#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1aib n PHE 6 N 0.00 0.13 -0.32 1.12 3.72 -1.26 -4.59 117.46 116.27 1aib n PHE 6 Ca 0.00 -0.07 0.13 0.00 -0.05 0.00 0.00 57.45 57.46 1aib n PHE 6 Cb 0.00 -0.00 0.36 0.00 -0.94 0.00 0.00 39.48 38.90 1aib n PHE 6 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 1aib h GLU 7 N 4.35 0.70 -0.11 -1.08 3.07 -2.12 -2.83 114.58 116.55 1aib h GLU 7 Ca 0.00 -0.04 -0.11 0.00 -0.50 0.00 0.00 59.36 58.71 1aib h GLU 7 Cb 0.94 -0.16 -0.13 0.00 -0.84 0.00 0.00 28.75 28.56 1aib h GLU 7 CO 0.00 0.46 -0.64 -1.71 -1.40 0.00 0.00 179.01 175.72 1aib n ASN 8 N -4.64 2.03 -4.71 1.42 2.85 -1.26 -4.99 115.26 105.95 1aib n ASN 8 Ca 0.21 -3.55 -0.41 0.00 -0.11 0.00 0.00 54.58 50.71 1aib n ASN 8 Cb 0.54 -0.47 -0.04 0.00 1.24 0.00 0.00 39.78 41.06 1aib n ASN 8 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 1aib s ILE 9 N -2.95 4.91 0.21 -1.44 1.01 -1.07 -5.03 121.20 116.84 1aib s ILE 9 Ca 0.39 1.87 -0.14 0.00 0.00 0.00 0.00 60.65 62.77 1aib s ILE 9 Cb 0.38 -4.23 -0.08 0.00 0.01 0.00 0.00 42.46 38.54 1aib s ILE 9 CO -0.07 0.19 0.62 0.42 0.00 0.00 0.00 174.94 176.10 1aib s THR 10 N 0.91 4.79 -0.15 2.92 -4.23 -1.26 -5.01 115.64 113.60 1aib s THR 10 Ca 0.47 0.85 0.00 0.00 -1.18 0.00 0.00 61.69 61.84 1aib s THR 10 Cb -0.20 -3.71 0.00 0.00 1.34 0.00 0.00 72.50 69.93 1aib s THR 10 CO 0.25 0.08 0.56 0.00 -0.54 0.00 0.00 174.62 174.97 1aib n ALA 11 N 0.35 0.15 -1.98 3.99 0.00 -1.26 -4.98 120.51 116.78 1aib n ALA 11 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1aib n ALA 11 Cb 0.52 -0.15 0.00 0.00 0.00 0.00 0.00 19.45 19.82 1aib n ALA 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1aib n ALA 12 N -1.06 -1.76 -1.76 0.00 0.00 -1.26 -4.93 120.51 109.74 1aib n ALA 12 Ca 0.00 0.38 -0.38 0.00 0.00 0.00 0.00 53.44 53.44 1aib n ALA 12 Cb 0.42 -1.26 0.02 0.00 0.00 0.00 0.00 19.45 18.62 1aib n ALA 12 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1aib s PRO 13 N -0.51 3.43 0.34 0.00 0.04 -1.26 -4.96 135.00 132.09 1aib s PRO 13 Ca 0.00 2.03 -0.29 0.00 0.04 0.00 0.00 61.00 62.79 1aib s PRO 13 Cb 0.00 -2.33 -0.10 0.00 0.04 0.00 0.00 34.50 32.10 1aib s PRO 13 CO 0.00 -0.89 1.36 0.00 0.04 0.00 0.00 177.00 177.50 1aib s ALA 14 N -1.41 3.52 0.26 8.56 0.00 -1.26 -4.94 121.76 126.48 1aib s ALA 14 Ca 0.68 1.34 -0.30 0.00 0.00 0.00 0.00 51.96 53.68 1aib s ALA 14 Cb -0.35 -3.51 -0.10 0.00 0.00 0.00 0.00 23.12 19.16 1aib s ALA 14 CO 0.42 -0.75 1.39 0.34 0.00 0.00 0.00 175.76 177.16 1aib s ASP 15 N -0.38 6.73 0.22 0.00 2.15 -1.26 -4.92 116.67 119.21 1aib s ASP 15 Ca 0.50 2.62 -0.08 0.00 0.43 0.00 0.00 52.55 56.02 1aib s ASP 15 Cb -0.41 -2.63 0.35 0.00 -0.30 0.00 0.00 42.92 39.93 1aib s ASP 15 CO 0.55 -0.63 1.70 1.55 -0.17 0.00 0.00 175.17 178.17 1aib h PRO 16 N 4.76 0.26 0.00 4.34 0.13 -2.00 -2.44 132.00 137.05 1aib h PRO 16 Ca -0.46 -0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 64.64 1aib h PRO 16 Cb 1.22 -0.06 -0.00 0.00 0.13 0.00 0.00 31.00 32.29 1aib h PRO 16 CO 0.75 0.17 -0.12 0.82 -0.23 0.00 0.00 178.00 179.39 1aib h ILE 17 N 0.27 0.39 -0.93 -3.56 1.08 -1.94 -3.40 117.51 109.42 1aib h ILE 17 Ca 0.35 -1.32 0.03 0.00 -0.39 0.00 0.00 64.86 63.54 1aib h ILE 17 Cb 0.55 0.77 -0.05 0.00 -3.07 0.00 0.00 36.82 35.01 1aib h ILE 17 CO -0.44 0.13 0.61 -0.07 -0.69 0.00 0.00 178.15 177.69 1aib h LEU 18 N -1.00 1.01 -1.29 1.44 4.07 -1.93 -3.08 115.31 114.52 1aib h LEU 18 Ca -0.02 -0.01 -0.00 0.00 0.08 0.00 0.00 57.88 57.93 1aib h LEU 18 Cb 0.32 -0.23 -0.00 0.00 1.08 0.00 0.00 40.66 41.83 1aib h LEU 18 CO -0.01 0.69 -0.01 1.23 -1.08 0.00 0.00 178.44 179.27 1aib h GLY 19 N 1.18 0.00 2.00 0.83 0.00 -1.66 -2.75 103.07 102.67 1aib h GLY 19 Ca 0.37 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.61 1aib h GLY 19 CO -0.12 0.00 -0.43 -2.00 0.00 0.00 0.00 176.54 173.99 1aib h LEU 20 N 0.00 0.00 -0.28 3.11 7.12 -1.75 -2.89 115.31 120.62 1aib h LEU 20 Ca -0.00 0.00 0.05 0.00 0.13 0.00 0.00 57.88 58.06 1aib h LEU 20 Cb 0.57 0.00 -0.05 0.00 -0.53 0.00 0.00 40.66 40.65 1aib h LEU 20 CO 0.00 0.43 -0.05 0.00 -0.13 0.00 0.00 178.44 178.69 1aib h ALA 21 N 1.57 0.21 -0.54 1.25 0.00 -1.64 -1.51 119.26 118.60 1aib h ALA 21 Ca -0.00 0.10 0.04 0.00 0.00 0.00 0.00 54.91 55.05 1aib h ALA 21 Cb 0.83 0.19 -0.04 0.00 0.00 0.00 0.00 17.79 18.77 1aib h ALA 21 CO 0.06 -0.45 0.29 -0.44 0.00 0.00 0.00 179.25 178.70 1aib h ASP 22 N 0.03 0.43 -0.50 0.00 3.32 -1.66 -0.99 116.42 117.05 1aib h ASP 22 Ca 0.14 0.02 0.07 0.00 0.02 0.00 0.00 57.03 57.28 1aib h ASP 22 Cb 0.20 -0.06 -0.03 0.00 0.22 0.00 0.00 39.33 39.66 1aib h ASP 22 CO -0.27 0.29 0.34 0.25 -1.72 0.00 0.00 179.24 178.13 1aib h LEU 23 N 0.56 0.36 0.23 1.55 6.46 -1.42 -0.30 115.31 122.74 1aib h LEU 23 Ca 0.23 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.98 1aib h LEU 23 Cb 0.12 -0.07 0.00 0.00 -0.73 0.00 0.00 40.66 39.98 1aib h LEU 23 CO -0.15 0.23 -0.11 0.15 -0.62 0.00 0.00 178.44 177.94 1aib h PHE 24 N 0.40 -0.29 -0.49 1.25 3.57 -0.49 -2.64 116.94 118.25 1aib h PHE 24 Ca 0.22 -0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.79 1aib h PHE 24 Cb 0.35 0.10 -0.10 0.00 2.79 0.00 0.00 35.95 39.09 1aib h PHE 24 CO -0.00 -0.18 -0.42 -0.09 -2.23 0.00 0.00 178.31 175.39 1aib h ARG 25 N -0.71 -0.26 0.00 1.11 2.43 -0.96 -0.01 114.38 115.98 1aib h ARG 25 Ca -0.03 0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1aib h ARG 25 Cb 0.24 0.06 0.00 0.00 -0.42 0.00 0.00 29.97 29.85 1aib h ARG 25 CO 0.05 -0.17 0.00 0.00 -1.51 0.00 0.00 179.97 178.34 1aib n ALA 26 N -3.11 1.44 0.36 2.80 0.00 -0.15 -3.35 120.51 118.51 1aib n ALA 26 Ca 0.01 -0.03 0.12 0.00 0.00 0.00 0.00 53.44 53.54 1aib n ALA 26 Cb 0.35 -1.15 0.25 0.00 0.00 0.00 0.00 19.45 18.90 1aib n ALA 26 CO 0.00 0.00 0.00 0.38 0.00 0.00 0.00 177.50 177.88 1aib h ASP 27 N 0.00 0.00 -6.71 0.00 2.03 -0.60 -3.48 116.42 107.66 1aib h ASP 27 Ca 0.00 -0.00 -0.30 0.00 -0.73 0.00 0.00 57.03 56.00 1aib h ASP 27 Cb 0.15 0.00 -0.05 0.00 -0.83 0.00 0.00 39.33 38.60 1aib h ASP 27 CO 0.00 0.00 -0.49 -1.84 -1.03 0.00 0.00 179.24 175.88 1aib n GLU 28 N -2.81 -0.77 -3.12 4.15 0.28 -1.21 -4.98 120.64 112.17 1aib n GLU 28 Ca 0.05 -0.12 -0.24 0.00 -0.16 0.00 0.00 57.16 56.69 1aib n GLU 28 Cb 0.50 -1.16 -0.00 0.00 1.43 0.00 0.00 31.44 32.20 1aib n GLU 28 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 177.13 177.47 1aib s ARG 29 N -5.79 3.30 0.00 3.44 6.06 -1.26 -5.13 118.95 119.57 1aib s ARG 29 Ca 0.14 -0.35 0.00 0.00 -2.50 0.00 0.00 55.73 53.02 1aib s ARG 29 Cb -0.08 -2.59 0.00 0.00 0.06 0.00 0.00 34.95 32.34 1aib s ARG 29 CO 0.49 -0.08 0.00 -2.30 -2.50 0.00 0.00 175.30 170.91 1aib n PRO 30 N -1.97 0.00 0.00 5.12 -0.02 -1.26 -4.51 135.00 132.36 1aib n PRO 30 Ca -0.01 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.47 1aib n PRO 30 Cb 0.57 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.05 1aib n PRO 30 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1aib n GLY 31 N 0.00 0.93 3.43 -1.23 0.00 -1.26 -4.94 105.19 102.13 1aib n GLY 31 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 1aib n GLY 31 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1aib n LYS 32 N 0.00 0.46 -5.09 1.61 2.85 -1.26 -4.89 118.16 111.84 1aib n LYS 32 Ca 0.00 0.16 -0.29 0.00 -1.05 0.00 0.00 58.31 57.14 1aib n LYS 32 Cb 0.18 -1.36 -0.16 0.00 -0.65 0.00 0.00 35.03 33.04 1aib n LYS 32 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 177.40 177.77 1aib s ILE 33 N -1.35 1.76 -0.30 0.58 1.01 -0.52 -4.99 121.20 117.38 1aib s ILE 33 Ca 0.62 -0.93 0.01 0.00 0.00 0.00 0.00 60.65 60.35 1aib s ILE 33 Cb -0.69 -1.47 0.07 0.00 0.01 0.00 0.00 42.46 40.38 1aib s ILE 33 CO 0.59 0.50 -0.02 0.21 0.00 0.00 0.00 174.94 176.22 1aib s ASN 34 N -0.33 4.72 0.00 3.58 2.47 -1.26 -0.74 114.94 123.38 1aib s ASN 34 Ca 0.03 -1.58 0.20 0.00 0.42 0.00 0.00 52.86 51.93 1aib s ASN 34 Cb -0.10 -1.64 0.27 0.00 -1.45 0.00 0.00 41.25 38.33 1aib s ASN 34 CO 0.01 -0.28 1.22 0.18 -3.72 0.00 0.00 177.10 174.51 1aib n LEU 35 N 4.47 2.95 -0.47 3.21 4.77 0.16 -4.37 117.00 127.71 1aib n LEU 35 Ca -0.09 -1.30 0.11 0.00 -0.03 0.00 0.00 56.01 54.70 1aib n LEU 35 Cb 0.42 -0.12 0.44 0.00 -2.33 0.00 0.00 43.42 41.83 1aib n LEU 35 CO 0.24 0.59 0.81 0.61 -1.33 0.00 0.00 177.39 178.31 1aib n GLY 36 N 1.17 0.08 3.78 -0.72 0.00 -0.65 -1.00 105.19 107.85 1aib n GLY 36 Ca 0.14 -0.39 -0.35 0.00 0.00 0.00 0.00 46.02 45.42 1aib n GLY 36 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1aib s ILE 37 N -1.86 3.25 -0.26 -0.61 -4.36 -1.26 -4.85 121.20 111.24 1aib s ILE 37 Ca 0.33 0.75 0.13 0.00 -0.26 0.00 0.00 60.65 61.60 1aib s ILE 37 Cb 0.18 -3.29 0.71 0.00 1.25 0.00 0.00 42.46 41.30 1aib s ILE 37 CO 0.28 -0.19 1.69 0.61 0.24 0.00 0.00 174.94 177.56 1aib n GLY 38 N 0.03 3.64 3.32 6.27 0.00 -1.26 -4.75 105.19 112.44 1aib n GLY 38 Ca 0.11 -1.01 -0.21 0.00 0.00 0.00 0.00 46.02 44.92 1aib n GLY 38 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1aib s VAL 39 N -2.91 1.74 0.62 1.61 1.01 -1.26 -5.09 120.40 116.12 1aib s VAL 39 Ca 0.52 -1.89 -0.16 0.00 0.00 0.00 0.00 61.98 60.45 1aib s VAL 39 Cb 0.41 -1.80 -0.02 0.00 0.00 0.00 0.00 36.38 34.97 1aib s VAL 39 CO 0.12 -0.34 1.09 -0.47 0.00 0.00 0.00 175.10 175.51 1aib s TYR 40 N -2.09 2.74 -0.16 5.22 5.04 -1.26 -4.82 117.35 122.03 1aib s TYR 40 Ca 0.15 1.54 -0.09 0.00 -2.44 0.00 0.00 57.07 56.23 1aib s TYR 40 Cb -0.05 -3.13 0.06 0.00 0.35 0.00 0.00 41.96 39.18 1aib s TYR 40 CO 0.06 -1.49 0.40 0.21 -1.34 0.00 0.00 175.55 173.39 1aib s LYS 41 N -3.99 0.38 0.47 4.97 2.36 -1.26 -4.45 119.74 118.21 1aib s LYS 41 Ca 0.66 0.76 -0.03 0.00 -2.55 0.00 0.00 55.97 54.82 1aib s LYS 41 Cb -0.19 -0.03 0.10 0.00 -1.05 0.00 0.00 37.83 36.66 1aib s LYS 41 CO 0.38 -0.16 0.64 -0.40 1.55 0.00 0.00 175.35 177.37 1aib n ASP 42 N 4.22 0.58 0.12 1.43 5.75 -0.21 -4.67 116.55 123.77 1aib n ASP 42 Ca -0.23 -1.56 0.20 0.00 -0.01 0.00 0.00 54.79 53.19 1aib n ASP 42 Cb 0.55 -0.44 0.75 0.00 -1.03 0.00 0.00 41.12 40.95 1aib n ASP 42 CO 0.00 0.00 0.00 -0.08 -0.11 0.00 0.00 177.20 177.01 1aib h GLU 43 N 0.00 0.00 0.00 0.11 4.81 -1.91 0.31 114.58 117.90 1aib h GLU 43 Ca -0.21 0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 58.91 1aib h GLU 43 Cb 0.71 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.07 1aib h GLU 43 CO 0.20 0.00 -1.22 1.79 -0.73 0.00 0.00 179.01 179.05 1aib h THR 44 N 0.00 0.37 -0.03 0.32 1.35 -1.99 -3.45 112.91 109.48 1aib h THR 44 Ca 0.18 -1.71 0.00 0.00 -0.55 0.00 0.00 66.41 64.33 1aib h THR 44 Cb 1.03 1.90 0.00 0.00 -1.73 0.00 0.00 68.15 69.36 1aib h THR 44 CO -0.00 0.21 0.00 0.61 -0.25 0.00 0.00 175.52 176.09 1aib n GLY 45 N 1.32 0.86 3.45 5.82 0.00 0.11 -5.10 105.19 111.65 1aib n GLY 45 Ca -0.06 -0.01 -0.10 0.00 0.00 0.00 0.00 46.02 45.85 1aib n GLY 45 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1aib s LYS 46 N 0.16 1.29 -0.77 1.61 -2.85 -1.26 -4.86 119.74 113.07 1aib s LYS 46 Ca 0.00 -0.90 0.02 0.00 -1.00 0.00 0.00 55.97 54.09 1aib s LYS 46 Cb 0.00 0.49 0.19 0.00 -2.06 0.00 0.00 37.83 36.44 1aib s LYS 46 CO 0.00 -0.53 0.60 0.99 0.10 0.00 0.00 175.35 176.51 1aib s THR 47 N -3.88 3.57 0.95 3.79 2.01 -1.26 -1.04 115.64 119.77 1aib s THR 47 Ca 0.10 -3.96 -0.14 0.00 0.31 0.00 0.00 61.69 57.99 1aib s THR 47 Cb 0.00 -3.28 0.16 0.00 0.01 0.00 0.00 72.50 69.40 1aib s THR 47 CO -0.04 -1.02 1.18 -2.84 -0.69 0.00 0.00 174.62 171.22 1aib s PRO 48 N -1.25 0.84 -0.26 4.92 0.02 -1.26 -5.00 135.00 133.00 1aib s PRO 48 Ca 0.25 0.05 -0.20 0.00 0.02 0.00 0.00 61.00 61.12 1aib s PRO 48 Cb -0.08 -1.83 -0.02 0.00 0.02 0.00 0.00 34.50 32.60 1aib s PRO 48 CO -0.13 -2.35 0.61 0.08 -0.33 0.00 0.00 177.00 174.88 1aib s VAL 49 N -3.44 4.99 0.32 3.83 1.01 -1.26 -4.91 120.40 120.93 1aib s VAL 49 Ca 0.67 1.05 -0.28 0.00 0.00 0.00 0.00 61.98 63.42 1aib s VAL 49 Cb -0.11 -3.93 -0.13 0.00 0.00 0.00 0.00 36.38 32.21 1aib s VAL 49 CO 0.53 0.01 1.09 0.18 0.00 0.00 0.00 175.10 176.91 1aib n LEU 50 N 5.71 2.38 -0.33 3.92 4.32 -1.26 -4.81 117.00 126.92 1aib n LEU 50 Ca -0.01 1.18 -0.03 0.00 -0.02 0.00 0.00 56.01 57.13 1aib n LEU 50 Cb 0.49 -1.35 0.10 0.00 -1.62 0.00 0.00 43.42 41.03 1aib n LEU 50 CO 0.43 -1.13 1.25 0.74 -1.22 0.00 0.00 177.39 177.45 1aib h THR 51 N 2.12 1.21 -0.02 -5.08 2.02 -1.97 -1.87 112.91 109.32 1aib h THR 51 Ca -0.42 -0.41 -0.06 0.00 0.77 0.00 0.00 66.41 66.29 1aib h THR 51 Cb 1.32 -0.09 -0.01 0.00 -1.74 0.00 0.00 68.15 67.63 1aib h THR 51 CO 0.61 0.22 -0.29 0.77 0.37 0.00 0.00 175.52 177.19 1aib h SER 52 N 1.20 0.03 -0.06 4.18 4.64 -1.92 0.38 113.55 122.00 1aib h SER 52 Ca 0.33 -0.01 -0.01 0.00 -0.47 0.00 0.00 61.79 61.64 1aib h SER 52 Cb -0.11 -0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 61.97 1aib h SER 52 CO -0.08 0.33 -0.00 0.58 -0.87 0.00 0.00 176.83 176.78 1aib h VAL 53 N 0.03 1.26 -0.62 0.95 2.07 -1.78 -1.11 116.25 117.05 1aib h VAL 53 Ca 0.00 -0.82 0.05 0.00 0.82 0.00 0.00 66.70 66.76 1aib h VAL 53 Cb 0.54 1.69 -0.05 0.00 -1.52 0.00 0.00 31.29 31.95 1aib h VAL 53 CO 0.04 0.22 0.34 0.50 0.02 0.00 0.00 177.57 178.69 1aib h LYS 54 N -0.20 0.62 -0.88 1.57 1.63 -0.64 0.21 116.57 118.89 1aib h LYS 54 Ca 0.02 -0.04 0.03 0.00 -0.85 0.00 0.00 60.65 59.81 1aib h LYS 54 Cb 0.36 -0.14 -0.05 0.00 -0.60 0.00 0.00 32.23 31.79 1aib h LYS 54 CO 0.00 0.41 0.57 0.87 -3.45 0.00 0.00 179.45 177.86 1aib h LYS 55 N 0.64 1.09 0.00 1.90 1.57 -0.85 -1.15 116.57 119.77 1aib h LYS 55 Ca 0.27 -0.07 -0.14 0.00 -1.87 0.00 0.00 60.65 58.84 1aib h LYS 55 Cb 0.15 -0.25 -0.02 0.00 0.08 0.00 0.00 32.23 32.19 1aib h LYS 55 CO -0.16 0.72 -0.68 0.00 -0.57 0.00 0.00 179.45 178.76 1aib h ALA 56 N 1.36 0.84 0.00 3.86 0.00 0.38 -2.51 119.26 123.20 1aib h ALA 56 Ca 0.35 -0.62 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1aib h ALA 56 Cb -0.02 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1aib h ALA 56 CO -0.11 0.85 0.00 0.93 0.00 0.00 0.00 179.25 180.92 1aib h GLU 57 N 0.00 0.00 0.06 0.00 5.08 0.56 -1.94 114.58 118.34 1aib h GLU 57 Ca -0.01 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.18 1aib h GLU 57 Cb 1.23 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.47 1aib h GLU 57 CO 0.09 0.00 -0.89 0.37 -1.00 0.00 0.00 179.01 177.58 1aib h GLN 58 N 0.00 0.13 -0.71 2.33 5.75 -1.02 -2.66 115.11 118.93 1aib h GLN 58 Ca 0.00 -0.22 0.15 0.00 -0.15 0.00 0.00 58.65 58.44 1aib h GLN 58 Cb 0.52 0.08 -0.11 0.00 1.07 0.00 0.00 27.48 29.04 1aib h GLN 58 CO 0.00 1.10 0.12 -0.92 -2.65 0.00 0.00 178.83 176.49 1aib h TYR 59 N -0.67 0.17 -0.18 3.99 3.20 -1.33 -0.98 116.97 121.17 1aib h TYR 59 Ca -0.20 0.04 -0.07 0.00 3.14 0.00 0.00 58.73 61.64 1aib h TYR 59 Cb 1.42 0.03 -0.00 0.00 1.54 0.00 0.00 36.73 39.72 1aib h TYR 59 CO 0.17 -0.12 -0.16 -0.07 -1.64 0.00 0.00 178.16 176.35 1aib h LEU 60 N 0.22 0.45 -0.83 2.82 3.38 -1.46 -2.30 115.31 117.58 1aib h LEU 60 Ca 0.39 -0.47 0.19 0.00 0.09 0.00 0.00 57.88 58.08 1aib h LEU 60 Cb 0.66 -0.13 -0.12 0.00 0.09 0.00 0.00 40.66 41.17 1aib h LEU 60 CO -0.52 0.82 0.32 0.25 0.09 0.00 0.00 178.44 179.40 1aib h LEU 61 N 0.08 0.23 -0.45 1.67 6.46 -0.85 -0.29 115.31 122.17 1aib h LEU 61 Ca 0.03 0.14 -0.17 0.00 -0.12 0.00 0.00 57.88 57.76 1aib h LEU 61 Cb 0.69 0.14 -0.01 0.00 -0.73 0.00 0.00 40.66 40.75 1aib h LEU 61 CO 0.04 0.01 -0.74 -0.33 -0.62 0.00 0.00 178.44 176.80 1aib h GLU 62 N 0.38 0.26 0.00 1.25 5.08 -1.22 -3.38 114.58 116.95 1aib h GLU 62 Ca 0.49 -0.22 0.00 0.00 -1.00 0.00 0.00 59.36 58.63 1aib h GLU 62 Cb 0.88 0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.18 1aib h GLU 62 CO -0.50 0.89 -1.52 0.09 -1.00 0.00 0.00 179.01 176.97 1aib n ASN 63 N -3.78 0.56 -4.71 1.42 4.13 -0.49 -4.94 115.26 107.46 1aib n ASN 63 Ca -0.03 -0.42 -0.42 0.00 1.68 0.00 0.00 54.58 55.39 1aib n ASN 63 Cb 0.71 1.54 -0.03 0.00 -1.54 0.00 0.00 39.78 40.46 1aib n ASN 63 CO 0.00 0.00 0.00 -1.61 0.28 0.00 0.00 177.26 175.93 1aib s GLU 64 N -3.20 4.40 0.00 3.52 2.02 -0.24 -4.92 118.70 120.28 1aib s GLU 64 Ca -0.01 1.79 0.12 0.00 0.02 0.00 0.00 54.97 56.89 1aib s GLU 64 Cb 0.14 -3.39 -0.06 0.00 0.10 0.00 0.00 34.13 30.93 1aib s GLU 64 CO 0.84 -0.32 0.63 0.25 0.02 0.00 0.00 175.26 176.68 1aib n THR 66 N 4.09 0.00 -3.56 3.63 -2.24 -1.26 -5.01 114.28 109.94 1aib n THR 66 Ca 0.10 -0.31 -0.14 0.00 -2.27 0.00 0.00 64.05 61.42 1aib n THR 66 Cb 0.46 1.09 -0.06 0.00 -2.10 0.00 0.00 70.33 69.72 1aib n THR 66 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1aib s THR 67 N -1.80 0.00 -0.32 4.28 -1.32 -1.26 -5.02 115.64 110.20 1aib s THR 67 Ca 0.08 0.00 0.08 0.00 -1.21 0.00 0.00 61.69 60.64 1aib s THR 67 Cb 0.10 -1.00 0.50 0.00 -1.51 0.00 0.00 72.50 70.59 1aib s THR 67 CO 0.38 0.00 1.47 0.29 -2.21 0.00 0.00 174.62 174.56 1aib n LYS 68 N 1.02 2.05 -1.74 7.08 5.02 -1.26 -5.04 118.16 125.29 1aib n LYS 68 Ca -0.15 -3.30 -0.38 0.00 -2.02 0.00 0.00 58.31 52.46 1aib n LYS 68 Cb 0.57 -1.89 0.05 0.00 -0.02 0.00 0.00 35.03 33.75 1aib n LYS 68 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1aib s ASN 69 N -2.61 4.94 0.19 4.39 2.47 -1.26 -4.89 114.94 118.17 1aib s ASN 69 Ca 0.46 2.73 -0.30 0.00 0.42 0.00 0.00 52.86 56.17 1aib s ASN 69 Cb 0.41 -2.63 -0.17 0.00 -1.45 0.00 0.00 41.25 37.42 1aib s ASN 69 CO -0.00 -1.79 0.80 -1.22 -3.72 0.00 0.00 177.10 171.17 1aib n TYR 70 N -1.42 0.32 -1.72 0.43 4.01 -1.26 -5.01 117.16 112.51 1aib n TYR 70 Ca 0.13 0.88 -0.31 0.00 -0.16 0.00 0.00 57.90 58.44 1aib n TYR 70 Cb 0.46 -2.09 0.04 0.00 -0.31 0.00 0.00 39.34 37.44 1aib n TYR 70 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1aib s LEU 71 N 1.69 3.07 1.37 7.72 1.43 -1.26 -5.07 118.68 127.63 1aib s LEU 71 Ca 0.68 1.45 -0.20 0.00 -1.03 0.00 0.00 54.13 55.03 1aib s LEU 71 Cb -0.92 -4.35 0.35 0.00 0.03 0.00 0.00 46.19 41.31 1aib s LEU 71 CO 0.56 -1.29 0.94 -0.83 0.23 0.00 0.00 176.35 175.97 1aib s GLY 72 N -4.02 1.44 0.35 -3.19 0.00 -1.26 -4.82 107.32 95.82 1aib s GLY 72 Ca 0.57 -0.57 0.15 0.00 0.00 0.00 0.00 44.72 44.87 1aib s GLY 72 CO 0.54 0.36 1.76 -2.22 0.00 0.00 0.00 173.10 173.54 1aib h ILE 73 N -3.27 1.18 -0.00 0.90 2.04 -1.97 -2.28 117.51 114.10 1aib h ILE 73 Ca -0.50 -1.53 0.00 0.00 1.00 0.00 0.00 64.86 63.82 1aib h ILE 73 Cb 1.34 1.86 0.00 0.00 -0.74 0.00 0.00 36.82 39.28 1aib h ILE 73 CO 0.36 0.42 -0.12 -0.90 0.00 0.00 0.00 178.15 177.91 1aib n ASP 74 N -3.84 0.57 0.00 1.72 5.75 -1.26 -4.38 116.55 115.11 1aib n ASP 74 Ca -0.01 -0.66 0.00 0.00 -0.01 0.00 0.00 54.79 54.10 1aib n ASP 74 Cb 0.48 -0.04 0.00 0.00 -1.03 0.00 0.00 41.12 40.53 1aib n ASP 74 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1aib n GLY 75 N 1.27 0.16 3.60 6.12 0.00 -0.86 -1.00 105.19 114.49 1aib n GLY 75 Ca 0.15 -1.13 -0.43 0.00 0.00 0.00 0.00 46.02 44.61 1aib n GLY 75 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1aib s ILE 76 N 0.00 4.54 0.21 -0.61 1.01 -1.26 -4.21 121.20 120.88 1aib s ILE 76 Ca 0.00 1.19 -0.21 0.00 0.00 0.00 0.00 60.65 61.63 1aib s ILE 76 Cb 0.00 -4.37 0.16 0.00 0.01 0.00 0.00 42.46 38.26 1aib s ILE 76 CO 0.00 -0.60 1.56 -0.65 0.00 0.00 0.00 174.94 175.25 1aib h PRO 77 N 8.56 -0.06 0.00 2.79 0.11 -1.98 -0.74 132.00 140.68 1aib h PRO 77 Ca -0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.88 1aib h PRO 77 Cb 1.08 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.20 1aib h PRO 77 CO 1.00 -0.04 0.00 0.39 -0.21 0.00 0.00 178.00 179.14 1aib n GLU 78 N -5.43 0.16 -0.07 1.05 4.71 -1.26 -0.76 120.64 119.04 1aib n GLU 78 Ca 0.07 0.17 -0.11 0.00 -0.01 0.00 0.00 57.16 57.28 1aib n GLU 78 Cb 0.37 -1.70 -0.05 0.00 -1.01 0.00 0.00 31.44 29.04 1aib n GLU 78 CO 0.00 0.00 0.00 0.35 0.09 0.00 0.00 177.13 177.57 1aib h PHE 79 N 0.00 0.38 -0.18 -0.32 3.57 -1.51 -1.83 116.94 117.05 1aib h PHE 79 Ca 0.00 -0.06 0.03 0.00 3.53 0.00 0.00 57.97 61.47 1aib h PHE 79 Cb 0.60 -0.10 -0.06 0.00 2.79 0.00 0.00 35.95 39.18 1aib h PHE 79 CO 0.00 0.53 -0.46 0.78 -2.23 0.00 0.00 178.31 176.93 1aib h GLY 80 N 0.12 -1.17 0.58 2.40 0.00 0.39 -1.47 103.07 103.93 1aib h GLY 80 Ca 0.06 0.70 0.05 0.00 0.00 0.00 0.00 47.33 48.14 1aib h GLY 80 CO 0.01 -0.25 0.02 3.21 0.00 0.00 0.00 176.54 179.53 1aib h ARG 81 N -0.45 0.11 -0.46 4.80 3.08 -1.17 -0.46 114.38 119.84 1aib h ARG 81 Ca 0.04 -0.01 -0.06 0.00 0.07 0.00 0.00 59.98 60.02 1aib h ARG 81 Cb 0.55 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.56 1aib h ARG 81 CO -0.41 0.07 0.07 0.00 -1.07 0.00 0.00 179.97 178.63 1aib h THR 83 N 0.64 1.35 -0.41 0.00 1.35 -0.03 -0.96 112.91 114.86 1aib h THR 83 Ca 0.14 -1.97 0.08 0.00 -0.55 0.00 0.00 66.41 64.11 1aib h THR 83 Cb 0.40 1.95 -0.07 0.00 -1.73 0.00 0.00 68.15 68.71 1aib h THR 83 CO 0.01 0.60 -0.01 1.56 -0.25 0.00 0.00 175.52 177.43 1aib h GLN 84 N 0.32 0.09 -0.16 4.72 4.20 -0.46 0.11 115.11 123.93 1aib h GLN 84 Ca -0.01 -0.01 -0.06 0.00 0.06 0.00 0.00 58.65 58.64 1aib h GLN 84 Cb 1.18 -0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.93 1aib h GLN 84 CO 0.11 0.06 -0.15 0.93 -0.67 0.00 0.00 178.83 179.11 1aib h GLU 85 N 0.10 0.26 -0.17 1.46 5.08 -0.79 -0.29 114.58 120.23 1aib h GLU 85 Ca 0.20 -0.07 -0.13 0.00 -1.00 0.00 0.00 59.36 58.36 1aib h GLU 85 Cb 0.29 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 1aib h GLU 85 CO -0.35 0.42 -0.47 1.25 -1.00 0.00 0.00 179.01 178.86 1aib h LEU 86 N 0.25 0.46 0.00 1.33 5.85 0.21 -0.78 115.31 122.63 1aib h LEU 86 Ca 0.05 -0.22 -0.00 0.00 0.84 0.00 0.00 57.88 58.55 1aib h LEU 86 Cb 0.42 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.32 1aib h LEU 86 CO 0.03 0.86 -0.00 -0.07 -0.34 0.00 0.00 178.44 178.92 1aib h LEU 87 N 0.34 -0.00 -1.88 2.25 -0.00 -0.26 -3.37 115.31 112.39 1aib h LEU 87 Ca 0.02 -0.59 0.00 0.00 -0.00 0.00 0.00 57.88 57.31 1aib h LEU 87 Cb 0.96 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.62 1aib h LEU 87 CO 0.08 0.79 0.00 0.49 -0.00 0.00 0.00 178.44 179.80 1aib n PHE 88 N -4.68 0.39 -0.34 1.13 3.72 -0.17 -4.77 117.46 112.73 1aib n PHE 88 Ca -0.06 -0.19 0.00 0.00 -0.05 0.00 0.00 57.45 57.15 1aib n PHE 88 Cb 0.28 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.82 1aib n PHE 88 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1aib n GLY 89 N 1.37 -3.07 0.32 1.37 0.00 -0.30 -4.39 105.19 100.48 1aib n GLY 89 Ca 0.18 -1.20 0.02 0.00 0.00 0.00 0.00 46.02 45.02 1aib n GLY 89 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1aib h LYS 90 N 0.04 0.70 -0.64 1.61 3.64 -1.92 -2.88 116.57 117.12 1aib h LYS 90 Ca 0.00 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 1aib h LYS 90 Cb 0.21 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 31.88 1aib h LYS 90 CO 0.00 0.50 0.00 0.41 -2.27 0.00 0.00 179.45 178.09 1aib n GLY 91 N -1.34 2.69 3.70 5.01 0.00 -1.26 -4.96 105.19 109.03 1aib n GLY 91 Ca 0.04 -0.78 -0.43 0.00 0.00 0.00 0.00 46.02 44.85 1aib n GLY 91 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1aib n SER 92 N 0.62 3.70 -0.26 1.61 2.88 -1.09 -4.80 113.62 116.28 1aib n SER 92 Ca 0.24 1.07 0.13 0.00 -1.33 0.00 0.00 58.87 58.97 1aib n SER 92 Cb 1.01 -1.53 0.39 0.00 -0.75 0.00 0.00 64.21 63.34 1aib n SER 92 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1aib h ALA 93 N 6.38 1.87 -0.50 -1.46 0.00 -1.92 0.23 119.26 123.87 1aib h ALA 93 Ca -0.44 0.02 0.09 0.00 0.00 0.00 0.00 54.91 54.57 1aib h ALA 93 Cb 1.22 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.87 1aib h ALA 93 CO 0.93 -0.11 0.34 -0.07 0.00 0.00 0.00 179.25 180.34 1aib h LEU 94 N 0.66 0.28 0.13 0.00 4.07 -1.96 0.34 115.31 118.83 1aib h LEU 94 Ca 0.44 0.00 -0.29 0.00 0.08 0.00 0.00 57.88 58.12 1aib h LEU 94 Cb 0.75 -0.05 0.00 0.00 1.08 0.00 0.00 40.66 42.44 1aib h LEU 94 CO -0.20 0.17 -1.48 0.40 -1.08 0.00 0.00 178.44 176.26 1aib h ILE 95 N 0.31 1.02 -0.19 1.22 2.04 -1.20 -0.30 117.51 120.41 1aib h ILE 95 Ca 0.23 -2.43 -0.09 0.00 1.00 0.00 0.00 64.86 63.57 1aib h ILE 95 Cb 0.50 2.74 -0.01 0.00 -0.74 0.00 0.00 36.82 39.30 1aib h ILE 95 CO -0.05 0.74 -0.29 0.78 0.00 0.00 0.00 178.15 179.33 1aib h ASN 96 N -0.21 0.36 0.47 1.72 -0.26 0.42 -1.93 115.58 116.16 1aib h ASN 96 Ca -0.31 -0.12 0.00 0.00 -0.56 0.00 0.00 56.30 55.31 1aib h ASN 96 Cb 1.84 -0.10 0.00 0.00 -1.06 0.00 0.00 38.32 39.00 1aib h ASN 96 CO 0.09 0.64 -0.16 0.47 -1.06 0.00 0.00 177.43 177.41 1aib n ASP 97 N -4.11 0.45 -3.29 5.81 8.00 0.11 -4.95 116.55 118.56 1aib n ASP 97 Ca -0.01 -0.39 -0.16 0.00 0.71 0.00 0.00 54.79 54.94 1aib n ASP 97 Cb 0.41 -0.07 0.08 0.00 -0.02 0.00 0.00 41.12 41.52 1aib n ASP 97 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 1aib n LYS 98 N -1.09 -5.48 -0.00 -1.24 0.00 -0.72 -4.39 118.16 105.23 1aib n LYS 98 Ca 0.12 0.81 0.10 0.00 0.00 0.00 0.00 58.31 59.34 1aib n LYS 98 Cb 0.30 -5.70 -0.12 0.00 0.00 0.00 0.00 35.03 29.51 1aib n LYS 98 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 1aib n ARG 99 N -3.82 0.43 -4.37 1.64 1.74 -0.14 -3.59 116.66 108.56 1aib n ARG 99 Ca -0.23 -0.03 -0.31 0.00 -0.77 0.00 0.00 57.85 56.51 1aib n ARG 99 Cb 0.65 -1.45 -0.10 0.00 -1.02 0.00 0.00 32.46 30.54 1aib n ARG 99 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1aib s ALA 100 N -2.98 2.93 -0.04 7.54 0.00 -1.22 -1.25 121.76 126.74 1aib s ALA 100 Ca 0.05 -1.16 0.01 0.00 0.00 0.00 0.00 51.96 50.86 1aib s ALA 100 Cb 0.15 -0.96 0.02 0.00 0.00 0.00 0.00 23.12 22.33 1aib s ALA 100 CO 0.83 0.62 -0.03 1.03 0.00 0.00 0.00 175.76 178.21 1aib s ARG 101 N -1.83 0.64 -0.13 0.00 1.81 -0.32 -4.95 118.95 114.17 1aib s ARG 101 Ca 0.19 -0.06 -0.04 0.00 -1.72 0.00 0.00 55.73 54.11 1aib s ARG 101 Cb -0.11 -0.69 -0.03 0.00 -0.45 0.00 0.00 34.95 33.66 1aib s ARG 101 CO 0.11 -0.08 -0.00 0.99 -0.68 0.00 0.00 175.30 175.63 1aib s THR 102 N 0.87 4.21 -0.10 0.02 2.01 -1.26 -0.79 115.64 120.59 1aib s THR 102 Ca -0.11 -0.26 0.02 0.00 0.31 0.00 0.00 61.69 61.65 1aib s THR 102 Cb -0.14 -2.83 -0.02 0.00 0.01 0.00 0.00 72.50 69.53 1aib s THR 102 CO -0.00 0.53 -0.15 0.00 -0.69 0.00 0.00 174.62 174.30 1aib s ALA 103 N -0.12 2.55 0.05 7.40 0.00 -0.48 -4.90 121.76 126.26 1aib s ALA 103 Ca 0.04 -0.93 -0.31 0.00 0.00 0.00 0.00 51.96 50.77 1aib s ALA 103 Cb -0.13 -1.08 -0.06 0.00 0.00 0.00 0.00 23.12 21.86 1aib s ALA 103 CO 0.02 0.33 1.24 -1.14 0.00 0.00 0.00 175.76 176.21 1aib s GLN 104 N 0.08 4.40 0.20 0.00 0.74 -0.17 -1.20 119.66 123.71 1aib s GLN 104 Ca -0.07 1.81 0.04 0.00 0.05 0.00 0.00 55.36 57.19 1aib s GLN 104 Cb -0.15 -3.38 -0.05 0.00 1.10 0.00 0.00 33.01 30.53 1aib s GLN 104 CO 0.05 -0.33 -0.04 0.95 -0.55 0.00 0.00 175.29 175.36 1aib s THR 105 N 1.33 1.09 -1.12 -0.34 -4.23 -0.10 -4.57 115.64 107.70 1aib s THR 105 Ca 0.59 -2.05 -0.20 0.00 -1.18 0.00 0.00 61.69 58.86 1aib s THR 105 Cb -0.30 -2.14 -0.06 0.00 1.34 0.00 0.00 72.50 71.35 1aib s THR 105 CO 0.28 -0.50 1.94 -0.81 -0.54 0.00 0.00 174.62 174.99 1aib n PRO 106 N -0.32 2.09 0.00 3.99 -0.04 -1.26 -3.05 135.00 136.41 1aib n PRO 106 Ca -0.07 -2.45 0.00 0.00 -0.04 0.00 0.00 63.50 60.94 1aib n PRO 106 Cb 0.62 -3.35 0.00 0.00 -0.04 0.00 0.00 33.50 30.74 1aib n PRO 106 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1aib n GLY 107 N 5.02 0.16 0.13 0.55 0.00 -1.14 -3.31 105.19 106.59 1aib n GLY 107 Ca 0.48 -1.94 -0.13 0.00 0.00 0.00 0.00 46.02 44.44 1aib n GLY 107 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1aib h GLY 108 N 0.00 0.37 0.09 -0.02 0.00 -1.73 -2.94 103.07 98.84 1aib h GLY 108 Ca 0.00 -0.35 0.14 0.00 0.00 0.00 0.00 47.33 47.12 1aib h GLY 108 CO 0.00 0.32 0.25 -0.84 0.00 0.00 0.00 176.54 176.27 1aib h THR 109 N -0.01 0.62 0.00 4.70 2.02 -1.91 0.07 112.91 118.40 1aib h THR 109 Ca 0.03 -0.13 -0.05 0.00 0.77 0.00 0.00 66.41 67.03 1aib h THR 109 Cb 0.61 0.21 -0.01 0.00 -1.74 0.00 0.00 68.15 67.22 1aib h THR 109 CO 0.03 0.07 -0.23 1.23 0.37 0.00 0.00 175.52 176.98 1aib h GLY 110 N 0.37 0.00 1.89 2.16 0.00 -1.56 -1.99 103.07 103.95 1aib h GLY 110 Ca 0.40 0.00 -0.21 0.00 0.00 0.00 0.00 47.33 47.53 1aib h GLY 110 CO -0.43 0.00 -0.96 0.00 0.00 0.00 0.00 176.54 175.15 1aib h ALA 111 N 1.77 0.42 0.64 3.60 0.00 -0.83 -0.97 119.26 123.89 1aib h ALA 111 Ca -0.00 -0.82 -0.03 0.00 0.00 0.00 0.00 54.91 54.06 1aib h ALA 111 Cb 0.59 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.28 1aib h ALA 111 CO 0.03 1.07 -0.31 1.25 0.00 0.00 0.00 179.25 181.29 1aib h LEU 112 N 0.04 -0.73 -0.57 0.00 5.85 -1.06 0.34 115.31 119.17 1aib h LEU 112 Ca -0.04 -0.01 0.08 0.00 0.84 0.00 0.00 57.88 58.75 1aib h LEU 112 Cb 1.66 0.19 -0.06 0.00 0.37 0.00 0.00 40.66 42.81 1aib h LEU 112 CO 0.14 -0.37 0.24 -0.09 -0.34 0.00 0.00 178.44 178.01 1aib h ARG 113 N -1.13 0.43 -0.24 1.25 9.65 -1.45 0.35 114.38 123.24 1aib h ARG 113 Ca -0.09 -0.03 -0.03 0.00 -1.10 0.00 0.00 59.98 58.73 1aib h ARG 113 Cb 0.70 -0.10 -0.01 0.00 -1.39 0.00 0.00 29.97 29.17 1aib h ARG 113 CO 0.14 0.28 0.00 0.28 2.80 0.00 0.00 179.97 183.48 1aib h VAL 114 N 0.44 1.15 -0.12 0.20 2.07 -1.06 -0.40 116.25 118.52 1aib h VAL 114 Ca 0.28 -0.56 -0.12 0.00 0.82 0.00 0.00 66.70 67.12 1aib h VAL 114 Cb 0.30 0.97 0.00 0.00 -1.52 0.00 0.00 31.29 31.03 1aib h VAL 114 CO -0.26 0.19 -0.38 0.00 0.02 0.00 0.00 177.57 177.15 1aib h ALA 115 N 1.67 0.21 0.10 1.67 0.00 0.80 -2.59 119.26 121.12 1aib h ALA 115 Ca 0.08 -0.45 0.02 0.00 0.00 0.00 0.00 54.91 54.55 1aib h ALA 115 Cb 0.22 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 1aib h ALA 115 CO 0.00 0.30 -0.19 0.00 0.00 0.00 0.00 179.25 179.36 1aib h ALA 116 N 0.50 -0.32 0.00 0.00 0.00 0.25 -0.80 119.26 118.90 1aib h ALA 116 Ca -0.01 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.79 1aib h ALA 116 Cb 1.00 0.31 -0.01 0.00 0.00 0.00 0.00 17.79 19.09 1aib h ALA 116 CO 0.08 -0.72 -0.38 -0.44 0.00 0.00 0.00 179.25 177.79 1aib h ASP 117 N -0.37 0.00 -0.37 0.00 3.32 -1.12 0.12 116.42 118.01 1aib h ASP 117 Ca 0.03 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.04 1aib h ASP 117 Cb 0.39 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.93 1aib h ASP 117 CO -0.11 0.38 0.07 0.15 -1.72 0.00 0.00 179.24 178.01 1aib h PHE 118 N 0.00 0.65 -0.09 4.55 3.57 -1.00 -1.63 116.94 122.98 1aib h PHE 118 Ca -0.00 -0.09 -0.07 0.00 3.53 0.00 0.00 57.97 61.34 1aib h PHE 118 Cb 0.68 -0.18 0.00 0.00 2.79 0.00 0.00 35.95 39.24 1aib h PHE 118 CO 0.00 0.65 -0.21 -0.07 -2.23 0.00 0.00 178.31 176.46 1aib h LEU 119 N 0.46 0.34 -1.24 0.59 3.38 -0.75 -1.78 115.31 116.31 1aib h LEU 119 Ca 0.11 -0.57 0.07 0.00 0.09 0.00 0.00 57.88 57.58 1aib h LEU 119 Cb 0.35 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 40.95 1aib h LEU 119 CO 0.01 0.85 0.55 0.00 0.09 0.00 0.00 178.44 179.94 1aib h ALA 120 N 0.50 1.61 0.00 1.53 0.00 -0.69 -2.26 119.26 119.94 1aib h ALA 120 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1aib h ALA 120 Cb 0.80 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1aib h ALA 120 CO 0.05 0.26 -1.05 1.63 0.00 0.00 0.00 179.25 180.13 1aib n LYS 121 N -4.49 0.83 0.00 0.00 4.76 -0.62 -4.56 118.16 114.09 1aib n LYS 121 Ca 0.13 -0.03 0.00 0.00 -2.87 0.00 0.00 58.31 55.54 1aib n LYS 121 Cb 0.23 -1.39 0.00 0.00 -1.84 0.00 0.00 35.03 32.03 1aib n LYS 121 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1aib n ASN 122 N -1.57 0.87 -4.14 4.39 3.02 -0.67 -5.06 115.26 112.11 1aib n ASN 122 Ca 0.02 -1.09 -0.11 0.00 -0.03 0.00 0.00 54.58 53.37 1aib n ASN 122 Cb 0.33 0.00 -0.09 0.00 -0.61 0.00 0.00 39.78 39.41 1aib n ASN 122 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1aib s THR 123 N -0.09 0.01 -2.07 3.41 2.01 -0.86 -4.99 115.64 113.05 1aib s THR 123 Ca 0.00 -1.84 0.13 0.00 0.31 0.00 0.00 61.69 60.29 1aib s THR 123 Cb 0.00 -2.38 0.33 0.00 0.01 0.00 0.00 72.50 70.46 1aib s THR 123 CO 0.00 -0.04 1.39 -1.54 -0.69 0.00 0.00 174.62 173.73 1aib n SER 124 N -0.28 0.93 -4.76 3.53 3.41 -1.26 -4.74 113.62 110.44 1aib n SER 124 Ca 0.00 -1.78 -0.41 0.00 -0.26 0.00 0.00 58.87 56.42 1aib n SER 124 Cb 0.65 -0.09 -0.02 0.00 -0.26 0.00 0.00 64.21 64.49 1aib n SER 124 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1aib s VAL 125 N -1.82 2.85 0.00 -3.33 1.01 -1.26 -4.87 120.40 112.98 1aib s VAL 125 Ca 0.21 0.81 0.00 0.00 0.00 0.00 0.00 61.98 63.00 1aib s VAL 125 Cb 0.11 -3.52 0.00 0.00 0.00 0.00 0.00 36.38 32.97 1aib s VAL 125 CO 0.16 0.17 0.00 1.17 0.00 0.00 0.00 175.10 176.61 1aib n LYS 126 N 1.33 3.29 -3.75 2.72 4.81 -1.26 -4.76 118.16 120.54 1aib n LYS 126 Ca 0.02 0.00 -0.13 0.00 -0.87 0.00 0.00 58.31 57.33 1aib n LYS 126 Cb 0.42 -0.57 -0.10 0.00 0.02 0.00 0.00 35.03 34.79 1aib n LYS 126 CO 0.00 0.00 0.00 0.50 1.17 0.00 0.00 177.40 179.07 1aib s ARG 129 N -0.95 0.43 -0.09 1.64 3.52 -1.26 -0.73 118.95 121.51 1aib s ARG 129 Ca 0.00 0.49 0.01 0.00 -0.13 0.00 0.00 55.73 56.10 1aib s ARG 129 Cb 0.00 0.21 0.02 0.00 -1.56 0.00 0.00 34.95 33.62 1aib s ARG 129 CO 0.00 -0.05 -0.09 0.54 -0.81 0.00 0.00 175.30 174.89 1aib s VAL 133 N 0.16 1.03 -0.14 7.11 0.11 0.43 -1.63 120.40 127.46 1aib s VAL 133 Ca -0.00 -0.34 -0.27 0.00 -2.93 0.00 0.00 61.98 58.44 1aib s VAL 133 Cb -0.03 -1.01 -0.01 0.00 -1.53 0.00 0.00 36.38 33.80 1aib s VAL 133 CO 0.01 0.35 0.90 0.26 -3.33 0.00 0.00 175.10 173.29 1aib s TRP 134 N 1.31 3.46 0.15 1.54 0.52 0.45 -1.28 118.94 125.09 1aib s TRP 134 Ca -0.03 1.39 0.08 0.00 0.02 0.00 0.00 56.10 57.56 1aib s TRP 134 Cb -0.14 -3.08 -0.04 0.00 -1.15 0.00 0.00 33.47 29.07 1aib s TRP 134 CO -0.04 -0.23 -0.17 0.14 0.02 0.00 0.00 176.95 176.68 1aib s VAL 135 N 2.06 1.67 0.87 4.03 -7.23 0.24 -1.10 120.40 120.94 1aib s VAL 135 Ca 0.42 -1.86 -0.12 0.00 -1.81 0.00 0.00 61.98 58.61 1aib s VAL 135 Cb -0.17 -1.76 0.11 0.00 0.56 0.00 0.00 36.38 35.12 1aib s VAL 135 CO 0.14 -0.35 1.09 -0.94 -0.31 0.00 0.00 175.10 174.74 1aib s SER 136 N -2.61 3.79 -0.29 4.85 1.04 -1.26 -2.02 113.70 117.21 1aib s SER 136 Ca 0.14 1.41 0.00 0.00 0.48 0.00 0.00 55.95 57.98 1aib s SER 136 Cb -0.05 -2.11 0.05 0.00 0.10 0.00 0.00 66.02 64.01 1aib s SER 136 CO 0.05 -2.43 -0.04 0.21 0.98 0.00 0.00 173.24 172.01 1aib s ASN 137 N -3.59 4.72 0.76 7.02 3.84 -0.48 -3.26 114.94 123.94 1aib s ASN 137 Ca 0.63 -1.34 -0.06 0.00 0.21 0.00 0.00 52.86 52.30 1aib s ASN 137 Cb -0.17 -1.65 0.12 0.00 -0.55 0.00 0.00 41.25 39.01 1aib s ASN 137 CO 0.56 -0.24 1.06 -2.16 -2.79 0.00 0.00 177.10 173.53 1aib s PRO 138 N 1.19 1.63 0.20 0.43 0.04 -1.26 -3.59 135.00 133.64 1aib s PRO 138 Ca -0.06 -0.70 0.01 0.00 0.04 0.00 0.00 61.00 60.29 1aib s PRO 138 Cb -0.20 -2.19 -0.01 0.00 0.04 0.00 0.00 34.50 32.15 1aib s PRO 138 CO -0.03 -1.57 0.24 0.45 0.04 0.00 0.00 177.00 176.13 1aib n SER 139 N -3.04 -0.64 -4.68 6.66 2.88 -1.20 -4.63 113.62 108.96 1aib n SER 139 Ca 0.13 -2.21 -0.42 0.00 -1.33 0.00 0.00 58.87 55.03 1aib n SER 139 Cb 0.60 1.29 -0.03 0.00 -0.75 0.00 0.00 64.21 65.33 1aib n SER 139 CO 0.00 0.00 0.00 0.86 -1.23 0.00 0.00 175.04 174.67 1aib s TRP 140 N -3.32 2.77 0.29 0.66 -0.00 -1.13 -4.44 118.94 113.77 1aib s TRP 140 Ca 0.20 0.79 0.04 0.00 -0.00 0.00 0.00 56.10 57.14 1aib s TRP 140 Cb 0.00 -3.66 0.73 0.00 -0.00 0.00 0.00 33.47 30.54 1aib s TRP 140 CO 0.14 -2.46 1.71 -1.00 -0.00 0.00 0.00 176.95 175.35 1aib h PRO 141 N 8.05 0.44 0.00 5.86 0.13 -2.00 -1.82 132.00 142.66 1aib h PRO 141 Ca -0.36 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 1aib h PRO 141 Cb 1.17 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.20 1aib h PRO 141 CO 0.91 0.29 0.00 -1.71 -0.23 0.00 0.00 178.00 177.27 1aib n ASN 142 N -5.00 0.00 -0.06 1.44 5.15 -1.26 -2.72 115.26 112.81 1aib n ASN 142 Ca 0.22 -0.23 -0.14 0.00 -0.60 0.00 0.00 54.58 53.83 1aib n ASN 142 Cb 0.64 -0.04 -0.06 0.00 -0.53 0.00 0.00 39.78 39.79 1aib n ASN 142 CO 0.00 0.00 0.00 0.45 1.40 0.00 0.00 177.26 179.11 1aib h HIS 143 N 0.00 0.59 -0.82 1.20 3.86 -1.72 -2.60 115.15 115.65 1aib h HIS 143 Ca 0.00 -0.19 0.03 0.00 -1.16 0.00 0.00 60.37 59.05 1aib h HIS 143 Cb 0.01 -0.12 -0.05 0.00 1.06 0.00 0.00 27.41 28.32 1aib h HIS 143 CO 0.00 0.88 0.53 -0.22 0.86 0.00 0.00 177.93 179.98 1aib h LYS 144 N 0.13 1.00 -0.31 2.45 3.64 -1.73 -2.81 116.57 118.94 1aib h LYS 144 Ca 0.02 -0.06 -0.08 0.00 -1.27 0.00 0.00 60.65 59.26 1aib h LYS 144 Cb 0.81 -0.22 -0.01 0.00 -0.41 0.00 0.00 32.23 32.39 1aib h LYS 144 CO 0.06 0.66 -0.10 0.77 -2.27 0.00 0.00 179.45 178.56 1aib h SER 145 N 1.03 0.64 -0.38 4.20 0.02 -1.70 0.24 113.55 117.59 1aib h SER 145 Ca 0.33 -0.38 -0.11 0.00 -0.84 0.00 0.00 61.79 60.78 1aib h SER 145 Cb 0.01 -0.17 -0.02 0.00 0.14 0.00 0.00 62.40 62.36 1aib h SER 145 CO -0.11 0.87 -0.18 -0.37 -1.14 0.00 0.00 176.83 175.90 1aib h VAL 146 N 0.39 1.27 -0.18 2.27 -1.51 -1.27 0.15 116.25 117.37 1aib h VAL 146 Ca 0.08 -1.30 -0.17 0.00 -1.23 0.00 0.00 66.70 64.08 1aib h VAL 146 Cb 0.61 1.11 -0.00 0.00 -2.13 0.00 0.00 31.29 30.88 1aib h VAL 146 CO 0.04 0.44 -0.58 -0.26 -1.23 0.00 0.00 177.57 175.98 1aib h PHE 147 N 0.76 0.72 -0.02 5.19 0.04 -1.48 -3.00 116.94 119.14 1aib h PHE 147 Ca 0.11 -0.26 -0.15 0.00 2.80 0.00 0.00 57.97 60.47 1aib h PHE 147 Cb 0.70 -0.13 -0.02 0.00 2.20 0.00 0.00 35.95 38.70 1aib h PHE 147 CO 0.04 1.01 -0.68 -0.91 -0.60 0.00 0.00 178.31 177.17 1aib h ASN 148 N 0.43 0.13 0.90 2.17 2.35 -0.23 -2.24 115.58 119.09 1aib h ASN 148 Ca 0.00 -0.08 0.00 0.00 -0.55 0.00 0.00 56.30 55.67 1aib h ASN 148 Cb 1.13 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 39.46 1aib h ASN 148 CO 0.11 0.77 0.00 -1.20 -1.65 0.00 0.00 177.43 175.45 1aib n SER 149 N -3.77 0.68 -0.14 5.81 7.64 0.02 -0.57 113.62 123.28 1aib n SER 149 Ca -0.02 0.64 0.12 0.00 1.01 0.00 0.00 58.87 60.62 1aib n SER 149 Cb 0.67 -0.79 0.25 0.00 -1.01 0.00 0.00 64.21 63.32 1aib n SER 149 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1aib n ALA 150 N -1.77 3.47 -1.89 -0.43 0.00 -0.99 -4.97 120.51 113.94 1aib n ALA 150 Ca 0.03 -0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.05 1aib n ALA 150 Cb 0.28 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 18.66 1aib n ALA 150 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1aib n GLY 151 N 1.43 0.58 3.31 0.00 0.00 0.26 -4.87 105.19 105.90 1aib n GLY 151 Ca 0.08 -0.47 -0.27 0.00 0.00 0.00 0.00 46.02 45.36 1aib n GLY 151 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1aib s LEU 152 N -1.54 2.22 -0.08 0.99 1.02 -0.88 -5.02 118.68 115.39 1aib s LEU 152 Ca 0.00 -0.61 -0.25 0.00 0.02 0.00 0.00 54.13 53.29 1aib s LEU 152 Cb 0.00 -1.10 -0.03 0.00 0.02 0.00 0.00 46.19 45.08 1aib s LEU 152 CO 0.00 0.18 0.79 -0.70 0.02 0.00 0.00 176.35 176.63 1aib s GLU 154 N -1.48 4.43 -0.19 1.70 2.12 0.09 -4.16 118.70 121.20 1aib s GLU 154 Ca 0.10 1.01 -0.04 0.00 0.36 0.00 0.00 54.97 56.40 1aib s GLU 154 Cb -0.10 -3.48 -0.02 0.00 0.26 0.00 0.00 34.13 30.79 1aib s GLU 154 CO 0.03 -0.06 -0.02 0.14 -0.54 0.00 0.00 175.26 174.82 1aib s VAL 155 N 1.18 3.82 0.24 3.70 -7.23 -1.26 -0.43 120.40 120.42 1aib s VAL 155 Ca 0.40 -0.36 0.06 0.00 -1.81 0.00 0.00 61.98 60.28 1aib s VAL 155 Cb -0.18 -2.71 -0.03 0.00 0.56 0.00 0.00 36.38 34.01 1aib s VAL 155 CO 0.19 0.44 0.23 -0.13 -0.31 0.00 0.00 175.10 175.52 1aib s ARG 156 N 0.94 3.04 -0.09 4.82 1.81 -0.40 -4.96 118.95 124.11 1aib s ARG 156 Ca 0.01 -0.97 0.05 0.00 -1.72 0.00 0.00 55.73 53.09 1aib s ARG 156 Cb -0.14 -2.64 -0.00 0.00 -0.45 0.00 0.00 34.95 31.71 1aib s ARG 156 CO 0.01 0.41 -0.24 -1.21 -0.68 0.00 0.00 175.30 173.60 1aib s GLU 157 N -3.81 2.90 0.27 3.54 2.02 -1.26 -0.59 118.70 121.76 1aib s GLU 157 Ca 0.33 -0.89 0.04 0.00 0.02 0.00 0.00 54.97 54.48 1aib s GLU 157 Cb -0.08 -2.26 -0.03 0.00 0.10 0.00 0.00 34.13 31.86 1aib s GLU 157 CO 0.26 0.24 0.40 1.52 0.02 0.00 0.00 175.26 177.70 1aib s TYR 158 N 0.18 3.42 0.75 1.61 1.13 -0.86 -4.91 117.35 118.68 1aib s TYR 158 Ca -0.14 0.01 -0.11 0.00 -1.41 0.00 0.00 57.07 55.42 1aib s TYR 158 Cb -0.17 -1.67 0.04 0.00 -1.10 0.00 0.00 41.96 39.07 1aib s TYR 158 CO 0.07 0.34 1.09 0.00 -2.51 0.00 0.00 175.55 174.54 1aib s ALA 159 N -2.06 2.52 0.19 9.51 0.00 -1.26 -1.39 121.76 129.28 1aib s ALA 159 Ca 0.36 -0.22 0.00 0.00 0.00 0.00 0.00 51.96 52.10 1aib s ALA 159 Cb -0.09 -3.09 0.00 0.00 0.00 0.00 0.00 23.12 19.94 1aib s ALA 159 CO 0.30 -1.47 0.00 0.98 0.00 0.00 0.00 175.76 175.58 1aib n TYR 160 N -3.25 -3.38 -4.10 0.00 9.36 -1.24 -4.11 117.16 110.45 1aib n TYR 160 Ca 0.07 0.66 -0.32 0.00 3.32 0.00 0.00 57.90 61.63 1aib n TYR 160 Cb 0.56 1.93 -0.07 0.00 -0.63 0.00 0.00 39.34 41.13 1aib n TYR 160 CO 0.00 0.00 0.00 -0.47 0.22 0.00 0.00 176.86 176.61 1aib s TYR 161 N -2.00 3.23 -0.47 2.98 5.04 -1.24 -0.74 117.35 124.15 1aib s TYR 161 Ca 0.00 0.14 -0.12 0.00 -2.44 0.00 0.00 57.07 54.65 1aib s TYR 161 Cb 0.00 -1.68 0.10 0.00 0.35 0.00 0.00 41.96 40.73 1aib s TYR 161 CO 0.00 0.53 0.36 0.34 -1.34 0.00 0.00 175.55 175.44 1aib s ASP 162 N -2.00 5.88 0.59 4.32 -1.08 -0.27 -4.76 116.67 119.36 1aib s ASP 162 Ca 0.25 -1.63 0.35 0.00 -0.52 0.00 0.00 52.55 51.00 1aib s ASP 162 Cb -0.12 -2.08 1.86 0.00 -1.46 0.00 0.00 42.92 41.12 1aib s ASP 162 CO 0.17 -0.67 2.20 0.00 0.52 0.00 0.00 175.17 177.39 1aib h ALA 163 N 8.59 1.17 0.18 3.66 0.00 -1.98 0.08 119.26 130.97 1aib h ALA 163 Ca -0.25 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 1aib h ALA 163 Cb 1.09 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1aib h ALA 163 CO 0.87 0.05 -0.09 0.93 0.00 0.00 0.00 179.25 181.01 1aib h GLU 164 N 0.00 -0.24 -0.00 0.00 5.08 -1.98 -3.40 114.58 114.03 1aib h GLU 164 Ca -0.00 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1aib h GLU 164 Cb 0.19 0.05 0.00 0.00 0.50 0.00 0.00 28.75 29.49 1aib h GLU 164 CO 0.00 -0.16 -0.31 0.09 -1.00 0.00 0.00 179.01 177.63 1aib n ASN 165 N -4.91 0.80 -3.27 1.42 3.02 -1.15 -4.98 115.26 106.19 1aib n ASN 165 Ca -0.03 -0.64 -0.09 0.00 -0.03 0.00 0.00 54.58 53.79 1aib n ASN 165 Cb 0.10 0.14 0.01 0.00 -0.61 0.00 0.00 39.78 39.42 1aib n ASN 165 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1aib n HIS 166 N -0.95 -2.67 -3.52 3.10 8.25 0.00 -5.03 115.22 114.41 1aib n HIS 166 Ca 0.10 1.00 -0.05 0.00 -0.26 0.00 0.00 57.72 58.51 1aib n HIS 166 Cb 0.34 -3.81 0.00 0.00 1.12 0.00 0.00 29.99 27.64 1aib n HIS 166 CO 0.00 0.00 0.00 0.25 0.64 0.00 0.00 176.34 177.23 1aib n THR 167 N -2.28 0.00 -3.20 1.59 -2.24 -1.22 -4.97 114.28 101.96 1aib n THR 167 Ca -0.07 -0.58 -0.43 0.00 -2.27 0.00 0.00 64.05 60.70 1aib n THR 167 Cb 0.56 0.46 -0.07 0.00 -2.10 0.00 0.00 70.33 69.17 1aib n THR 167 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1aib s LEU 168 N 0.00 4.72 -0.37 3.22 0.20 -1.26 -1.11 118.68 124.08 1aib s LEU 168 Ca 0.09 -0.56 -0.11 0.00 0.69 0.00 0.00 54.13 54.24 1aib s LEU 168 Cb -0.02 -2.55 0.02 0.00 -0.43 0.00 0.00 46.19 43.22 1aib s LEU 168 CO 0.07 -0.71 0.22 1.51 -0.29 0.00 0.00 176.35 177.14 1aib s ASP 169 N 2.01 5.78 0.20 3.68 -4.77 0.09 -4.86 116.67 118.80 1aib s ASP 169 Ca 0.17 -0.89 -0.10 0.00 -3.30 0.00 0.00 52.55 48.43 1aib s ASP 169 Cb -0.16 -2.05 0.13 0.00 -1.09 0.00 0.00 42.92 39.76 1aib s ASP 169 CO 0.16 -0.36 1.81 0.15 0.70 0.00 0.00 175.17 177.63 1aib h PHE 170 N 8.46 0.99 0.73 2.11 3.57 -1.94 -2.11 116.94 128.74 1aib h PHE 170 Ca -0.27 -0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.18 1aib h PHE 170 Cb 1.11 -0.32 -0.01 0.00 2.79 0.00 0.00 35.95 39.53 1aib h PHE 170 CO 0.58 0.70 -0.48 -0.44 -2.23 0.00 0.00 178.31 176.45 1aib h ASP 171 N 0.99 -1.22 0.01 0.41 3.32 -1.97 0.12 116.42 118.08 1aib h ASP 171 Ca 0.25 0.07 -0.00 0.00 0.02 0.00 0.00 57.03 57.37 1aib h ASP 171 Cb 0.04 0.36 -0.00 0.00 0.22 0.00 0.00 39.33 39.95 1aib h ASP 171 CO -0.04 -0.72 -0.00 0.00 -1.72 0.00 0.00 179.24 176.76 1aib h ALA 172 N -1.03 1.46 -0.06 3.45 0.00 -1.95 -1.18 119.26 119.96 1aib h ALA 172 Ca -0.10 -0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.65 1aib h ALA 172 Cb 0.93 -0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.73 1aib h ALA 172 CO 0.08 0.00 -0.58 1.25 0.00 0.00 0.00 179.25 180.01 1aib h LEU 173 N 0.00 0.61 -0.36 0.00 5.85 -0.60 -2.53 115.31 118.28 1aib h LEU 173 Ca -0.00 -0.69 -0.08 0.00 0.84 0.00 0.00 57.88 57.95 1aib h LEU 173 Cb 0.01 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 40.84 1aib h LEU 173 CO 0.00 1.21 -0.40 -0.29 -0.34 0.00 0.00 178.44 178.62 1aib h ILE 174 N 0.07 0.76 0.08 4.05 2.10 0.22 -1.84 117.51 122.94 1aib h ILE 174 Ca -0.05 -1.83 -0.25 0.00 1.08 0.00 0.00 64.86 63.80 1aib h ILE 174 Cb 1.24 2.20 0.00 0.00 -1.09 0.00 0.00 36.82 39.17 1aib h ILE 174 CO 0.12 0.39 -1.11 0.78 -1.08 0.00 0.00 178.15 177.25 1aib h ASN 175 N 0.00 0.41 1.28 2.19 2.35 -1.33 -2.75 115.58 117.73 1aib h ASN 175 Ca -0.00 -0.39 -0.08 0.00 -0.55 0.00 0.00 56.30 55.27 1aib h ASN 175 Cb 1.17 -0.13 -0.01 0.00 0.05 0.00 0.00 38.32 39.39 1aib h ASN 175 CO 0.05 1.26 -0.40 0.77 -1.65 0.00 0.00 177.43 177.47 1aib h SER 176 N 0.11 0.00 -0.22 5.81 4.64 -1.16 -2.58 113.55 120.15 1aib h SER 176 Ca -0.10 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.18 1aib h SER 176 Cb 1.80 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.87 1aib h SER 176 CO 0.18 0.40 0.05 0.18 -0.87 0.00 0.00 176.83 176.77 1aib n LEU 177 N -3.31 2.95 -4.94 5.97 4.77 -0.72 -4.74 117.00 116.99 1aib n LEU 177 Ca 0.01 -1.51 -0.24 0.00 -0.03 0.00 0.00 56.01 54.24 1aib n LEU 177 Cb 0.62 -0.57 -0.02 0.00 -2.33 0.00 0.00 43.42 41.12 1aib n LEU 177 CO 0.38 0.44 0.09 0.20 -1.33 0.00 0.00 177.39 177.18 1aib s ASN 178 N -0.14 6.33 0.98 -1.43 0.01 -0.97 -4.52 114.94 115.19 1aib s ASN 178 Ca 0.18 0.38 0.00 0.00 -0.71 0.00 0.00 52.86 52.71 1aib s ASN 178 Cb 0.14 -2.00 0.00 0.00 0.41 0.00 0.00 41.25 39.80 1aib s ASN 178 CO 0.05 -0.18 0.00 1.21 -1.51 0.00 0.00 177.10 176.67 1aib n GLU 179 N -1.37 0.00 -3.89 -0.60 4.07 -1.26 -4.82 120.64 112.76 1aib n GLU 179 Ca -0.05 0.00 -0.34 0.00 -0.06 0.00 0.00 57.16 56.71 1aib n GLU 179 Cb 0.56 0.00 0.01 0.00 -0.06 0.00 0.00 31.44 31.95 1aib n GLU 179 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1aib n ALA 180 N 7.96 -2.37 -0.26 4.31 0.00 -1.26 -4.73 120.51 124.14 1aib n ALA 180 Ca 0.00 -0.42 -0.09 0.00 0.00 0.00 0.00 53.44 52.94 1aib n ALA 180 Cb 0.00 -1.63 0.00 0.00 0.00 0.00 0.00 19.45 17.82 1aib n ALA 180 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1aib n GLN 181 N -3.73 0.00 -1.91 0.00 6.02 -1.26 -4.75 117.38 111.75 1aib n GLN 181 Ca -0.14 0.00 -0.42 0.00 -0.01 0.00 0.00 57.00 56.43 1aib n GLN 181 Cb 0.49 -0.23 -0.02 0.00 1.02 0.00 0.00 30.24 31.50 1aib n GLN 181 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1aib s ALA 182 N -0.45 3.71 0.00 -1.58 0.00 -1.26 -1.81 121.76 120.37 1aib s ALA 182 Ca 0.12 1.42 0.00 0.00 0.00 0.00 0.00 51.96 53.50 1aib s ALA 182 Cb -0.09 -3.60 0.00 0.00 0.00 0.00 0.00 23.12 19.43 1aib s ALA 182 CO 0.16 -0.83 0.00 0.41 0.00 0.00 0.00 175.76 175.50 1aib n GLY 183 N 2.57 0.58 3.85 0.00 0.00 -0.04 -5.00 105.19 107.16 1aib n GLY 183 Ca 0.09 -0.55 -0.32 0.00 0.00 0.00 0.00 46.02 45.23 1aib n GLY 183 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1aib s ASP 184 N -2.50 6.74 -0.15 1.61 1.01 -0.75 -4.48 116.67 118.14 1aib s ASP 184 Ca 0.00 1.19 -0.17 0.00 0.71 0.00 0.00 52.55 54.28 1aib s ASP 184 Cb 0.00 -2.34 -0.04 0.00 1.01 0.00 0.00 42.92 41.55 1aib s ASP 184 CO 0.00 -0.17 0.44 -0.69 0.21 0.00 0.00 175.17 174.96 1aib s VAL 185 N -1.94 5.20 -0.19 -1.27 1.01 -0.65 -0.39 120.40 122.18 1aib s VAL 185 Ca 0.52 0.84 -0.04 0.00 0.00 0.00 0.00 61.98 63.31 1aib s VAL 185 Cb -0.10 -3.78 -0.02 0.00 0.00 0.00 0.00 36.38 32.48 1aib s VAL 185 CO 0.18 0.30 -0.03 -0.69 0.00 0.00 0.00 175.10 174.87 1aib s VAL 186 N 0.88 3.77 -0.29 2.92 1.01 0.33 -0.41 120.40 128.61 1aib s VAL 186 Ca 0.23 -0.38 -0.17 0.00 0.00 0.00 0.00 61.98 61.66 1aib s VAL 186 Cb -0.15 -2.69 -0.02 0.00 0.00 0.00 0.00 36.38 33.52 1aib s VAL 186 CO 0.09 0.45 0.46 -0.22 0.00 0.00 0.00 175.10 175.87 1aib s LEU 187 N 0.88 4.15 -0.17 3.92 0.20 -0.26 -0.54 118.68 126.85 1aib s LEU 187 Ca -0.00 0.25 -0.06 0.00 0.69 0.00 0.00 54.13 55.01 1aib s LEU 187 Cb -0.14 -2.54 -0.03 0.00 -0.43 0.00 0.00 46.19 43.04 1aib s LEU 187 CO 0.02 -0.31 0.02 -0.36 -0.29 0.00 0.00 176.35 175.43 1aib s PHE 188 N 2.23 3.14 -0.26 5.38 0.08 -0.25 -4.53 117.98 123.77 1aib s PHE 188 Ca 0.18 -0.13 -0.29 0.00 0.12 0.00 0.00 56.93 56.81 1aib s PHE 188 Cb -0.16 -2.04 -0.01 0.00 -0.57 0.00 0.00 43.02 40.25 1aib s PHE 188 CO 0.11 0.03 1.39 -1.01 -0.10 0.00 0.00 175.22 175.63 1aib s HIS 189 N 0.46 2.54 0.33 0.36 3.76 -1.26 -0.74 115.29 120.73 1aib s HIS 189 Ca 0.00 0.79 0.19 0.00 -0.15 0.00 0.00 55.06 55.88 1aib s HIS 189 Cb -0.13 -3.88 0.94 0.00 1.11 0.00 0.00 32.58 30.61 1aib s HIS 189 CO 0.02 -2.07 1.88 0.78 -0.85 0.00 0.00 174.74 174.50 1aib h GLY 190 N 10.95 0.00 -3.28 -2.22 0.00 -1.73 -3.46 103.07 103.33 1aib h GLY 190 Ca -0.28 0.00 0.14 0.00 0.00 0.00 0.00 47.33 47.19 1aib h GLY 190 CO 1.02 0.00 0.54 0.00 0.00 0.00 0.00 176.54 178.10 1aib n HIS 193 N -3.68 1.79 -3.25 0.00 -0.00 -1.26 -4.85 115.22 103.97 1aib n HIS 193 Ca -0.10 0.43 -0.41 0.00 0.46 0.00 0.00 57.72 58.11 1aib n HIS 193 Cb 0.62 -2.48 -0.08 0.00 -0.12 0.00 0.00 29.99 27.93 1aib n HIS 193 CO 0.00 0.00 0.00 1.21 0.46 0.00 0.00 176.34 178.01 1aib s ASN 194 N 5.37 6.35 0.00 0.26 2.47 -1.26 -0.45 114.94 127.69 1aib s ASN 194 Ca 1.05 0.22 0.19 0.00 0.42 0.00 0.00 52.86 54.74 1aib s ASN 194 Cb -1.02 -2.27 -0.07 0.00 -1.45 0.00 0.00 41.25 36.44 1aib s ASN 194 CO 0.59 -0.38 0.93 -0.81 -3.72 0.00 0.00 177.10 173.70 1aib n PRO 195 N 5.63 1.22 0.15 0.43 -0.04 -1.26 -2.85 135.00 138.28 1aib n PRO 195 Ca -0.05 -0.62 0.12 0.00 -0.04 0.00 0.00 63.50 62.91 1aib n PRO 195 Cb 0.49 -1.39 0.21 0.00 -0.04 0.00 0.00 33.50 32.78 1aib n PRO 195 CO 0.00 0.00 0.00 1.79 -0.04 0.00 0.00 175.50 177.25 1aib h THR 196 N 1.47 0.00 0.00 0.52 1.35 -1.76 -3.30 112.91 111.19 1aib h THR 196 Ca 0.00 -0.79 0.00 0.00 -0.55 0.00 0.00 66.41 65.07 1aib h THR 196 Cb 0.60 1.67 0.00 0.00 -1.73 0.00 0.00 68.15 68.68 1aib h THR 196 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 1aib n GLY 197 N 1.20 0.23 3.74 5.82 0.00 0.41 -4.29 105.19 112.30 1aib n GLY 197 Ca 0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 1aib n GLY 197 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1aib s ILE 198 N -1.56 5.29 0.06 -0.61 1.01 -1.26 -0.69 121.20 123.43 1aib s ILE 198 Ca 0.00 0.56 0.07 0.00 0.00 0.00 0.00 60.65 61.28 1aib s ILE 198 Cb 0.00 -3.63 -0.03 0.00 0.01 0.00 0.00 42.46 38.81 1aib s ILE 198 CO 0.00 0.41 -0.18 -1.81 0.00 0.00 0.00 174.94 173.36 1aib s ASP 199 N 0.28 2.19 0.54 3.58 1.01 -1.26 -4.51 116.67 118.50 1aib s ASP 199 Ca 0.17 -0.56 -0.21 0.00 0.71 0.00 0.00 52.55 52.67 1aib s ASP 199 Cb -0.13 -0.15 -0.06 0.00 1.01 0.00 0.00 42.92 43.59 1aib s ASP 199 CO 0.05 0.08 1.04 -2.65 0.21 0.00 0.00 175.17 173.89 1aib n PRO 200 N 1.61 1.17 -1.80 8.23 -0.02 -1.26 -5.01 135.00 137.92 1aib n PRO 200 Ca -0.18 0.44 -0.29 0.00 -2.02 0.00 0.00 63.50 61.44 1aib n PRO 200 Cb 0.54 -2.20 0.14 0.00 -0.02 0.00 0.00 33.50 31.95 1aib n PRO 200 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1aib s THR 201 N -1.42 1.98 -0.29 3.45 -4.23 -1.26 -4.75 115.64 109.12 1aib s THR 201 Ca 0.71 0.00 0.26 0.00 -1.18 0.00 0.00 61.69 61.49 1aib s THR 201 Cb -0.45 -2.93 0.28 0.00 1.34 0.00 0.00 72.50 70.74 1aib s THR 201 CO 0.50 0.00 1.79 0.25 -0.54 0.00 0.00 174.62 176.62 1aib h LEU 202 N -1.42 0.00 0.11 4.79 7.12 -1.99 0.11 115.31 124.04 1aib h LEU 202 Ca -0.46 0.00 -0.16 0.00 0.13 0.00 0.00 57.88 57.39 1aib h LEU 202 Cb 1.30 0.00 0.02 0.00 -0.53 0.00 0.00 40.66 41.44 1aib h LEU 202 CO 0.54 0.00 -0.69 -0.33 -0.13 0.00 0.00 178.44 177.83 1aib h GLU 203 N 0.00 0.24 -0.31 1.25 5.08 -1.99 -2.97 114.58 115.88 1aib h GLU 203 Ca 0.00 -0.41 0.02 0.00 -1.00 0.00 0.00 59.36 57.96 1aib h GLU 203 Cb 0.35 0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.73 1aib h GLU 203 CO 0.00 1.20 0.17 1.96 -1.00 0.00 0.00 179.01 181.33 1aib h GLN 204 N -0.49 0.33 -0.57 2.33 4.20 -1.82 -1.01 115.11 118.09 1aib h GLN 204 Ca -0.12 -0.02 0.02 0.00 0.06 0.00 0.00 58.65 58.58 1aib h GLN 204 Cb 1.53 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 29.20 1aib h GLN 204 CO 0.12 0.22 0.36 -1.49 -0.67 0.00 0.00 178.83 177.37 1aib h TRP 205 N 0.34 0.68 -0.90 2.96 4.06 -0.89 0.38 115.95 122.58 1aib h TRP 205 Ca 0.13 0.02 0.05 0.00 2.06 0.00 0.00 58.89 61.14 1aib h TRP 205 Cb 0.02 -0.23 -0.06 0.00 -1.00 0.00 0.00 29.16 27.90 1aib h TRP 205 CO -0.09 0.41 0.59 1.96 -3.56 0.00 0.00 178.44 177.75 1aib h GLN 206 N 0.73 1.05 0.22 0.49 4.20 -1.32 0.15 115.11 120.63 1aib h GLN 206 Ca 0.22 -0.06 -0.01 0.00 0.06 0.00 0.00 58.65 58.85 1aib h GLN 206 Cb -0.04 -0.24 0.00 0.00 0.30 0.00 0.00 27.48 27.51 1aib h GLN 206 CO -0.07 0.70 -0.10 1.15 -0.67 0.00 0.00 178.83 179.83 1aib h THR 207 N 1.08 0.86 -0.07 -0.54 2.02 -0.12 -1.34 112.91 114.80 1aib h THR 207 Ca 0.37 -0.48 0.02 0.00 0.77 0.00 0.00 66.41 67.10 1aib h THR 207 Cb 0.10 1.14 -0.00 0.00 -1.74 0.00 0.00 68.15 67.64 1aib h THR 207 CO -0.13 0.11 0.07 -0.07 0.37 0.00 0.00 175.52 175.87 1aib h LEU 208 N -0.53 0.00 -0.09 2.58 3.38 -0.07 0.14 115.31 120.72 1aib h LEU 208 Ca -0.03 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.69 1aib h LEU 208 Cb 0.40 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.16 1aib h LEU 208 CO 0.05 0.00 -0.97 0.00 0.09 0.00 0.00 178.44 177.61 1aib h ALA 209 N 1.92 0.24 0.18 1.53 0.00 -0.27 -0.48 119.26 122.37 1aib h ALA 209 Ca 0.03 -0.69 -0.01 0.00 0.00 0.00 0.00 54.91 54.25 1aib h ALA 209 Cb 0.18 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1aib h ALA 209 CO -0.00 0.73 -0.08 1.96 0.00 0.00 0.00 179.25 181.85 1aib h GLN 210 N 0.36 -0.23 -0.24 0.00 4.20 -0.05 -2.61 115.11 116.54 1aib h GLN 210 Ca -0.10 0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.61 1aib h GLN 210 Cb 1.62 0.05 -0.01 0.00 0.30 0.00 0.00 27.48 29.43 1aib h GLN 210 CO 0.18 0.15 0.08 1.25 -0.67 0.00 0.00 178.83 179.82 1aib h LEU 211 N -0.66 0.30 -0.76 1.46 5.85 -0.84 -2.32 115.31 118.35 1aib h LEU 211 Ca -0.02 -0.03 -0.08 0.00 0.84 0.00 0.00 57.88 58.59 1aib h LEU 211 Cb 0.48 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.41 1aib h LEU 211 CO 0.04 0.30 0.03 -1.28 -0.34 0.00 0.00 178.44 177.19 1aib h SER 212 N 0.34 0.93 0.96 1.25 0.87 -0.94 -1.68 113.55 115.28 1aib h SER 212 Ca 0.09 -0.24 -0.18 0.00 -1.23 0.00 0.00 61.79 60.23 1aib h SER 212 Cb 0.11 -0.25 -0.03 0.00 -0.44 0.00 0.00 62.40 61.79 1aib h SER 212 CO -0.01 0.98 -0.85 -0.37 -0.53 0.00 0.00 176.83 176.05 1aib h VAL 213 N 0.90 1.55 0.11 2.23 -1.51 -1.04 -2.47 116.25 116.01 1aib h VAL 213 Ca 0.17 -2.96 -0.01 0.00 -1.23 0.00 0.00 66.70 62.68 1aib h VAL 213 Cb 0.49 2.62 0.00 0.00 -2.13 0.00 0.00 31.29 32.27 1aib h VAL 213 CO 0.02 0.83 -0.05 -0.08 -1.23 0.00 0.00 177.57 177.06 1aib h GLU 214 N 0.00 -0.14 0.00 5.19 4.81 -1.36 -3.23 114.58 119.85 1aib h GLU 214 Ca -0.01 0.01 -0.08 0.00 -0.13 0.00 0.00 59.36 59.15 1aib h GLU 214 Cb 1.55 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 30.95 1aib h GLU 214 CO 0.11 0.06 -0.40 0.87 -0.73 0.00 0.00 179.01 178.91 1aib h LYS 215 N -0.31 0.00 -0.04 1.92 6.56 -1.40 -3.49 116.57 119.81 1aib h LYS 215 Ca -0.01 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.58 1aib h LYS 215 Cb 0.26 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.92 1aib h LYS 215 CO 0.02 0.40 0.00 0.41 -2.06 0.00 0.00 179.45 178.23 1aib n GLY 216 N 0.43 0.62 3.86 3.86 0.00 -0.94 -4.09 105.19 108.93 1aib n GLY 216 Ca 0.00 -0.76 -0.31 0.00 0.00 0.00 0.00 46.02 44.96 1aib n GLY 216 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1aib s TRP 217 N -2.04 3.51 -0.35 1.61 0.51 -1.13 -0.87 118.94 120.18 1aib s TRP 217 Ca 0.00 1.33 -0.10 0.00 -2.12 0.00 0.00 56.10 55.21 1aib s TRP 217 Cb 0.00 -2.76 0.02 0.00 -0.81 0.00 0.00 33.47 29.92 1aib s TRP 217 CO 0.00 -0.78 0.17 -1.17 -0.51 0.00 0.00 176.95 174.66 1aib s LEU 218 N -5.17 4.44 0.33 2.99 2.96 0.48 -4.87 118.68 119.84 1aib s LEU 218 Ca 0.56 -0.84 -0.23 0.00 -0.22 0.00 0.00 54.13 53.40 1aib s LEU 218 Cb -0.12 -1.99 -0.10 0.00 0.50 0.00 0.00 46.19 44.48 1aib s LEU 218 CO 0.52 -0.31 0.89 -2.16 -1.32 0.00 0.00 176.35 173.97 1aib s PRO 219 N 1.56 4.40 -0.22 0.98 0.04 -1.26 -0.51 135.00 139.98 1aib s PRO 219 Ca 0.03 1.14 -0.02 0.00 0.04 0.00 0.00 61.00 62.19 1aib s PRO 219 Cb -0.18 -2.64 0.07 0.00 0.04 0.00 0.00 34.50 31.78 1aib s PRO 219 CO 0.06 0.22 0.03 -1.17 0.04 0.00 0.00 177.00 176.18 1aib s LEU 220 N -2.37 1.61 -0.07 -3.56 0.20 0.29 -3.06 118.68 111.72 1aib s LEU 220 Ca 0.52 -1.02 -0.27 0.00 0.69 0.00 0.00 54.13 54.05 1aib s LEU 220 Cb -0.15 -0.75 -0.03 0.00 -0.43 0.00 0.00 46.19 44.83 1aib s LEU 220 CO 0.20 -0.31 0.86 -0.36 -0.29 0.00 0.00 176.35 176.46 1aib s PHE 221 N 1.73 3.57 -0.36 5.38 0.40 0.10 -1.09 117.98 127.71 1aib s PHE 221 Ca -0.00 1.46 -0.11 0.00 -0.60 0.00 0.00 56.93 57.67 1aib s PHE 221 Cb -0.17 -3.01 0.02 0.00 0.51 0.00 0.00 43.02 40.37 1aib s PHE 221 CO -0.10 -0.05 0.21 0.34 0.70 0.00 0.00 175.22 176.32 1aib s ASP 222 N 0.98 5.76 -0.89 1.36 2.15 0.08 -1.10 116.67 125.00 1aib s ASP 222 Ca 0.44 -0.86 -0.01 0.00 0.43 0.00 0.00 52.55 52.55 1aib s ASP 222 Cb -0.19 -2.04 0.22 0.00 -0.30 0.00 0.00 42.92 40.61 1aib s ASP 222 CO 0.21 -0.35 0.80 0.33 -0.17 0.00 0.00 175.17 175.98 1aib n PHE 223 N 5.02 4.15 0.82 -5.34 -0.00 0.57 -1.85 117.46 120.82 1aib n PHE 223 Ca -0.12 -4.11 0.09 0.00 -0.00 0.00 0.00 57.45 53.31 1aib n PHE 223 Cb 0.47 -1.11 0.04 0.00 -0.00 0.00 0.00 39.48 38.87 1aib n PHE 223 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 1aib n ALA 224 N 2.22 2.92 -2.46 3.13 0.00 -1.26 -2.66 120.51 122.40 1aib n ALA 224 Ca 0.22 -0.61 0.02 0.00 0.00 0.00 0.00 53.44 53.07 1aib n ALA 224 Cb 0.37 -0.65 0.05 0.00 0.00 0.00 0.00 19.45 19.21 1aib n ALA 224 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1aib n TYR 225 N 0.48 0.37 -1.68 0.00 4.01 -1.26 -4.29 117.16 114.79 1aib n TYR 225 Ca 0.09 -1.03 -0.46 0.00 -0.16 0.00 0.00 57.90 56.34 1aib n TYR 225 Cb 0.44 -0.18 -0.04 0.00 -0.31 0.00 0.00 39.34 39.24 1aib n TYR 225 CO 0.00 0.00 0.00 0.94 -0.46 0.00 0.00 176.86 177.34 1aib n GLN 226 N 0.04 2.36 0.00 -0.72 7.27 -1.26 -1.08 117.38 124.00 1aib n GLN 226 Ca 0.09 0.86 0.00 0.00 0.07 0.00 0.00 57.00 58.02 1aib n GLN 226 Cb 1.02 -2.73 0.00 0.00 2.41 0.00 0.00 30.24 30.94 1aib n GLN 226 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1aib n GLY 227 N 4.33 0.66 0.25 1.69 0.00 -1.26 -4.74 105.19 106.12 1aib n GLY 227 Ca 0.21 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.35 1aib n GLY 227 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1aib n PHE 228 N -1.14 0.00 0.00 1.61 3.01 -0.24 -4.31 117.46 116.39 1aib n PHE 228 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.46 1aib n PHE 228 Cb 0.00 -0.07 0.00 0.00 -0.01 0.00 0.00 39.48 39.40 1aib n PHE 228 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1aib n ALA 229 N -0.73 0.00 -0.02 4.37 0.00 -1.26 -3.33 120.51 119.53 1aib n ALA 229 Ca 0.08 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.45 1aib n ALA 229 Cb 0.39 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.84 1aib n ALA 229 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1aib n ARG 230 N -1.71 4.67 0.00 0.00 0.63 -1.26 -4.76 116.66 114.23 1aib n ARG 230 Ca 0.00 -0.03 0.00 0.00 -0.92 0.00 0.00 57.85 56.90 1aib n ARG 230 Cb 0.00 -0.41 0.00 0.00 0.45 0.00 0.00 32.46 32.50 1aib n ARG 230 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1aib n GLY 231 N 0.68 4.28 0.55 5.14 0.00 -1.26 -4.93 105.19 109.64 1aib n GLY 231 Ca 0.00 -0.98 0.36 0.00 0.00 0.00 0.00 46.02 45.40 1aib n GLY 231 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1aib h LEU 233 N 0.00 0.00 0.00 0.99 5.85 -1.89 -0.91 115.31 119.35 1aib h LEU 233 Ca 0.00 0.00 -0.39 0.00 0.84 0.00 0.00 57.88 58.33 1aib h LEU 233 Cb 0.00 0.00 -0.07 0.00 0.37 0.00 0.00 40.66 40.96 1aib h LEU 233 CO 0.00 0.00 -2.47 -0.62 -0.34 0.00 0.00 178.44 175.01 1aib n GLU 234 N -3.89 0.65 -0.29 1.25 -0.58 -1.26 -4.23 120.64 112.29 1aib n GLU 234 Ca 0.27 0.14 -0.01 0.00 -0.42 0.00 0.00 57.16 57.14 1aib n GLU 234 Cb 1.38 -1.52 0.17 0.00 -0.57 0.00 0.00 31.44 30.90 1aib n GLU 234 CO 0.00 0.00 0.00 0.93 -0.48 0.00 0.00 177.13 177.58 1aib h GLU 235 N 0.00 1.15 0.00 3.49 5.08 -1.83 -0.86 114.58 121.61 1aib h GLU 235 Ca -0.58 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 57.70 1aib h GLU 235 Cb 1.92 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 30.91 1aib h GLU 235 CO -0.08 0.78 0.00 -0.25 -1.00 0.00 0.00 179.01 178.45 1aib n ASP 236 N -4.39 0.28 -0.79 1.42 9.92 -0.38 -2.25 116.55 120.37 1aib n ASP 236 Ca 0.10 0.57 0.07 0.00 -0.53 0.00 0.00 54.79 55.00 1aib n ASP 236 Cb 0.04 -0.63 0.19 0.00 -0.64 0.00 0.00 41.12 40.08 1aib n ASP 236 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1aib n ALA 237 N -1.62 2.35 -0.35 2.24 0.00 -0.34 -4.50 120.51 118.29 1aib n ALA 237 Ca 0.03 -1.34 0.09 0.00 0.00 0.00 0.00 53.44 52.22 1aib n ALA 237 Cb 0.18 -0.55 0.26 0.00 0.00 0.00 0.00 19.45 19.35 1aib n ALA 237 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1aib h GLU 238 N 2.30 0.84 0.17 0.00 5.08 -1.33 0.11 114.58 121.75 1aib h GLU 238 Ca 0.00 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 1aib h GLU 238 Cb 0.89 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.94 1aib h GLU 238 CO 0.04 0.55 -0.15 0.78 -1.00 0.00 0.00 179.01 179.24 1aib h GLY 239 N 0.86 -0.79 0.30 -3.84 0.00 -1.81 0.47 103.07 98.27 1aib h GLY 239 Ca 0.52 0.35 0.14 0.00 0.00 0.00 0.00 47.33 48.34 1aib h GLY 239 CO -0.32 -0.27 0.54 -2.00 0.00 0.00 0.00 176.54 174.49 1aib h LEU 240 N -0.31 0.73 -1.23 3.11 5.85 -1.77 -0.70 115.31 120.98 1aib h LEU 240 Ca -0.02 0.08 -0.07 0.00 0.84 0.00 0.00 57.88 58.70 1aib h LEU 240 Cb 0.27 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.23 1aib h LEU 240 CO -0.00 0.33 -0.33 0.03 -0.34 0.00 0.00 178.44 178.13 1aib h ARG 241 N 0.79 0.00 -0.11 1.25 3.08 -0.50 0.20 114.38 119.09 1aib h ARG 241 Ca 0.50 0.00 -0.05 0.00 0.07 0.00 0.00 59.98 60.50 1aib h ARG 241 Cb 0.64 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.69 1aib h ARG 241 CO -0.33 0.33 -0.12 0.00 -1.07 0.00 0.00 179.97 178.79 1aib h ALA 242 N 1.67 0.17 -0.72 0.04 0.00 0.15 -2.40 119.26 118.16 1aib h ALA 242 Ca -0.00 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 1aib h ALA 242 Cb 0.71 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.43 1aib h ALA 242 CO 0.04 0.03 0.40 0.74 0.00 0.00 0.00 179.25 180.46 1aib h PHE 243 N -0.12 0.98 0.00 0.00 -1.00 -1.32 -2.11 116.94 113.36 1aib h PHE 243 Ca 0.02 -0.02 -0.02 0.00 2.81 0.00 0.00 57.97 60.76 1aib h PHE 243 Cb 0.65 -0.32 -0.00 0.00 3.61 0.00 0.00 35.95 39.89 1aib h PHE 243 CO 0.09 0.69 -0.08 0.00 -1.61 0.00 0.00 178.31 177.41 1aib h ALA 244 N 1.20 1.27 -0.41 2.45 0.00 -0.89 -1.62 119.26 121.25 1aib h ALA 244 Ca 0.25 -0.07 -0.13 0.00 0.00 0.00 0.00 54.91 54.97 1aib h ALA 244 Cb 0.03 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1aib h ALA 244 CO -0.04 0.10 -0.25 0.00 0.00 0.00 0.00 179.25 179.06 1aib h ALA 245 N 1.92 0.79 0.00 0.00 0.00 -0.85 -3.30 119.26 117.82 1aib h ALA 245 Ca -0.00 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.52 1aib h ALA 245 Cb 0.25 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 17.89 1aib h ALA 245 CO 0.01 0.65 -1.53 -1.33 0.00 0.00 0.00 179.25 177.05 1aib n MET 246 N -4.10 0.55 -3.80 0.00 2.81 -0.93 -4.98 117.12 106.68 1aib n MET 246 Ca -0.00 -0.07 -0.24 0.00 -1.81 0.00 0.00 57.70 55.57 1aib n MET 246 Cb 0.46 -1.61 -0.02 0.00 -0.71 0.00 0.00 33.22 31.33 1aib n MET 246 CO 0.00 0.00 0.00 -1.01 1.51 0.00 0.00 175.97 176.47 1aib s HIS 247 N -3.40 3.47 -0.14 2.03 3.76 -0.66 -4.97 115.29 115.39 1aib s HIS 247 Ca -0.03 0.16 -0.08 0.00 -0.15 0.00 0.00 55.06 54.96 1aib s HIS 247 Cb 0.13 -1.72 -0.24 0.00 1.11 0.00 0.00 32.58 31.86 1aib s HIS 247 CO 0.86 0.39 0.30 1.63 -0.85 0.00 0.00 174.74 177.06 1aib n LYS 248 N -1.11 0.73 -4.46 1.40 4.76 -1.26 -4.92 118.16 113.30 1aib n LYS 248 Ca -0.07 0.30 -0.23 0.00 -2.87 0.00 0.00 58.31 55.44 1aib n LYS 248 Cb 0.55 -1.70 -0.14 0.00 -1.84 0.00 0.00 35.03 31.91 1aib n LYS 248 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 1aib s GLU 249 N -2.53 1.13 -0.11 1.97 2.02 -1.26 -2.62 118.70 117.30 1aib s GLU 249 Ca -0.24 -0.87 -0.30 0.00 0.02 0.00 0.00 54.97 53.58 1aib s GLU 249 Cb 0.07 -1.20 0.12 0.00 0.10 0.00 0.00 34.13 33.22 1aib s GLU 249 CO 0.73 0.30 1.01 -1.17 0.02 0.00 0.00 175.26 176.15 1aib s LEU 250 N -1.23 -0.31 -0.03 1.80 0.20 -0.73 -4.69 118.68 113.68 1aib s LEU 250 Ca 0.04 0.16 -0.01 0.00 0.69 0.00 0.00 54.13 55.02 1aib s LEU 250 Cb -0.08 1.81 0.03 0.00 -0.43 0.00 0.00 46.19 47.52 1aib s LEU 250 CO 0.02 -0.42 0.06 -0.63 -0.29 0.00 0.00 176.35 175.09 1aib s ILE 251 N -2.10 -0.07 -0.04 6.68 1.01 -1.17 -0.95 121.20 124.55 1aib s ILE 251 Ca 0.03 0.23 0.06 0.00 0.00 0.00 0.00 60.65 60.97 1aib s ILE 251 Cb -0.01 -0.12 -0.01 0.00 0.01 0.00 0.00 42.46 42.33 1aib s ILE 251 CO -0.04 0.09 -0.23 -0.69 0.00 0.00 0.00 174.94 174.08 1aib s VAL 252 N 1.20 1.87 -0.14 2.92 1.01 -0.40 -0.72 120.40 126.14 1aib s VAL 252 Ca -0.08 -0.98 -0.01 0.00 0.00 0.00 0.00 61.98 60.91 1aib s VAL 252 Cb -0.13 -1.57 0.04 0.00 0.00 0.00 0.00 36.38 34.72 1aib s VAL 252 CO -0.04 0.52 -0.03 0.00 0.00 0.00 0.00 175.10 175.56 1aib s ALA 253 N -0.25 1.17 0.25 5.51 0.00 -0.26 -0.58 121.76 127.60 1aib s ALA 253 Ca 0.00 -0.58 0.07 0.00 0.00 0.00 0.00 51.96 51.46 1aib s ALA 253 Cb -0.12 -1.00 -0.05 0.00 0.00 0.00 0.00 23.12 21.95 1aib s ALA 253 CO 0.02 -0.71 -0.10 -1.54 0.00 0.00 0.00 175.76 173.43 1aib s SER 254 N 1.77 2.71 -0.02 0.00 1.04 -0.43 -0.31 113.70 118.45 1aib s SER 254 Ca 0.02 -1.11 0.01 0.00 0.48 0.00 0.00 55.95 55.35 1aib s SER 254 Cb -0.14 -0.16 0.01 0.00 0.10 0.00 0.00 66.02 65.83 1aib s SER 254 CO -0.07 -0.26 -0.04 -0.55 0.98 0.00 0.00 173.24 173.30 1aib s SER 255 N -3.39 0.73 -0.06 7.02 0.15 -1.09 -0.77 113.70 116.29 1aib s SER 255 Ca 0.27 -0.10 0.15 0.00 0.70 0.00 0.00 55.95 56.97 1aib s SER 255 Cb 0.01 -0.26 0.53 0.00 -1.71 0.00 0.00 66.02 64.60 1aib s SER 255 CO 0.10 -0.01 1.42 -1.22 1.20 0.00 0.00 173.24 174.73 1aib n TYR 256 N 3.60 1.00 0.14 3.44 4.01 -0.56 -4.42 117.16 124.36 1aib n TYR 256 Ca -0.21 -0.42 -0.01 0.00 -0.16 0.00 0.00 57.90 57.10 1aib n TYR 256 Cb 0.54 -0.13 0.22 0.00 -0.31 0.00 0.00 39.34 39.65 1aib n TYR 256 CO 0.00 0.00 0.00 0.77 -0.46 0.00 0.00 176.86 177.17 1aib h SER 257 N 3.17 0.07 0.00 7.72 0.02 -1.85 -2.78 113.55 119.89 1aib h SER 257 Ca 0.00 -0.04 -0.21 0.00 -0.84 0.00 0.00 61.79 60.71 1aib h SER 257 Cb 1.01 -0.02 -0.03 0.00 0.14 0.00 0.00 62.40 63.50 1aib h SER 257 CO 0.12 0.59 -1.20 1.41 -1.14 0.00 0.00 176.83 176.60 1aib n HIS 258 N -3.92 0.97 1.40 3.45 8.25 -1.26 -3.03 115.22 121.08 1aib n HIS 258 Ca -0.02 0.42 0.12 0.00 -0.26 0.00 0.00 57.72 57.98 1aib n HIS 258 Cb 0.55 -1.05 0.68 0.00 1.12 0.00 0.00 29.99 31.29 1aib n HIS 258 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1aib n ASN 259 N -4.45 0.00 0.00 0.41 2.04 -1.26 -2.89 115.26 109.11 1aib n ASN 259 Ca -0.29 -0.56 0.00 0.00 -0.44 0.00 0.00 54.58 53.29 1aib n ASN 259 Cb 0.63 -0.08 0.00 0.00 -2.53 0.00 0.00 39.78 37.80 1aib n ASN 259 CO 0.00 0.00 0.00 0.49 -0.44 0.00 0.00 177.26 177.31 1aib n PHE 260 N -1.08 0.00 -3.25 -2.53 3.01 -1.05 -4.83 117.46 107.73 1aib n PHE 260 Ca 0.16 -0.06 -0.23 0.00 1.01 0.00 0.00 57.45 58.33 1aib n PHE 260 Cb 0.11 -0.01 0.02 0.00 -0.01 0.00 0.00 39.48 39.59 1aib n PHE 260 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1aib n GLY 261 N -0.06 -0.50 1.36 1.37 0.00 -1.14 -4.60 105.19 101.61 1aib n GLY 261 Ca 0.00 0.12 -0.04 0.00 0.00 0.00 0.00 46.02 46.10 1aib n GLY 261 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1aib n LEU 262 N -3.94 4.71 -0.14 0.99 7.94 -1.17 -4.74 117.00 120.65 1aib n LEU 262 Ca -0.05 -3.47 -0.04 0.00 -1.11 0.00 0.00 56.01 51.34 1aib n LEU 262 Cb 0.57 -0.66 -0.03 0.00 0.53 0.00 0.00 43.42 43.83 1aib n LEU 262 CO 0.51 1.01 0.47 -1.22 -1.11 0.00 0.00 177.39 177.06 1aib n TYR 263 N -0.83 -0.15 1.57 1.96 4.01 -1.23 -1.51 117.16 120.98 1aib n TYR 263 Ca 0.35 0.43 0.01 0.00 -0.16 0.00 0.00 57.90 58.52 1aib n TYR 263 Cb 1.14 -0.51 0.02 0.00 -0.31 0.00 0.00 39.34 39.68 1aib n TYR 263 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 1aib n ASN 264 N -3.76 0.57 -0.00 7.72 0.23 -1.26 -2.38 115.26 116.38 1aib n ASN 264 Ca 0.01 -2.02 0.10 0.00 -0.53 0.00 0.00 54.58 52.14 1aib n ASN 264 Cb 0.09 -0.17 -0.13 0.00 -2.08 0.00 0.00 39.78 37.49 1aib n ASN 264 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 1aib n GLU 265 N -0.24 0.28 -2.43 -3.83 -0.58 -0.57 -5.03 120.64 108.23 1aib n GLU 265 Ca 0.02 -0.05 -0.02 0.00 -0.42 0.00 0.00 57.16 56.69 1aib n GLU 265 Cb 0.12 -1.48 0.00 0.00 -0.57 0.00 0.00 31.44 29.51 1aib n GLU 265 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1aib n ARG 266 N -1.66 -1.13 -5.18 3.49 5.12 -1.00 -4.56 116.66 111.73 1aib n ARG 266 Ca 0.02 1.31 -0.31 0.00 -1.93 0.00 0.00 57.85 56.94 1aib n ARG 266 Cb 0.38 -4.19 -0.17 0.00 -1.16 0.00 0.00 32.46 27.31 1aib n ARG 266 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1aib s VAL 267 N -2.58 2.00 0.01 1.55 1.01 -1.26 -2.91 120.40 118.21 1aib s VAL 267 Ca 0.07 -0.99 -0.29 0.00 0.00 0.00 0.00 61.98 60.77 1aib s VAL 267 Cb -0.02 -1.72 0.10 0.00 0.00 0.00 0.00 36.38 34.74 1aib s VAL 267 CO 0.48 0.55 1.26 -0.83 0.00 0.00 0.00 175.10 176.56 1aib s GLY 268 N 0.29 -0.24 0.05 4.51 0.00 -1.17 -1.49 107.32 109.27 1aib s GLY 268 Ca -0.17 0.30 -0.12 0.00 0.00 0.00 0.00 44.72 44.73 1aib s GLY 268 CO 0.08 2.75 0.26 0.00 0.00 0.00 0.00 173.10 176.19 1aib s ALA 269 N -2.24 -0.54 -0.29 3.20 0.00 0.05 -0.92 121.76 121.02 1aib s ALA 269 Ca 0.22 -0.15 0.02 0.00 0.00 0.00 0.00 51.96 52.05 1aib s ALA 269 Cb 0.02 0.34 0.08 0.00 0.00 0.00 0.00 23.12 23.55 1aib s ALA 269 CO -0.01 -0.41 -0.02 0.00 0.00 0.00 0.00 175.76 175.31 1aib s THR 271 N 1.15 5.34 -0.28 0.00 2.01 0.25 -1.38 115.64 122.74 1aib s THR 271 Ca 0.00 0.44 -0.01 0.00 0.31 0.00 0.00 61.69 62.43 1aib s THR 271 Cb -0.19 -3.51 0.05 0.00 0.01 0.00 0.00 72.50 68.85 1aib s THR 271 CO -0.08 0.60 -0.04 -0.22 -0.69 0.00 0.00 174.62 174.19 1aib s LEU 272 N -1.03 3.61 -0.09 4.42 0.20 0.03 -1.28 118.68 124.54 1aib s LEU 272 Ca 0.18 -1.19 -0.01 0.00 0.69 0.00 0.00 54.13 53.80 1aib s LEU 272 Cb -0.14 -1.66 -0.03 0.00 -0.43 0.00 0.00 46.19 43.93 1aib s LEU 272 CO 0.07 -0.21 -0.04 0.54 -0.29 0.00 0.00 176.35 176.42 1aib s VAL 273 N 1.24 3.90 0.37 1.68 0.11 -0.13 -1.17 120.40 126.41 1aib s VAL 273 Ca -0.05 -0.40 0.07 0.00 -2.93 0.00 0.00 61.98 58.68 1aib s VAL 273 Cb -0.19 -2.63 -0.07 0.00 -1.53 0.00 0.00 36.38 31.96 1aib s VAL 273 CO -0.03 0.58 -0.01 0.00 -3.33 0.00 0.00 175.10 172.32 1aib s ALA 274 N -0.65 2.90 0.52 1.54 0.00 -0.38 -1.78 121.76 123.91 1aib s ALA 274 Ca 0.10 -2.19 0.21 0.00 0.00 0.00 0.00 51.96 50.09 1aib s ALA 274 Cb -0.12 0.22 1.41 0.00 0.00 0.00 0.00 23.12 24.64 1aib s ALA 274 CO 0.02 -0.11 2.14 0.00 0.00 0.00 0.00 175.76 177.81 1aib h ALA 275 N 1.93 1.71 -2.88 0.00 0.00 -1.80 -3.44 119.26 114.77 1aib h ALA 275 Ca -0.43 -0.05 0.07 0.00 0.00 0.00 0.00 54.91 54.51 1aib h ALA 275 Cb 1.24 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 18.95 1aib h ALA 275 CO 0.76 0.06 0.27 0.16 0.00 0.00 0.00 179.25 180.50 1aib s ASP 276 N -6.67 -0.31 0.12 0.00 1.47 -1.26 -5.01 116.67 105.01 1aib s ASP 276 Ca -0.05 -0.45 -0.24 0.00 1.18 0.00 0.00 52.55 52.99 1aib s ASP 276 Cb 0.16 0.66 -0.06 0.00 -0.34 0.00 0.00 42.92 43.33 1aib s ASP 276 CO 0.63 -1.20 1.42 -1.28 0.68 0.00 0.00 175.17 175.42 1aib h SER 277 N 2.00 -1.59 -0.98 2.11 0.87 -1.76 -1.38 113.55 112.82 1aib h SER 277 Ca -0.22 0.23 0.12 0.00 -1.23 0.00 0.00 61.79 60.69 1aib h SER 277 Cb 1.26 0.69 -0.08 0.00 -0.44 0.00 0.00 62.40 63.82 1aib h SER 277 CO 0.26 -0.22 0.62 -0.08 -0.53 0.00 0.00 176.83 176.88 1aib h GLU 278 N -0.10 0.93 -0.04 2.24 4.81 -1.96 -0.41 114.58 120.04 1aib h GLU 278 Ca 0.10 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 59.25 1aib h GLU 278 Cb 0.36 -0.21 -0.00 0.00 0.63 0.00 0.00 28.75 29.53 1aib h GLU 278 CO -0.63 0.61 -0.07 1.15 -0.73 0.00 0.00 179.01 179.35 1aib h THR 279 N 0.95 1.42 0.00 0.32 2.02 -1.91 0.15 112.91 115.85 1aib h THR 279 Ca 0.48 -1.34 -0.02 0.00 0.77 0.00 0.00 66.41 66.30 1aib h THR 279 Cb 0.50 2.22 -0.00 0.00 -1.74 0.00 0.00 68.15 69.13 1aib h THR 279 CO -0.25 0.36 -0.11 -0.37 0.37 0.00 0.00 175.52 175.53 1aib h VAL 280 N -0.39 0.68 0.10 3.16 -1.51 -0.30 -0.16 116.25 117.83 1aib h VAL 280 Ca 0.00 -0.43 -0.28 0.00 -1.23 0.00 0.00 66.70 64.77 1aib h VAL 280 Cb 0.62 1.26 0.02 0.00 -2.13 0.00 0.00 31.29 31.06 1aib h VAL 280 CO 0.02 0.10 -1.18 0.44 -1.23 0.00 0.00 177.57 175.72 1aib h ASP 281 N 0.00 0.68 0.01 4.19 5.19 -0.88 -0.89 116.42 124.72 1aib h ASP 281 Ca -0.00 -0.63 -0.00 0.00 -0.62 0.00 0.00 57.03 55.78 1aib h ASP 281 Cb 0.26 -0.21 0.00 0.00 0.18 0.00 0.00 39.33 39.55 1aib h ASP 281 CO 0.01 1.45 -0.01 -0.09 -3.12 0.00 0.00 179.24 177.49 1aib h ARG 282 N 0.21 -0.02 -0.39 3.56 2.43 0.15 -2.56 114.38 117.77 1aib h ARG 282 Ca -0.15 0.00 -0.03 0.00 -0.81 0.00 0.00 59.98 58.99 1aib h ARG 282 Cb 1.85 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 31.39 1aib h ARG 282 CO 0.21 0.15 0.11 0.00 -1.51 0.00 0.00 179.97 178.93 1aib h ALA 283 N 0.80 1.47 0.00 2.80 0.00 -1.17 -3.09 119.26 120.08 1aib h ALA 283 Ca -0.00 -0.14 -0.10 0.00 0.00 0.00 0.00 54.91 54.66 1aib h ALA 283 Cb 0.18 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 1aib h ALA 283 CO 0.00 0.39 -0.49 0.35 0.00 0.00 0.00 179.25 179.50 1aib h PHE 284 N 0.55 0.00 -0.47 0.00 3.57 -1.00 -1.98 116.94 117.62 1aib h PHE 284 Ca 0.13 0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.54 1aib h PHE 284 Cb 0.19 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 38.91 1aib h PHE 284 CO 0.01 0.49 -0.08 0.66 -2.23 0.00 0.00 178.31 177.16 1aib h SER 285 N 0.00 0.88 0.70 0.41 4.64 -1.37 0.25 113.55 119.05 1aib h SER 285 Ca -0.00 -0.35 -0.04 0.00 -0.47 0.00 0.00 61.79 60.93 1aib h SER 285 Cb 1.16 -0.24 -0.01 0.00 -0.31 0.00 0.00 62.40 63.01 1aib h SER 285 CO 0.06 1.02 -0.19 1.56 -0.87 0.00 0.00 176.83 178.41 1aib h GLN 286 N 0.72 0.00 -0.28 4.77 1.08 -1.53 0.12 115.11 119.99 1aib h GLN 286 Ca 0.12 0.00 -0.14 0.00 -1.45 0.00 0.00 58.65 57.19 1aib h GLN 286 Cb 0.62 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.04 1aib h GLN 286 CO 0.04 0.19 -0.38 1.98 -0.95 0.00 0.00 178.83 179.71 1aib h MET 287 N 0.00 0.65 -0.40 1.46 4.05 -0.73 -2.97 114.93 116.98 1aib h MET 287 Ca -0.00 -0.32 -0.06 0.00 -0.28 0.00 0.00 59.70 59.03 1aib h MET 287 Cb 0.59 0.00 -0.01 0.00 -0.80 0.00 0.00 31.60 31.38 1aib h MET 287 CO 0.03 0.92 0.01 0.87 0.23 0.00 0.00 176.91 178.97 1aib h LYS 288 N 0.54 0.71 -0.74 0.39 1.57 0.12 -2.62 116.57 116.53 1aib h LYS 288 Ca 0.05 -0.22 0.15 0.00 -1.87 0.00 0.00 60.65 58.75 1aib h LYS 288 Cb 0.90 -0.07 -0.10 0.00 0.08 0.00 0.00 32.23 33.05 1aib h LYS 288 CO 0.08 0.79 0.25 0.00 -0.57 0.00 0.00 179.45 180.00 1aib h ALA 289 N 0.89 1.01 -0.61 3.86 0.00 -1.03 -0.39 119.26 122.98 1aib h ALA 289 Ca 0.12 0.13 0.06 0.00 0.00 0.00 0.00 54.91 55.21 1aib h ALA 289 Cb 0.47 0.14 -0.05 0.00 0.00 0.00 0.00 17.79 18.34 1aib h ALA 289 CO 0.02 -0.26 0.32 0.00 0.00 0.00 0.00 179.25 179.33 1aib h ALA 290 N 1.56 0.81 -0.24 0.00 0.00 -1.31 -2.24 119.26 117.85 1aib h ALA 290 Ca 0.41 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.32 1aib h ALA 290 Cb 0.65 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1aib h ALA 290 CO -0.44 -0.02 0.07 0.82 0.00 0.00 0.00 179.25 179.69 1aib h ILE 291 N 0.60 1.20 -0.10 0.00 2.04 -1.27 -1.21 117.51 118.77 1aib h ILE 291 Ca 0.28 -0.62 0.03 0.00 1.00 0.00 0.00 64.86 65.54 1aib h ILE 291 Cb 0.19 1.16 -0.00 0.00 -0.74 0.00 0.00 36.82 37.43 1aib h ILE 291 CO -0.18 0.20 0.10 -0.09 0.00 0.00 0.00 178.15 178.18 1aib h ARG 292 N 0.21 0.00 -0.07 2.37 9.65 -0.62 0.95 114.38 126.88 1aib h ARG 292 Ca 0.08 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.96 1aib h ARG 292 Cb 0.24 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.82 1aib h ARG 292 CO -0.00 0.00 0.00 0.00 2.80 0.00 0.00 179.97 182.77 1aib n ALA 293 N -2.37 2.45 -0.24 2.80 0.00 -0.89 -4.07 120.51 118.20 1aib n ALA 293 Ca -0.00 -0.69 0.00 0.00 0.00 0.00 0.00 53.44 52.75 1aib n ALA 293 Cb 0.21 -0.60 0.00 0.00 0.00 0.00 0.00 19.45 19.06 1aib n ALA 293 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1aib n ASN 294 N 1.00 0.00 0.00 0.00 2.85 0.19 -4.90 115.26 114.40 1aib n ASN 294 Ca 0.11 0.03 0.00 0.00 -0.11 0.00 0.00 54.58 54.60 1aib n ASN 294 Cb 0.45 -0.38 0.00 0.00 1.24 0.00 0.00 39.78 41.09 1aib n ASN 294 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1aib n TYR 295 N -2.22 0.00 0.00 1.20 0.18 -0.54 -5.06 117.16 110.72 1aib n TYR 295 Ca 0.00 -0.29 0.00 0.00 1.88 0.00 0.00 57.90 59.49 1aib n TYR 295 Cb 0.00 -0.03 0.00 0.00 -0.38 0.00 0.00 39.34 38.93 1aib n TYR 295 CO 0.00 0.00 0.00 0.45 -2.08 0.00 0.00 176.86 175.23 1aib n SER 296 N -0.29 0.00 -3.48 9.48 2.88 -0.37 -4.80 113.62 117.03 1aib n SER 296 Ca 0.00 0.00 -0.14 0.00 -1.33 0.00 0.00 58.87 57.40 1aib n SER 296 Cb 0.34 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.77 1aib n SER 296 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1aib s ASN 297 N 0.00 -0.57 0.47 -3.46 2.20 -1.26 -4.11 114.94 108.22 1aib s ASN 297 Ca 0.00 0.33 -0.10 0.00 -0.94 0.00 0.00 52.86 52.15 1aib s ASN 297 Cb 0.00 0.53 -0.05 0.00 -2.00 0.00 0.00 41.25 39.72 1aib s ASN 297 CO 0.00 -0.73 0.84 -2.16 -2.94 0.00 0.00 177.10 172.11 1aib s PRO 298 N -2.41 3.70 -0.28 3.55 0.04 -1.26 -5.00 135.00 133.34 1aib s PRO 298 Ca -0.04 0.49 -0.29 0.00 0.04 0.00 0.00 61.00 61.21 1aib s PRO 298 Cb -0.01 -2.31 -0.02 0.00 0.04 0.00 0.00 34.50 32.20 1aib s PRO 298 CO -0.02 -0.19 1.72 -1.25 0.04 0.00 0.00 177.00 177.30 1aib s PRO 299 N -4.33 3.55 0.33 0.56 0.05 -1.26 -4.78 135.00 129.12 1aib s PRO 299 Ca 0.52 1.55 0.04 0.00 0.05 0.00 0.00 61.00 63.15 1aib s PRO 299 Cb -0.10 -4.13 0.66 0.00 0.05 0.00 0.00 34.50 30.98 1aib s PRO 299 CO 0.39 -1.60 1.91 0.00 0.05 0.00 0.00 177.00 177.75 1aib h ALA 300 N 11.89 1.64 0.69 8.56 0.00 -1.94 -3.37 119.26 136.73 1aib h ALA 300 Ca -0.34 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.53 1aib h ALA 300 Cb 1.16 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.74 1aib h ALA 300 CO 1.02 0.20 -0.42 1.25 0.00 0.00 0.00 179.25 181.30 1aib h HIS 301 N 0.87 -1.11 -0.82 0.00 -0.00 -1.92 0.27 115.15 112.45 1aib h HIS 301 Ca 0.39 -0.01 0.01 0.00 -0.00 0.00 0.00 60.37 60.76 1aib h HIS 301 Cb 0.36 0.40 -0.04 0.00 -0.00 0.00 0.00 27.41 28.12 1aib h HIS 301 CO -0.00 -0.63 0.54 0.78 -0.00 0.00 0.00 177.93 178.63 1aib h GLY 302 N -1.03 1.15 2.00 5.26 0.00 -1.80 -0.56 103.07 108.08 1aib h GLY 302 Ca -0.09 -0.43 -0.01 0.00 0.00 0.00 0.00 47.33 46.80 1aib h GLY 302 CO 0.10 0.42 -0.03 0.00 0.00 0.00 0.00 176.54 177.03 1aib h ALA 303 N 1.30 1.00 -0.10 3.60 0.00 -1.69 0.90 119.26 124.28 1aib h ALA 303 Ca 0.30 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 55.09 1aib h ALA 303 Cb -0.13 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.66 1aib h ALA 303 CO -0.07 0.04 -0.30 0.77 0.00 0.00 0.00 179.25 179.69 1aib h SER 304 N 0.00 0.43 -0.21 0.00 0.02 0.18 -1.72 113.55 112.25 1aib h SER 304 Ca -0.00 -0.61 0.00 0.00 -0.84 0.00 0.00 61.79 60.34 1aib h SER 304 Cb 0.58 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.99 1aib h SER 304 CO 0.00 0.96 0.14 0.58 -1.14 0.00 0.00 176.83 177.37 1aib h VAL 305 N -0.08 1.06 -0.51 2.27 2.07 -0.64 0.07 116.25 120.49 1aib h VAL 305 Ca -0.01 -0.11 -0.02 0.00 0.82 0.00 0.00 66.70 67.38 1aib h VAL 305 Cb 0.92 0.76 -0.03 0.00 -1.52 0.00 0.00 31.29 31.43 1aib h VAL 305 CO 0.06 0.06 0.25 0.58 0.02 0.00 0.00 177.57 178.54 1aib h VAL 306 N 0.28 1.17 0.02 2.57 2.07 -0.84 -2.01 116.25 119.51 1aib h VAL 306 Ca 0.08 -0.48 -0.22 0.00 0.82 0.00 0.00 66.70 66.90 1aib h VAL 306 Cb -0.03 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 30.23 1aib h VAL 306 CO -0.02 0.20 -1.02 0.00 0.02 0.00 0.00 177.57 176.76 1aib h ALA 307 N 1.56 0.34 -0.03 1.67 0.00 -0.96 -2.73 119.26 119.12 1aib h ALA 307 Ca 0.18 -0.88 -0.01 0.00 0.00 0.00 0.00 54.91 54.20 1aib h ALA 307 Cb 0.07 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.73 1aib h ALA 307 CO -0.02 1.18 -0.01 1.15 0.00 0.00 0.00 179.25 181.54 1aib h THR 308 N 0.01 1.31 0.21 0.00 2.02 -0.30 -1.90 112.91 114.27 1aib h THR 308 Ca -0.03 -0.94 0.01 0.00 0.77 0.00 0.00 66.41 66.23 1aib h THR 308 Cb 1.76 1.89 -0.03 0.00 -1.74 0.00 0.00 68.15 70.03 1aib h THR 308 CO 0.14 0.25 -0.32 0.40 0.37 0.00 0.00 175.52 176.36 1aib h ILE 309 N -0.32 0.33 0.00 3.11 2.04 -1.50 -2.43 117.51 118.74 1aib h ILE 309 Ca 0.01 0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.85 1aib h ILE 309 Cb 0.41 0.33 -0.00 0.00 -0.74 0.00 0.00 36.82 36.82 1aib h ILE 309 CO 0.00 0.00 -0.06 -0.07 0.00 0.00 0.00 178.15 178.02 1aib h LEU 310 N -0.59 0.00 0.00 1.44 3.38 -1.50 -2.43 115.31 115.61 1aib h LEU 310 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1aib h LEU 310 Cb 0.58 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.33 1aib h LEU 310 CO -0.13 0.06 -0.94 -1.54 0.09 0.00 0.00 178.44 175.98 1aib n SER 311 N -3.36 0.79 -4.34 -0.43 3.41 -0.72 -4.78 113.62 104.20 1aib n SER 311 Ca -0.01 0.23 -0.39 0.00 -0.26 0.00 0.00 58.87 58.44 1aib n SER 311 Cb 0.22 0.44 -0.12 0.00 -0.26 0.00 0.00 64.21 64.49 1aib n SER 311 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 1aib s ASN 312 N -4.99 5.54 0.62 4.04 0.02 -0.93 -4.96 114.94 114.28 1aib s ASN 312 Ca 0.01 -1.03 0.26 0.00 -1.02 0.00 0.00 52.86 51.08 1aib s ASN 312 Cb 0.11 -1.96 1.23 0.00 0.02 0.00 0.00 41.25 40.65 1aib s ASN 312 CO 0.78 -0.35 1.67 0.44 0.02 0.00 0.00 177.10 179.65 1aib h ASP 313 N 8.34 0.00 0.12 -1.22 3.32 -1.86 0.44 116.42 125.56 1aib h ASP 313 Ca -0.25 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 56.64 1aib h ASP 313 Cb 1.10 0.00 0.02 0.00 0.22 0.00 0.00 39.33 40.66 1aib h ASP 313 CO 0.64 0.00 -0.73 0.00 -1.72 0.00 0.00 179.24 177.43 1aib h ALA 314 N 1.06 -0.06 -0.11 3.45 0.00 -1.93 -2.99 119.26 118.68 1aib h ALA 314 Ca 0.22 -0.69 -0.19 0.00 0.00 0.00 0.00 54.91 54.24 1aib h ALA 314 Cb 1.58 0.11 -0.00 0.00 0.00 0.00 0.00 17.79 19.48 1aib h ALA 314 CO -0.00 0.35 -0.73 -0.07 0.00 0.00 0.00 179.25 178.80 1aib h LEU 315 N -0.46 0.62 -1.26 0.00 3.38 -0.54 -2.49 115.31 114.55 1aib h LEU 315 Ca -0.13 -0.40 0.02 0.00 0.09 0.00 0.00 57.88 57.46 1aib h LEU 315 Cb 1.56 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 42.08 1aib h LEU 315 CO 0.12 1.15 0.51 -0.09 0.09 0.00 0.00 178.44 180.22 1aib h ARG 316 N 0.36 0.97 -0.09 1.13 2.43 -0.40 -0.07 114.38 118.71 1aib h ARG 316 Ca -0.03 -0.06 -0.00 0.00 -0.81 0.00 0.00 59.98 59.08 1aib h ARG 316 Cb 1.32 -0.22 -0.00 0.00 -0.42 0.00 0.00 29.97 30.64 1aib h ARG 316 CO 0.13 0.64 0.06 0.00 -1.51 0.00 0.00 179.97 179.29 1aib h ALA 317 N 1.53 0.12 0.16 2.80 0.00 -1.39 0.20 119.26 122.69 1aib h ALA 317 Ca 0.29 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.16 1aib h ALA 317 Cb -0.06 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1aib h ALA 317 CO -0.07 -0.37 -0.08 0.82 0.00 0.00 0.00 179.25 179.55 1aib h ILE 318 N 0.09 0.94 -0.37 0.00 2.04 -1.08 -2.80 117.51 116.34 1aib h ILE 318 Ca 0.03 -0.52 0.08 0.00 1.00 0.00 0.00 64.86 65.45 1aib h ILE 318 Cb 0.03 1.26 -0.09 0.00 -0.74 0.00 0.00 36.82 37.29 1aib h ILE 318 CO -0.01 0.12 -0.29 -0.25 0.00 0.00 0.00 178.15 177.73 1aib h TRP 319 N -0.47 -0.78 -0.98 1.37 7.01 -0.76 0.16 115.95 121.50 1aib h TRP 319 Ca -0.02 0.05 0.17 0.00 2.11 0.00 0.00 58.89 61.20 1aib h TRP 319 Cb 0.37 0.40 -0.10 0.00 -2.10 0.00 0.00 29.16 27.72 1aib h TRP 319 CO 0.01 -0.36 0.58 0.93 -2.79 0.00 0.00 178.44 176.82 1aib h GLU 320 N -0.23 0.75 -0.15 2.65 5.08 -0.94 0.32 114.58 122.04 1aib h GLU 320 Ca 0.17 -0.04 -0.11 0.00 -1.00 0.00 0.00 59.36 58.38 1aib h GLU 320 Cb 0.51 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 1aib h GLU 320 CO -0.50 0.49 -0.37 1.96 -1.00 0.00 0.00 179.01 179.59 1aib h GLN 321 N 0.77 0.33 -0.52 2.33 1.08 -0.44 0.44 115.11 119.09 1aib h GLN 321 Ca 0.55 -0.15 -0.10 0.00 -1.45 0.00 0.00 58.65 57.51 1aib h GLN 321 Cb 0.81 -0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 28.21 1aib h GLN 321 CO -0.37 0.66 -0.05 0.93 -0.95 0.00 0.00 178.83 179.05 1aib h GLU 322 N 0.28 0.96 -0.75 1.46 5.08 0.54 0.12 114.58 122.26 1aib h GLU 322 Ca 0.03 -0.33 -0.03 0.00 -1.00 0.00 0.00 59.36 58.03 1aib h GLU 322 Cb 0.78 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.93 1aib h GLU 322 CO 0.06 1.00 0.34 1.25 -1.00 0.00 0.00 179.01 180.66 1aib h LEU 323 N 0.82 1.00 -1.05 1.33 5.85 -0.05 -2.20 115.31 121.02 1aib h LEU 323 Ca 0.14 -0.15 -0.07 0.00 0.84 0.00 0.00 57.88 58.65 1aib h LEU 323 Cb 0.60 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.36 1aib h LEU 323 CO 0.04 0.86 -0.08 0.74 -0.34 0.00 0.00 178.44 179.66 1aib h THR 324 N 1.06 1.23 -0.13 1.05 2.02 -0.27 0.69 112.91 118.56 1aib h THR 324 Ca 0.26 -1.00 -0.20 0.00 0.77 0.00 0.00 66.41 66.24 1aib h THR 324 Cb 0.15 1.06 0.00 0.00 -1.74 0.00 0.00 68.15 67.61 1aib h THR 324 CO -0.03 0.33 -0.73 0.44 0.37 0.00 0.00 175.52 175.90 1aib h ASP 325 N 0.54 0.72 0.42 4.18 3.32 -0.28 -0.69 116.42 124.64 1aib h ASP 325 Ca 0.10 -0.46 -0.02 0.00 0.02 0.00 0.00 57.03 56.67 1aib h ASP 325 Cb 0.47 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.81 1aib h ASP 325 CO 0.03 1.23 -0.20 0.24 -1.72 0.00 0.00 179.24 178.81 1aib h MET 326 N 0.42 -0.55 -0.38 3.56 2.86 -0.77 -0.78 114.93 119.30 1aib h MET 326 Ca -0.04 0.04 0.08 0.00 -2.06 0.00 0.00 59.70 57.72 1aib h MET 326 Cb 1.33 0.12 -0.08 0.00 0.06 0.00 0.00 31.60 33.03 1aib h MET 326 CO 0.14 -0.27 -0.20 -0.09 1.06 0.00 0.00 176.91 177.55 1aib h ARG 327 N -0.76 -0.13 0.00 1.72 2.43 -0.78 -1.38 114.38 115.48 1aib h ARG 327 Ca -0.06 0.01 -0.03 0.00 -0.81 0.00 0.00 59.98 59.09 1aib h ARG 327 Cb 0.53 0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 30.10 1aib h ARG 327 CO 0.10 -0.09 -0.14 1.96 -1.51 0.00 0.00 179.97 180.29 1aib h GLN 328 N -0.14 0.00 -0.45 0.20 4.20 -0.99 -1.54 115.11 116.40 1aib h GLN 328 Ca 0.19 0.00 -0.12 0.00 0.06 0.00 0.00 58.65 58.77 1aib h GLN 328 Cb 0.43 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.19 1aib h GLN 328 CO -0.46 0.14 -0.20 -0.09 -0.67 0.00 0.00 178.83 177.54 1aib h ARG 329 N 0.00 0.93 0.08 1.46 2.43 -0.03 0.66 114.38 119.91 1aib h ARG 329 Ca -0.00 -0.40 -0.00 0.00 -0.81 0.00 0.00 59.98 58.76 1aib h ARG 329 Cb 0.47 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.99 1aib h ARG 329 CO 0.02 1.06 -0.04 0.82 -1.51 0.00 0.00 179.97 180.32 1aib h ILE 330 N 0.76 1.14 -0.94 1.20 2.04 -0.91 -2.08 117.51 118.72 1aib h ILE 330 Ca 0.10 -0.87 0.18 0.00 1.00 0.00 0.00 64.86 65.26 1aib h ILE 330 Cb 0.77 1.70 -0.10 0.00 -0.74 0.00 0.00 36.82 38.45 1aib h ILE 330 CO 0.06 0.21 0.53 1.56 0.00 0.00 0.00 178.15 180.51 1aib h GLN 331 N -0.52 0.67 -0.72 2.37 4.20 -1.17 -1.52 115.11 118.42 1aib h GLN 331 Ca -0.01 -0.04 0.05 0.00 0.06 0.00 0.00 58.65 58.70 1aib h GLN 331 Cb 0.43 -0.15 -0.05 0.00 0.30 0.00 0.00 27.48 28.01 1aib h GLN 331 CO 0.02 0.44 0.44 0.00 -0.67 0.00 0.00 178.83 179.06 1aib h ARG 332 N 0.69 0.80 -0.15 1.46 -0.00 -0.54 -2.51 114.38 114.12 1aib h ARG 332 Ca 0.53 -0.05 -0.18 0.00 -0.50 0.00 0.00 59.98 59.78 1aib h ARG 332 Cb 0.81 -0.18 -0.00 0.00 0.00 0.00 0.00 29.97 30.60 1aib h ARG 332 CO -0.39 0.53 -0.65 0.52 0.00 0.00 0.00 179.97 179.98 1aib h MET 333 N 0.83 0.57 0.19 0.04 2.86 -0.62 -0.85 114.93 117.95 1aib h MET 333 Ca 0.31 -0.41 -0.01 0.00 -2.06 0.00 0.00 59.70 57.53 1aib h MET 333 Cb 0.10 0.07 0.00 0.00 0.06 0.00 0.00 31.60 31.84 1aib h MET 333 CO -0.15 1.03 -0.09 0.00 1.06 0.00 0.00 176.91 178.76 1aib h ARG 334 N 0.41 -0.25 -0.36 1.72 3.08 -1.10 0.66 114.38 118.54 1aib h ARG 334 Ca -0.02 0.02 0.04 0.00 0.07 0.00 0.00 59.98 60.09 1aib h ARG 334 Cb 1.22 0.06 -0.04 0.00 0.08 0.00 0.00 29.97 31.29 1aib h ARG 334 CO 0.12 -0.13 0.12 1.96 -1.07 0.00 0.00 179.97 180.98 1aib h GLN 335 N -0.31 0.27 0.00 0.04 7.50 -1.35 -1.88 115.11 119.37 1aib h GLN 335 Ca -0.03 -0.02 -0.01 0.00 0.50 0.00 0.00 58.65 59.10 1aib h GLN 335 Cb 0.24 -0.06 -0.00 0.00 0.05 0.00 0.00 27.48 27.71 1aib h GLN 335 CO 0.04 0.18 -0.04 1.25 -1.50 0.00 0.00 178.83 178.76 1aib h LEU 336 N 0.27 0.00 0.13 1.46 5.85 -1.09 -2.41 115.31 119.52 1aib h LEU 336 Ca 0.16 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.88 1aib h LEU 336 Cb 0.14 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.17 1aib h LEU 336 CO -0.17 0.04 -0.06 0.15 -0.34 0.00 0.00 178.44 178.06 1aib h PHE 337 N 0.00 -0.16 -0.58 1.25 3.57 -0.06 -0.01 116.94 120.95 1aib h PHE 337 Ca -0.00 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.52 1aib h PHE 337 Cb 0.80 0.05 -0.03 0.00 2.79 0.00 0.00 35.95 39.56 1aib h PHE 337 CO 0.00 0.32 0.38 -0.39 -2.23 0.00 0.00 178.31 176.39 1aib h VAL 338 N -0.85 1.11 0.20 1.41 -1.51 -1.41 0.19 116.25 115.39 1aib h VAL 338 Ca -0.02 -0.25 -0.01 0.00 -1.23 0.00 0.00 66.70 65.19 1aib h VAL 338 Cb 0.55 0.32 0.00 0.00 -2.13 0.00 0.00 31.29 30.03 1aib h VAL 338 CO 0.03 0.13 -0.10 0.78 -1.23 0.00 0.00 177.57 177.19 1aib h ASN 339 N 0.73 -0.22 -0.27 4.19 -0.26 -1.40 -0.38 115.58 117.96 1aib h ASN 339 Ca 0.22 -0.27 0.04 0.00 -0.56 0.00 0.00 56.30 55.73 1aib h ASN 339 Cb 0.00 0.06 -0.01 0.00 -1.06 0.00 0.00 38.32 37.31 1aib h ASN 339 CO -0.05 0.19 0.19 0.74 -1.06 0.00 0.00 177.43 177.43 1aib h THR 340 N -0.68 0.98 0.26 2.81 2.02 -0.88 -1.26 112.91 116.16 1aib h THR 340 Ca -0.03 -0.07 -0.01 0.00 0.77 0.00 0.00 66.41 67.07 1aib h THR 340 Cb 0.48 0.75 0.00 0.00 -1.74 0.00 0.00 68.15 67.64 1aib h THR 340 CO 0.04 0.04 -0.13 0.25 0.37 0.00 0.00 175.52 176.10 1aib h LEU 341 N 0.21 -0.30 -1.28 2.58 5.85 -0.61 -2.11 115.31 119.66 1aib h LEU 341 Ca 0.12 -0.22 0.18 0.00 0.84 0.00 0.00 57.88 58.80 1aib h LEU 341 Cb 0.20 0.08 -0.08 0.00 0.37 0.00 0.00 40.66 41.23 1aib h LEU 341 CO -0.02 0.11 0.60 1.56 -0.34 0.00 0.00 178.44 180.35 1aib h GLN 342 N -0.77 0.60 -0.06 1.25 7.50 -0.46 -1.39 115.11 121.77 1aib h GLN 342 Ca -0.04 -0.04 -0.01 0.00 0.50 0.00 0.00 58.65 59.06 1aib h GLN 342 Cb 0.50 -0.13 -0.00 0.00 0.05 0.00 0.00 27.48 27.90 1aib h GLN 342 CO 0.06 0.40 -0.02 0.93 -1.50 0.00 0.00 178.83 178.70 1aib h GLU 343 N 0.62 0.12 0.00 1.46 5.08 -1.24 -3.28 114.58 117.33 1aib h GLU 343 Ca 0.50 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.82 1aib h GLU 343 Cb 0.95 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.20 1aib h GLU 343 CO -0.25 0.47 0.00 1.63 -1.00 0.00 0.00 179.01 179.86 1aib n LYS 344 N -4.82 0.55 0.00 2.33 4.76 -0.56 -4.80 118.16 115.63 1aib n LYS 344 Ca -0.07 0.03 0.00 0.00 -2.87 0.00 0.00 58.31 55.40 1aib n LYS 344 Cb 0.23 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.92 1aib n LYS 344 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1aib n GLY 345 N 0.38 0.99 3.47 0.72 0.00 -1.19 -5.01 105.19 104.55 1aib n GLY 345 Ca 0.14 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.70 1aib n GLY 345 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1aib n ALA 346 N 0.00 0.83 0.06 4.61 0.00 -0.99 -4.80 120.51 120.23 1aib n ALA 346 Ca 0.00 -0.29 0.21 0.00 0.00 0.00 0.00 53.44 53.36 1aib n ALA 346 Cb 0.00 -2.63 0.69 0.00 0.00 0.00 0.00 19.45 17.51 1aib n ALA 346 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 177.50 176.53 1aib h ASN 347 N 13.83 0.00 -3.06 0.00 -1.24 -1.93 -3.44 115.58 119.74 1aib h ASN 347 Ca -0.21 0.00 -0.60 0.00 0.71 0.00 0.00 56.30 56.19 1aib h ASN 347 Cb 1.31 0.00 -0.17 0.00 0.73 0.00 0.00 38.32 40.19 1aib h ASN 347 CO 1.13 0.00 -0.79 -0.60 -1.29 0.00 0.00 177.43 175.87 1aib s ARG 348 N -4.53 1.48 -0.33 6.67 3.52 -1.26 -5.10 118.95 119.41 1aib s ARG 348 Ca -0.04 -1.55 -0.24 0.00 -0.13 0.00 0.00 55.73 53.77 1aib s ARG 348 Cb 0.14 -1.66 0.01 0.00 -1.56 0.00 0.00 34.95 31.88 1aib s ARG 348 CO 0.50 0.34 0.83 0.34 -0.81 0.00 0.00 175.30 176.50 1aib s ASP 349 N -2.89 6.66 -0.27 -2.12 2.15 -1.26 -4.90 116.67 114.04 1aib s ASP 349 Ca 0.22 0.61 0.11 0.00 0.43 0.00 0.00 52.55 53.92 1aib s ASP 349 Cb -0.06 -2.42 0.59 0.00 -0.30 0.00 0.00 42.92 40.72 1aib s ASP 349 CO 0.10 -0.70 1.57 0.49 -0.17 0.00 0.00 175.17 176.46 1aib n PHE 350 N 6.39 1.52 0.40 -5.34 3.01 -1.26 -4.68 117.46 117.51 1aib n PHE 350 Ca 0.05 -1.29 0.11 0.00 1.01 0.00 0.00 57.45 57.33 1aib n PHE 350 Cb 0.48 -0.52 0.48 0.00 -0.01 0.00 0.00 39.48 39.91 1aib n PHE 350 CO 0.00 0.00 0.00 -1.13 1.01 0.00 0.00 176.76 176.64 1aib n SER 351 N -0.70 0.60 0.31 4.37 3.41 -1.26 -2.18 113.62 118.17 1aib n SER 351 Ca 0.33 0.65 0.20 0.00 -0.26 0.00 0.00 58.87 59.80 1aib n SER 351 Cb 1.13 -0.78 1.01 0.00 -0.26 0.00 0.00 64.21 65.31 1aib n SER 351 CO 0.00 0.00 0.00 2.19 -0.16 0.00 0.00 175.04 177.07 1aib h PHE 352 N 0.00 0.00 -0.38 7.33 -0.00 -1.95 -2.43 116.94 119.51 1aib h PHE 352 Ca 0.00 0.00 0.11 0.00 -0.00 0.00 0.00 57.97 58.08 1aib h PHE 352 Cb 0.34 0.00 -0.02 0.00 -0.00 0.00 0.00 35.95 36.28 1aib h PHE 352 CO 0.00 0.01 0.33 0.82 -0.00 0.00 0.00 178.31 179.47 1aib h ILE 353 N 0.00 0.57 0.00 0.88 1.08 -1.83 -1.24 117.51 116.97 1aib h ILE 353 Ca -0.00 0.00 -0.10 0.00 -0.39 0.00 0.00 64.86 64.37 1aib h ILE 353 Cb 0.18 0.75 -0.02 0.00 -3.07 0.00 0.00 36.82 34.66 1aib h ILE 353 CO 0.00 0.00 -0.95 0.40 -0.69 0.00 0.00 178.15 176.92 1aib h ILE 354 N 0.00 0.46 0.00 -0.67 2.04 -1.67 -3.30 117.51 114.38 1aib h ILE 354 Ca 0.18 -1.77 -0.03 0.00 1.00 0.00 0.00 64.86 64.24 1aib h ILE 354 Cb 0.84 2.04 -0.00 0.00 -0.74 0.00 0.00 36.82 38.95 1aib h ILE 354 CO -0.00 0.26 -0.12 0.11 0.00 0.00 0.00 178.15 178.40 1aib h LYS 355 N 0.00 0.00 -6.74 2.37 1.57 -1.36 -3.46 116.57 108.96 1aib h LYS 355 Ca -0.07 0.00 -0.49 0.00 -1.87 0.00 0.00 60.65 58.22 1aib h LYS 355 Cb 1.36 0.00 0.02 0.00 0.08 0.00 0.00 32.23 33.69 1aib h LYS 355 CO 0.04 0.12 -0.01 -0.65 -0.57 0.00 0.00 179.45 178.38 1aib s GLN 356 N -3.54 3.58 0.22 3.15 -0.21 -1.20 -4.94 119.66 116.73 1aib s GLN 356 Ca 0.02 0.08 0.09 0.00 0.02 0.00 0.00 55.36 55.57 1aib s GLN 356 Cb 0.09 -2.50 -0.04 0.00 1.00 0.00 0.00 33.01 31.56 1aib s GLN 356 CO 0.61 -0.02 -0.07 -0.80 -2.12 0.00 0.00 175.29 172.90 1aib s ASN 357 N -3.77 4.32 0.29 5.90 0.02 0.13 -5.02 114.94 116.81 1aib s ASN 357 Ca 0.46 -0.63 0.00 0.00 -1.02 0.00 0.00 52.86 51.66 1aib s ASN 357 Cb -0.10 -0.74 0.00 0.00 0.02 0.00 0.00 41.25 40.43 1aib s ASN 357 CO 0.38 0.06 0.00 0.61 0.02 0.00 0.00 177.10 178.17 1aib n GLY 358 N -0.36 -0.06 0.13 0.66 0.00 -1.21 -4.18 105.19 100.17 1aib n GLY 358 Ca -0.09 -0.98 0.07 0.00 0.00 0.00 0.00 46.02 45.02 1aib n GLY 358 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1aib h MET 359 N 0.00 0.00 -6.22 1.61 2.86 -1.92 -3.48 114.93 107.79 1aib h MET 359 Ca 0.00 0.00 -0.48 0.00 -2.06 0.00 0.00 59.70 57.16 1aib h MET 359 Cb 0.00 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.63 1aib h MET 359 CO 0.00 0.16 -0.45 -0.06 1.06 0.00 0.00 176.91 177.62 1aib s PHE 360 N -3.15 3.10 -0.21 -0.22 0.08 -1.26 0.65 117.98 116.97 1aib s PHE 360 Ca 0.00 -0.18 -0.24 0.00 0.12 0.00 0.00 56.93 56.64 1aib s PHE 360 Cb 0.08 -1.66 0.06 0.00 -0.57 0.00 0.00 43.02 40.93 1aib s PHE 360 CO 0.77 0.30 0.65 -1.12 -0.10 0.00 0.00 175.22 175.73 1aib s SER 361 N -3.97 -0.67 -0.33 1.36 0.01 -0.40 -4.25 113.70 105.45 1aib s SER 361 Ca 0.38 1.20 -0.29 0.00 1.31 0.00 0.00 55.95 58.54 1aib s SER 361 Cb -0.08 1.19 0.00 0.00 0.21 0.00 0.00 66.02 67.35 1aib s SER 361 CO 0.27 -0.29 1.33 -0.36 0.41 0.00 0.00 173.24 174.60 1aib s PHE 362 N 0.07 2.60 0.57 2.43 0.08 -1.24 -1.19 117.98 121.29 1aib s PHE 362 Ca -0.02 0.81 0.35 0.00 0.12 0.00 0.00 56.93 58.19 1aib s PHE 362 Cb -0.04 -4.03 1.98 0.00 -0.57 0.00 0.00 43.02 40.36 1aib s PHE 362 CO 0.02 -1.79 2.26 0.66 -0.10 0.00 0.00 175.22 176.27 1aib h SER 363 N 9.68 0.00 -1.22 1.36 4.64 -0.93 -3.47 113.55 123.62 1aib h SER 363 Ca -0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 1aib h SER 363 Cb 1.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 1aib h SER 363 CO 1.05 0.02 0.00 0.61 -0.87 0.00 0.00 176.83 177.64 1aib n GLY 364 N -1.06 0.59 3.29 -0.77 0.00 -1.26 -5.09 105.19 100.89 1aib n GLY 364 Ca -0.03 -0.37 -0.22 0.00 0.00 0.00 0.00 46.02 45.40 1aib n GLY 364 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1aib s LEU 365 N -1.22 2.36 0.52 0.99 1.02 -1.26 -5.14 118.68 115.95 1aib s LEU 365 Ca 0.00 -0.76 -0.19 0.00 0.02 0.00 0.00 54.13 53.21 1aib s LEU 365 Cb 0.00 -0.79 -0.07 0.00 0.02 0.00 0.00 46.19 45.35 1aib s LEU 365 CO 0.00 -0.01 1.04 -0.89 0.02 0.00 0.00 176.35 176.50 1aib s THR 366 N -1.62 3.88 0.42 5.49 2.01 -1.26 -4.58 115.64 119.97 1aib s THR 366 Ca 0.09 1.06 0.17 0.00 0.31 0.00 0.00 61.69 63.32 1aib s THR 366 Cb -0.08 -3.46 0.37 0.00 0.01 0.00 0.00 72.50 69.35 1aib s THR 366 CO 0.05 -0.36 1.86 0.50 -0.69 0.00 0.00 174.62 175.98 1aib h LYS 367 N 1.17 0.41 0.02 4.92 3.11 -1.96 0.87 116.57 125.12 1aib h LYS 367 Ca -0.48 -0.02 -0.21 0.00 -2.81 0.00 0.00 60.65 57.12 1aib h LYS 367 Cb 1.22 -0.09 -0.02 0.00 -1.00 0.00 0.00 32.23 32.33 1aib h LYS 367 CO 0.59 0.27 -1.01 0.93 -2.81 0.00 0.00 179.45 177.43 1aib h GLU 368 N 0.43 0.06 -0.37 1.90 3.07 -1.93 -2.07 114.58 115.67 1aib h GLU 368 Ca 0.46 -0.10 -0.16 0.00 -0.50 0.00 0.00 59.36 59.06 1aib h GLU 368 Cb 1.10 0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 29.03 1aib h GLU 368 CO -0.17 1.01 -0.38 1.96 -1.40 0.00 0.00 179.01 180.02 1aib h GLN 369 N 0.02 0.92 -0.07 2.33 4.20 -1.27 -2.01 115.11 119.23 1aib h GLN 369 Ca -0.03 -0.49 0.01 0.00 0.06 0.00 0.00 58.65 58.19 1aib h GLN 369 Cb 1.74 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 29.53 1aib h GLN 369 CO 0.14 1.14 0.02 0.28 -0.67 0.00 0.00 178.83 179.74 1aib h VAL 370 N 0.73 0.99 0.00 -0.54 2.07 -0.91 0.04 116.25 118.62 1aib h VAL 370 Ca 0.06 -0.02 -0.03 0.00 0.82 0.00 0.00 66.70 67.53 1aib h VAL 370 Cb 0.98 0.92 -0.00 0.00 -1.52 0.00 0.00 31.29 31.67 1aib h VAL 370 CO 0.09 0.01 -0.13 -0.07 0.02 0.00 0.00 177.57 177.50 1aib h LEU 371 N 0.06 0.00 -0.17 2.57 3.38 -1.31 -1.87 115.31 117.97 1aib h LEU 371 Ca 0.03 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1aib h LEU 371 Cb 0.01 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 1aib h LEU 371 CO -0.03 0.13 0.05 0.03 0.09 0.00 0.00 178.44 178.72 1aib h ARG 372 N 0.00 0.27 -0.21 1.13 2.47 -0.28 -1.42 114.38 116.33 1aib h ARG 372 Ca -0.00 -0.06 -0.00 0.00 -1.26 0.00 0.00 59.98 58.66 1aib h ARG 372 Cb 0.30 -0.04 -0.01 0.00 -1.65 0.00 0.00 29.97 28.57 1aib h ARG 372 CO 0.02 0.38 0.12 -0.07 0.56 0.00 0.00 179.97 180.98 1aib h LEU 373 N 0.10 0.26 0.76 3.04 3.38 -0.43 -1.35 115.31 121.07 1aib h LEU 373 Ca 0.06 -0.08 -0.04 0.00 0.09 0.00 0.00 57.88 57.91 1aib h LEU 373 Cb 0.23 -0.07 0.01 0.00 0.09 0.00 0.00 40.66 40.92 1aib h LEU 373 CO -0.00 0.26 -0.37 0.03 0.09 0.00 0.00 178.44 178.46 1aib h ARG 374 N 0.24 -0.98 -0.46 1.13 3.08 -0.55 -1.89 114.38 114.95 1aib h ARG 374 Ca 0.07 0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.18 1aib h ARG 374 Cb 0.06 0.22 -0.02 0.00 0.08 0.00 0.00 29.97 30.31 1aib h ARG 374 CO -0.01 -0.65 0.24 0.93 -1.07 0.00 0.00 179.97 179.41 1aib h GLU 375 N -1.03 0.65 0.06 0.04 4.39 -1.17 -3.30 114.58 114.23 1aib h GLU 375 Ca -0.10 -0.08 -0.31 0.00 0.34 0.00 0.00 59.36 59.20 1aib h GLU 375 Cb 0.78 -0.12 -0.03 0.00 -0.10 0.00 0.00 28.75 29.28 1aib h GLU 375 CO 0.17 0.53 -1.73 0.93 -1.16 0.00 0.00 179.01 177.75 1aib h GLU 376 N 0.61 0.13 0.00 2.33 4.39 -1.36 -3.49 114.58 117.19 1aib h GLU 376 Ca 0.16 -0.23 -0.30 0.00 0.34 0.00 0.00 59.36 59.34 1aib h GLU 376 Cb 0.07 0.09 -0.05 0.00 -0.10 0.00 0.00 28.75 28.76 1aib h GLU 376 CO -0.02 0.86 -0.20 1.19 -1.16 0.00 0.00 179.01 179.68 1aib n PHE 377 N -3.28 0.26 0.70 4.33 3.72 -0.72 -5.03 117.46 117.44 1aib n PHE 377 Ca -0.21 -1.13 0.10 0.00 -0.05 0.00 0.00 57.45 56.17 1aib n PHE 377 Cb 1.04 -0.16 0.28 0.00 -0.94 0.00 0.00 39.48 39.70 1aib n PHE 377 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1aib n GLY 378 N 2.19 1.07 3.67 1.37 0.00 -1.25 -4.49 105.19 107.75 1aib n GLY 378 Ca -0.08 -0.57 -0.42 0.00 0.00 0.00 0.00 46.02 44.95 1aib n GLY 378 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1aib s VAL 379 N -1.57 4.76 -0.32 1.61 1.01 -1.17 -1.44 120.40 123.27 1aib s VAL 379 Ca 0.35 1.91 -0.05 0.00 0.00 0.00 0.00 61.98 64.19 1aib s VAL 379 Cb 0.19 -4.26 0.04 0.00 0.00 0.00 0.00 36.38 32.36 1aib s VAL 379 CO 0.27 -0.09 0.06 -0.31 0.00 0.00 0.00 175.10 175.04 1aib s TYR 380 N 2.68 3.26 0.24 5.22 1.51 0.09 -1.65 117.35 128.69 1aib s TYR 380 Ca 0.43 -1.60 0.09 0.00 -1.01 0.00 0.00 57.07 54.99 1aib s TYR 380 Cb -0.16 -2.21 -0.05 0.00 -0.11 0.00 0.00 41.96 39.43 1aib s TYR 380 CO 0.10 -0.76 -0.16 0.00 -1.11 0.00 0.00 175.55 173.63 1aib s ALA 381 N 1.35 2.30 0.38 3.71 0.00 -1.26 0.38 121.76 128.62 1aib s ALA 381 Ca -0.03 -1.76 -0.27 0.00 0.00 0.00 0.00 51.96 49.90 1aib s ALA 381 Cb -0.20 -0.12 -0.09 0.00 0.00 0.00 0.00 23.12 22.71 1aib s ALA 381 CO 0.01 0.13 1.30 0.08 0.00 0.00 0.00 175.76 177.29 1aib s VAL 382 N -2.82 2.65 0.65 0.00 1.01 -1.16 -4.83 120.40 115.91 1aib s VAL 382 Ca 0.26 0.61 0.30 0.00 0.00 0.00 0.00 61.98 63.15 1aib s VAL 382 Cb -0.02 -3.37 0.32 0.00 0.00 0.00 0.00 36.38 33.31 1aib s VAL 382 CO 0.10 0.11 1.94 0.00 0.00 0.00 0.00 175.10 177.25 1aib h ALA 383 N 2.92 1.45 0.00 5.51 0.00 -1.91 0.25 119.26 127.48 1aib h ALA 383 Ca -0.49 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1aib h ALA 383 Cb 1.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.03 1aib h ALA 383 CO 0.64 -0.37 0.00 -1.13 0.00 0.00 0.00 179.25 178.39 1aib n SER 384 N -3.04 0.00 0.00 0.00 3.41 -1.26 -4.42 113.62 108.31 1aib n SER 384 Ca -0.01 -0.20 0.00 0.00 -0.26 0.00 0.00 58.87 58.41 1aib n SER 384 Cb 0.40 -0.15 0.00 0.00 -0.26 0.00 0.00 64.21 64.21 1aib n SER 384 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1aib n GLY 385 N -0.04 0.73 3.71 5.00 0.00 0.88 -4.82 105.19 110.66 1aib n GLY 385 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 1aib n GLY 385 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1aib s ARG 386 N -0.21 4.27 -0.01 1.61 3.52 -1.23 -0.24 118.95 126.66 1aib s ARG 386 Ca 0.00 2.19 0.06 0.00 -0.13 0.00 0.00 55.73 57.85 1aib s ARG 386 Cb 0.00 -3.28 -0.02 0.00 -1.56 0.00 0.00 34.95 30.09 1aib s ARG 386 CO 0.00 -0.54 -0.20 0.14 -0.81 0.00 0.00 175.30 173.90 1aib s VAL 387 N 1.39 1.55 -0.47 7.11 -7.23 -0.34 -2.98 120.40 119.44 1aib s VAL 387 Ca 0.67 -0.87 -0.19 0.00 -1.81 0.00 0.00 61.98 59.78 1aib s VAL 387 Cb -0.39 -1.29 0.04 0.00 0.56 0.00 0.00 36.38 35.30 1aib s VAL 387 CO 0.30 0.41 0.60 0.21 -0.31 0.00 0.00 175.10 176.32 1aib s ASN 388 N -0.52 6.25 0.57 4.85 3.04 -0.17 -1.27 114.94 127.69 1aib s ASN 388 Ca 0.07 -0.66 0.26 0.00 0.04 0.00 0.00 52.86 52.57 1aib s ASN 388 Cb -0.08 -2.29 1.56 0.00 -1.54 0.00 0.00 41.25 38.90 1aib s ASN 388 CO -0.01 -0.80 2.11 0.58 -3.04 0.00 0.00 177.10 175.95 1aib h VAL 389 N 5.84 0.63 -0.09 -5.21 2.07 -0.13 -2.01 116.25 117.36 1aib h VAL 389 Ca -0.26 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.28 1aib h VAL 389 Cb 1.10 0.88 -0.00 0.00 -1.52 0.00 0.00 31.29 31.74 1aib h VAL 389 CO 0.91 0.00 0.18 0.00 0.02 0.00 0.00 177.57 178.68 1aib h ALA 390 N 1.84 1.47 -0.00 1.67 0.00 -1.89 -1.05 119.26 121.29 1aib h ALA 390 Ca 0.09 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1aib h ALA 390 Cb 0.41 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1aib h ALA 390 CO -0.00 -0.23 -0.24 0.41 0.00 0.00 0.00 179.25 179.19 1aib n GLY 391 N -1.27 -0.86 3.75 0.00 0.00 -0.76 -4.09 105.19 101.97 1aib n GLY 391 Ca -0.01 -0.34 -0.37 0.00 0.00 0.00 0.00 46.02 45.30 1aib n GLY 391 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1aib s MET 392 N -2.60 4.19 0.11 1.61 -1.94 -0.40 -4.88 119.30 115.40 1aib s MET 392 Ca 0.23 0.26 0.09 0.00 -1.71 0.00 0.00 55.69 54.55 1aib s MET 392 Cb 0.19 -3.38 -0.04 0.00 2.01 0.00 0.00 34.83 33.61 1aib s MET 392 CO 0.54 0.31 -0.22 0.95 -0.01 0.00 0.00 175.02 176.59 1aib s THR 393 N 0.19 1.83 0.57 2.05 -4.23 -1.26 -4.94 115.64 109.84 1aib s THR 393 Ca 0.21 -1.61 0.33 0.00 -1.18 0.00 0.00 61.69 59.44 1aib s THR 393 Cb -0.14 -1.66 0.33 0.00 1.34 0.00 0.00 72.50 72.37 1aib s THR 393 CO 0.08 -0.04 2.00 1.55 -0.54 0.00 0.00 174.62 177.66 1aib h PRO 394 N 3.99 0.00 0.00 3.99 0.13 -1.97 0.18 132.00 138.32 1aib h PRO 394 Ca -0.47 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.63 1aib h PRO 394 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1aib h PRO 394 CO 0.40 0.00 -0.13 -0.44 -0.23 0.00 0.00 178.00 177.60 1aib h ASP 395 N 0.00 0.11 1.23 1.44 5.19 -1.95 -3.34 116.42 119.10 1aib h ASP 395 Ca 0.00 -0.80 0.00 0.00 -0.62 0.00 0.00 57.03 55.61 1aib h ASP 395 Cb 0.42 -0.03 0.00 0.00 0.18 0.00 0.00 39.33 39.90 1aib h ASP 395 CO 0.00 0.90 -0.34 -0.55 -3.12 0.00 0.00 179.24 176.12 1aib h ASN 396 N -0.66 0.00 -0.82 6.45 7.08 -1.13 -3.39 115.58 123.10 1aib h ASN 396 Ca -0.02 -0.09 0.14 0.00 -3.08 0.00 0.00 56.30 53.25 1aib h ASN 396 Cb 0.92 0.00 -0.14 0.00 -2.08 0.00 0.00 38.32 37.01 1aib h ASN 396 CO 0.03 0.05 -0.34 -0.03 -2.08 0.00 0.00 177.43 175.05 1aib h MET 397 N 0.00 -0.06 0.17 4.14 4.05 -1.10 -2.69 114.93 119.44 1aib h MET 397 Ca 0.00 0.00 -0.01 0.00 -0.28 0.00 0.00 59.70 59.42 1aib h MET 397 Cb 0.79 0.01 0.00 0.00 -0.80 0.00 0.00 31.60 31.60 1aib h MET 397 CO 0.00 -0.04 -0.08 0.00 0.23 0.00 0.00 176.91 177.02 1aib h ALA 398 N 1.31 -0.23 -0.81 0.39 0.00 -1.78 -2.45 119.26 115.69 1aib h ALA 398 Ca 0.32 -0.16 0.18 0.00 0.00 0.00 0.00 54.91 55.24 1aib h ALA 398 Cb 0.59 0.09 -0.11 0.00 0.00 0.00 0.00 17.79 18.36 1aib h ALA 398 CO -0.86 -0.49 0.30 -1.00 0.00 0.00 0.00 179.25 177.20 1aib h PRO 399 N -0.51 0.38 0.56 0.00 0.13 -1.81 -2.12 132.00 128.63 1aib h PRO 399 Ca -0.02 -0.02 -0.03 0.00 -0.87 0.00 0.00 66.00 65.06 1aib h PRO 399 Cb 0.39 -0.09 0.01 0.00 0.13 0.00 0.00 31.00 31.44 1aib h PRO 399 CO 0.04 0.25 -0.27 1.25 -0.23 0.00 0.00 178.00 179.04 1aib h LEU 400 N 0.39 -0.64 -1.42 1.56 5.85 -1.48 -1.22 115.31 118.35 1aib h LEU 400 Ca 0.47 0.01 0.08 0.00 0.84 0.00 0.00 57.88 59.27 1aib h LEU 400 Cb 0.81 0.16 -0.05 0.00 0.37 0.00 0.00 40.66 41.95 1aib h LEU 400 CO -0.48 -0.43 0.47 0.00 -0.34 0.00 0.00 178.44 177.66 1aib h GLU 402 N 0.68 1.10 0.01 0.00 5.08 -0.78 0.11 114.58 120.78 1aib h GLU 402 Ca 0.32 -0.21 -0.00 0.00 -1.00 0.00 0.00 59.36 58.47 1aib h GLU 402 Cb 0.36 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 29.43 1aib h GLU 402 CO -0.11 0.91 -0.01 0.00 -1.00 0.00 0.00 179.01 178.81 1aib h ALA 403 N 1.14 -0.02 -0.95 3.43 0.00 0.08 -0.80 119.26 122.14 1aib h ALA 403 Ca 0.24 -0.11 0.08 0.00 0.00 0.00 0.00 54.91 55.13 1aib h ALA 403 Cb 0.23 0.01 -0.07 0.00 0.00 0.00 0.00 17.79 17.95 1aib h ALA 403 CO -0.02 -0.40 0.61 0.82 0.00 0.00 0.00 179.25 180.27 1aib h ILE 404 N -0.23 1.02 -0.03 0.00 2.04 -0.99 -1.72 117.51 117.59 1aib h ILE 404 Ca -0.00 -0.35 -0.11 0.00 1.00 0.00 0.00 64.86 65.40 1aib h ILE 404 Cb 0.23 -0.10 -0.01 0.00 -0.74 0.00 0.00 36.82 36.19 1aib h ILE 404 CO 0.00 0.19 -0.48 0.58 0.00 0.00 0.00 178.15 178.44 1aib h VAL 405 N 1.03 1.34 0.00 1.67 2.07 -0.72 -2.72 116.25 118.93 1aib h VAL 405 Ca 0.43 -1.66 0.00 0.00 0.82 0.00 0.00 66.70 66.29 1aib h VAL 405 Cb 0.30 1.86 0.00 0.00 -1.52 0.00 0.00 31.29 31.93 1aib h VAL 405 CO -0.19 0.48 0.00 0.00 0.02 0.00 0.00 177.57 177.89 1aib h ALA 407 N 1.45 1.00 0.00 1.67 0.00 -0.21 -3.09 119.26 120.09 1aib h ALA 407 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1aib h ALA 407 Cb 0.87 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1aib h ALA 407 CO 0.07 0.00 -0.83 1.33 0.00 0.00 0.00 179.25 179.81 1aib n VAL 408 N -3.06 0.00 0.00 0.00 0.24 -1.12 -5.10 118.33 109.29 1aib n VAL 408 Ca 0.01 -0.18 0.00 0.00 -2.04 0.00 0.00 64.34 62.13 1aib n VAL 408 Cb 0.30 0.89 0.00 0.00 -1.47 0.00 0.00 33.84 33.56 1aib n VAL 408 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87