05 115.31 121.72 1aia h LEU 371 Ca 0.01 -0.11 -0.05 0.00 -0.12 0.00 0.00 57.88 57.61 1aia h LEU 371 Cb 1.03 0.02 -0.03 0.00 -0.73 0.00 0.00 40.66 40.95 1aia h LEU 371 CO 0.09 0.07 0.18 -0.09 -0.62 0.00 0.00 178.44 178.07 1aia h ARG 372 N -0.19 0.95 -0.78 1.25 2.43 -1.44 -0.17 114.38 116.44 1aia h ARG 372 Ca -0.01 -0.19 0.12 0.00 -0.81 0.00 0.00 59.98 59.10 1aia h ARG 372 Cb 0.17 -0.14 -0.09 0.00 -0.42 0.00 0.00 29.97 29.49 1aia h ARG 372 CO 0.01 0.82 0.38 1.25 -1.51 0.00 0.00 179.97 180.92 1aia h LEU 373 N 0.92 0.45 -0.04 3.80 5.85 -1.10 0.30 115.31 125.49 1aia h LEU 373 Ca 0.20 0.08 -0.20 0.00 0.84 0.00 0.00 57.88 58.81 1aia h LEU 373 Cb 0.28 0.01 0.01 0.00 0.37 0.00 0.00 40.66 41.34 1aia h LEU 373 CO -0.01 0.22 -0.74 -0.09 -0.34 0.00 0.00 178.44 177.48 1aia h ARG 374 N 0.58 0.58 0.00 1.25 2.43 -0.59 -2.71 114.38 115.92 1aia h ARG 374 Ca 0.41 -0.56 -0.01 0.00 -0.81 0.00 0.00 59.98 59.01 1aia h ARG 374 Cb 0.53 0.15 -0.00 0.00 -0.42 0.00 0.00 29.97 30.23 1aia h ARG 374 CO -0.33 1.18 -0.14 0.93 -1.51 0.00 0.00 179.97 180.10 1aia h GLU 375 N 0.18 0.00 0.00 0.20 4.39 -0.90 -3.26 114.58 115.19 1aia h GLU 375 Ca -0.08 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.62 1aia h GLU 375 Cb 1.41 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.06 1aia h GLU 375 CO 0.15 0.19 0.00 0.39 -1.16 0.00 0.00 179.01 178.58 1aia n GLU 376 N -4.71 0.20 0.00 2.33 4.71 0.10 -4.65 120.64 118.63 1aia n GLU 376 Ca -0.04 0.14 0.00 0.00 -0.01 0.00 0.00 57.16 57.25 1aia n GLU 376 Cb 0.15 -1.50 0.00 0.00 -1.01 0.00 0.00 31.44 29.08 1aia n GLU 376 CO 0.00 0.00 0.00 1.19 0.09 0.00 0.00 177.13 178.41 1aia n PHE 377 N -1.23 0.00 0.00 -0.32 3.01 -1.03 -5.00 117.46 112.89 1aia n PHE 377 Ca 0.06 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.52 1aia n PHE 377 Cb 0.08 -0.15 0.00 0.00 -0.01 0.00 0.00 39.48 39.40 1aia n PHE 377 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1aia n GLY 378 N 1.72 2.32 3.69 1.37 0.00 -1.17 -4.78 105.19 108.34 1aia n GLY 378 Ca 0.00 -0.77 -0.42 0.00 0.00 0.00 0.00 46.02 44.83 1aia n GLY 378 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1aia s VAL 379 N 0.00 4.79 -0.18 1.61 1.01 -1.17 -3.07 120.40 123.39 1aia s VAL 379 Ca 0.00 2.03 -0.05 0.00 0.00 0.00 0.00 61.98 63.96 1aia s VAL 379 Cb 0.00 -4.31 -0.03 0.00 0.00 0.00 0.00 36.38 32.04 1aia s VAL 379 CO 0.00 0.01 0.01 -0.31 0.00 0.00 0.00 175.10 174.81 1aia s TYR 380 N 1.99 3.10 0.08 5.22 1.51 0.19 -2.76 117.35 126.68 1aia s TYR 380 Ca 0.48 -0.22 -0.01 0.00 -1.01 0.00 0.00 57.07 56.31 1aia s TYR 380 Cb -0.18 -2.05 -0.04 0.00 -0.11 0.00 0.00 41.96 39.58 1aia s TYR 380 CO 0.18 -0.04 -0.01 0.00 -1.11 0.00 0.00 175.55 174.56 1aia s ALA 381 N 0.60 0.67 0.36 3.71 0.00 -1.26 -0.36 121.76 125.48 1aia s ALA 381 Ca 0.00 -1.30 -0.28 0.00 0.00 0.00 0.00 51.96 50.38 1aia s ALA 381 Cb -0.14 0.41 -0.10 0.00 0.00 0.00 0.00 23.12 23.30 1aia s ALA 381 CO 0.02 -0.38 1.30 0.08 0.00 0.00 0.00 175.76 176.78 1aia s VAL 382 N -3.91 2.69 0.56 0.00 1.01 -1.14 -4.85 120.40 114.76 1aia s VAL 382 Ca 0.12 0.67 0.33 0.00 0.00 0.00 0.00 61.98 63.10 1aia s VAL 382 Cb 0.08 -3.41 0.49 0.00 0.00 0.00 0.00 36.38 33.53 1aia s VAL 382 CO -0.06 0.14 1.79 0.00 0.00 0.00 0.00 175.10 176.97 1aia h ALA 383 N 3.13 2.85 0.00 5.51 0.00 -1.91 -0.01 119.26 128.83 1aia h ALA 383 Ca -0.49 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.38 1aia h ALA 383 Cb 1.23 0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1aia h ALA 383 CO 0.64 -1.27 0.00 -1.13 0.00 0.00 0.00 179.25 177.49 1aia n SER 384 N -4.00 0.41 0.00 0.00 3.41 -1.26 -4.36 113.62 107.82 1aia n SER 384 Ca 0.20 0.63 0.00 0.00 -0.26 0.00 0.00 58.87 59.44 1aia n SER 384 Cb 1.10 -0.70 0.00 0.00 -0.26 0.00 0.00 64.21 64.35 1aia n SER 384 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1aia n GLY 385 N -0.43 0.62 3.71 5.00 0.00 -0.02 -4.90 105.19 109.17 1aia n GLY 385 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 1aia n GLY 385 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1aia s ARG 386 N -0.79 4.27 -0.01 1.61 3.52 -1.25 -1.68 118.95 124.63 1aia s ARG 386 Ca 0.00 2.20 0.07 0.00 -0.13 0.00 0.00 55.73 57.87 1aia s ARG 386 Cb 0.00 -3.25 -0.02 0.00 -1.56 0.00 0.00 34.95 30.12 1aia s ARG 386 CO 0.00 -0.53 -0.22 0.08 -0.81 0.00 0.00 175.30 173.82 1aia s VAL 387 N 1.29 1.75 -0.45 7.11 1.01 -0.44 -2.87 120.40 127.80 1aia s VAL 387 Ca 0.67 -0.98 -0.16 0.00 0.00 0.00 0.00 61.98 61.51 1aia s VAL 387 Cb -0.39 -1.46 0.05 0.00 0.00 0.00 0.00 36.38 34.58 1aia s VAL 387 CO 0.31 0.46 0.42 0.21 0.00 0.00 0.00 175.10 176.50 1aia s ASN 388 N -0.61 6.16 0.56 3.32 3.84 0.14 -2.38 114.94 125.98 1aia s ASN 388 Ca 0.09 -1.04 0.24 0.00 0.21 0.00 0.00 52.86 52.36 1aia s ASN 388 Cb -0.09 -2.20 1.56 0.00 -0.55 0.00 0.00 41.25 39.97 1aia s ASN 388 CO -0.00 -0.63 2.17 0.58 -2.79 0.00 0.00 177.10 176.42 1aia h VAL 389 N 5.74 0.70 0.00 -5.21 2.07 -0.69 -1.81 116.25 117.06 1aia h VAL 389 Ca -0.28 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.24 1aia h VAL 389 Cb 1.11 0.95 0.00 0.00 -1.52 0.00 0.00 31.29 31.83 1aia h VAL 389 CO 0.84 0.00 0.00 0.00 0.02 0.00 0.00 177.57 178.43 1aia n ALA 390 N -2.43 1.94 1.27 1.67 0.00 -1.26 -2.01 120.51 119.69 1aia n ALA 390 Ca -0.01 -0.08 0.13 0.00 0.00 0.00 0.00 53.44 53.48 1aia n ALA 390 Cb 0.17 -1.26 0.39 0.00 0.00 0.00 0.00 19.45 18.75 1aia n ALA 390 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1aia n GLY 391 N 0.04 -0.50 3.82 0.00 0.00 -0.68 -3.61 105.19 104.26 1aia n GLY 391 Ca 0.09 -0.42 -0.37 0.00 0.00 0.00 0.00 46.02 45.32 1aia n GLY 391 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1aia s MET 392 N -2.43 3.90 0.26 1.61 -1.94 -0.85 -4.84 119.30 115.01 1aia s MET 392 Ca 0.26 0.21 0.05 0.00 -1.71 0.00 0.00 55.69 54.50 1aia s MET 392 Cb 0.19 -3.27 -0.06 0.00 2.01 0.00 0.00 34.83 33.71 1aia s MET 392 CO 0.49 0.58 -0.02 0.95 -0.01 0.00 0.00 175.02 177.02 1aia s THR 393 N -0.63 1.32 0.49 2.05 -4.23 -1.26 -4.94 115.64 108.44 1aia s THR 393 Ca 0.20 -2.07 0.22 0.00 -1.18 0.00 0.00 61.69 58.86 1aia s THR 393 Cb -0.15 -2.45 0.27 0.00 1.34 0.00 0.00 72.50 71.52 1aia s THR 393 CO 0.09 -0.27 2.11 -0.65 -0.54 0.00 0.00 174.62 175.36 1aia h PRO 394 N 2.34 0.00 0.09 3.99 0.11 -1.99 -1.22 132.00 135.33 1aia h PRO 394 Ca -0.39 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.71 1aia h PRO 394 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1aia h PRO 394 CO 0.66 0.08 -0.04 -0.44 -0.21 0.00 0.00 178.00 178.06 1aia h ASP 395 N 0.00 -0.10 -0.20 -2.05 3.32 -1.95 -3.22 116.42 112.21 1aia h ASP 395 Ca -0.00 -0.42 0.00 0.00 0.02 0.00 0.00 57.03 56.63 1aia h ASP 395 Cb 0.18 0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.76 1aia h ASP 395 CO 0.01 0.40 0.00 -0.46 -1.72 0.00 0.00 179.24 177.47 1aia n ASN 396 N -4.91 1.47 -0.04 6.45 0.23 -1.08 -4.32 115.26 113.06 1aia n ASN 396 Ca -0.08 -1.78 -0.12 0.00 -0.53 0.00 0.00 54.58 52.06 1aia n ASN 396 Cb 0.26 -0.13 -0.06 0.00 -2.08 0.00 0.00 39.78 37.77 1aia n ASN 396 CO 0.00 0.00 0.00 -0.03 -0.93 0.00 0.00 177.26 176.30 1aia h MET 397 N 1.81 0.21 -0.02 -3.83 4.05 -1.23 -2.99 114.93 112.94 1aia h MET 397 Ca 0.00 -0.06 -0.00 0.00 -0.28 0.00 0.00 59.70 59.35 1aia h MET 397 Cb 0.40 -0.02 -0.00 0.00 -0.80 0.00 0.00 31.60 31.18 1aia h MET 397 CO 0.00 0.44 -0.00 0.00 0.23 0.00 0.00 176.91 177.58 1aia h ALA 398 N 0.76 0.02 -0.24 0.39 0.00 -1.79 -1.83 119.26 116.58 1aia h ALA 398 Ca 0.04 -0.18 0.07 0.00 0.00 0.00 0.00 54.91 54.83 1aia h ALA 398 Cb 0.34 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 1aia h ALA 398 CO 0.00 -0.29 0.29 -1.00 0.00 0.00 0.00 179.25 178.26 1aia h PRO 399 N -0.31 0.00 0.03 0.00 0.13 -1.85 0.68 132.00 130.68 1aia h PRO 399 Ca 0.00 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1aia h PRO 399 Cb 0.36 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.49 1aia h PRO 399 CO 0.00 0.00 -0.02 1.25 -0.23 0.00 0.00 178.00 179.01 1aia h LEU 400 N 0.00 -0.04 -1.59 1.56 6.46 -1.32 -2.58 115.31 117.80 1aia h LEU 400 Ca 0.11 -0.65 -0.04 0.00 -0.12 0.00 0.00 57.88 57.18 1aia h LEU 400 Cb 0.70 0.01 -0.01 0.00 -0.73 0.00 0.00 40.66 40.63 1aia h LEU 400 CO -0.00 0.68 -0.16 0.00 -0.62 0.00 0.00 178.44 178.34 1aia h GLU 402 N 0.06 -0.64 -0.88 0.00 4.57 -0.88 -1.12 114.58 115.71 1aia h GLU 402 Ca 0.01 0.04 0.02 0.00 -1.18 0.00 0.00 59.36 58.26 1aia h GLU 402 Cb 0.32 0.14 -0.05 0.00 -0.16 0.00 0.00 28.75 29.01 1aia h GLU 402 CO 0.02 -0.38 0.58 0.00 -1.18 0.00 0.00 179.01 178.05 1aia h ALA 403 N -0.28 1.42 -0.22 2.92 0.00 -1.22 -1.17 119.26 120.71 1aia h ALA 403 Ca -0.07 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.70 1aia h ALA 403 Cb 0.55 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 1aia h ALA 403 CO 0.11 0.51 -0.23 0.82 0.00 0.00 0.00 179.25 180.46 1aia h ILE 404 N 1.14 1.32 -0.85 0.00 2.04 -1.14 -3.04 117.51 116.98 1aia h ILE 404 Ca 0.34 -1.41 0.05 0.00 1.00 0.00 0.00 64.86 64.84 1aia h ILE 404 Cb -0.05 1.73 -0.06 0.00 -0.74 0.00 0.00 36.82 37.71 1aia h ILE 404 CO -0.09 0.43 0.54 0.58 0.00 0.00 0.00 178.15 179.61 1aia h VAL 405 N 0.23 1.08 0.00 1.67 2.07 -1.01 -2.27 116.25 118.02 1aia h VAL 405 Ca 0.03 -0.34 0.00 0.00 0.82 0.00 0.00 66.70 67.21 1aia h VAL 405 Cb 0.79 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.55 1aia h VAL 405 CO 0.06 0.18 0.09 0.00 0.02 0.00 0.00 177.57 177.92 1aia h ALA 407 N 1.38 1.08 -0.00 1.67 0.00 -1.10 -2.91 119.26 119.37 1aia h ALA 407 Ca 0.36 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.27 1aia h ALA 407 Cb 0.11 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1aia h ALA 407 CO -0.15 -0.08 -0.09 1.33 0.00 0.00 0.00 179.25 180.26 1aia n VAL 408 N -2.54 0.00 1.32 0.00 0.24 -0.86 -5.07 118.33 111.41 1aia n VAL 408 Ca -0.02 -0.46 0.11 0.00 -2.04 0.00 0.00 64.34 61.93 1aia n VAL 408 Cb 0.14 1.08 0.63 0.00 -1.47 0.00 0.00 33.84 34.22 1aia n VAL 408 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87