#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1brp s ARG 2 N 0.00 4.20 0.03 5.31 1.04 -1.26 -4.99 118.95 123.29 1brp s ARG 2 Ca 0.00 2.16 -0.30 0.00 -1.04 0.00 0.00 55.73 56.54 1brp s ARG 2 Cb 0.00 -2.93 -0.05 0.00 -2.04 0.00 0.00 34.95 29.93 1brp s ARG 2 CO 0.00 -0.29 1.17 0.34 -0.04 0.00 0.00 175.30 176.48 1brp s ASP 3 N -0.63 7.11 -0.46 -2.89 2.15 -1.26 -5.02 116.67 115.67 1brp s ASP 3 Ca 0.52 1.94 0.04 0.00 0.43 0.00 0.00 52.55 55.47 1brp s ASP 3 Cb -0.38 -2.57 0.61 0.00 -0.30 0.00 0.00 42.92 40.27 1brp s ASP 3 CO 0.50 -0.46 1.87 0.00 -0.17 0.00 0.00 175.17 176.91 1brp s ARG 5 N -3.39 4.09 0.22 0.00 0.52 -1.26 -4.23 118.95 114.91 1brp s ARG 5 Ca 0.57 0.20 -0.01 0.00 -0.52 0.00 0.00 55.73 55.97 1brp s ARG 5 Cb 0.47 -3.61 0.48 0.00 0.52 0.00 0.00 34.95 32.82 1brp s ARG 5 CO 0.07 -0.21 1.17 0.28 0.02 0.00 0.00 175.30 176.63 1brp n VAL 6 N 4.84 -0.31 0.28 3.52 0.31 -0.80 0.13 118.33 126.30 1brp n VAL 6 Ca -0.07 1.66 0.03 0.00 -0.01 0.00 0.00 64.34 65.96 1brp n VAL 6 Cb 0.50 -2.38 0.16 0.00 -0.91 0.00 0.00 33.84 31.22 1brp n VAL 6 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1brp n SER 7 N -5.10 0.00 -0.05 4.52 3.41 -1.26 -1.79 113.62 113.35 1brp n SER 7 Ca 0.15 0.36 -0.07 0.00 -0.26 0.00 0.00 58.87 59.06 1brp n SER 7 Cb 0.50 -0.41 -0.14 0.00 -0.26 0.00 0.00 64.21 63.90 1brp n SER 7 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1brp n SER 8 N -1.41 0.48 -4.61 4.04 3.41 0.34 -4.96 113.62 110.92 1brp n SER 8 Ca 0.02 0.23 -0.47 0.00 -0.26 0.00 0.00 58.87 58.39 1brp n SER 8 Cb 0.07 0.48 -0.03 0.00 -0.26 0.00 0.00 64.21 64.47 1brp n SER 8 CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1brp n PHE 9 N -2.87 1.58 -3.32 7.33 3.72 -0.74 -4.95 117.46 118.21 1brp n PHE 9 Ca -0.22 0.60 -0.36 0.00 -0.05 0.00 0.00 57.45 57.42 1brp n PHE 9 Cb 1.05 -2.33 -0.06 0.00 -0.94 0.00 0.00 39.48 37.20 1brp n PHE 9 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 1brp s ARG 10 N -0.61 4.05 0.47 -1.08 0.52 -1.26 -5.08 118.95 115.95 1brp s ARG 10 Ca 0.69 0.57 0.02 0.00 -0.52 0.00 0.00 55.73 56.49 1brp s ARG 10 Cb -0.76 -2.99 0.02 0.00 0.52 0.00 0.00 34.95 31.74 1brp s ARG 10 CO 0.53 0.50 0.13 1.33 0.02 0.00 0.00 175.30 177.81 1brp n VAL 11 N 0.98 0.00 -2.49 3.52 0.24 -1.26 -4.73 118.33 114.58 1brp n VAL 11 Ca -0.06 -2.09 -0.42 0.00 -2.04 0.00 0.00 64.34 59.73 1brp n VAL 11 Cb 0.52 0.25 -0.02 0.00 -1.47 0.00 0.00 33.84 33.11 1brp n VAL 11 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 1brp s LYS 12 N -3.78 3.44 0.42 7.34 2.47 0.41 -4.86 119.74 125.18 1brp s LYS 12 Ca 0.10 0.38 -0.25 0.00 -1.56 0.00 0.00 55.97 54.64 1brp s LYS 12 Cb -0.01 -4.05 -0.10 0.00 -1.46 0.00 0.00 37.83 32.21 1brp s LYS 12 CO 0.06 -1.77 1.16 -0.85 0.16 0.00 0.00 175.35 174.11 1brp n GLU 13 N 8.49 1.65 -4.24 4.03 0.00 -1.26 -2.76 120.64 126.55 1brp n GLU 13 Ca 0.11 0.59 -0.31 0.00 0.00 0.00 0.00 57.16 57.54 1brp n GLU 13 Cb 0.49 -2.23 -0.07 0.00 0.00 0.00 0.00 31.44 29.63 1brp n GLU 13 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1brp n ASN 14 N 0.31 -0.04 -4.72 -1.84 3.02 -1.26 -4.89 115.26 105.84 1brp n ASN 14 Ca 0.08 -1.18 -0.43 0.00 -0.03 0.00 0.00 54.58 53.02 1brp n ASN 14 Cb 0.39 -2.07 -0.01 0.00 -0.61 0.00 0.00 39.78 37.48 1brp n ASN 14 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 1brp n PHE 15 N -4.46 2.56 -3.94 3.10 7.35 -1.11 -5.00 117.46 115.96 1brp n PHE 15 Ca -0.24 0.40 -0.30 0.00 -0.76 0.00 0.00 57.45 56.55 1brp n PHE 15 Cb 0.65 -2.51 -0.15 0.00 0.35 0.00 0.00 39.48 37.82 1brp n PHE 15 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 1brp s ASP 16 N 0.15 3.95 0.18 -2.13 2.15 -1.26 -4.91 116.67 114.81 1brp s ASP 16 Ca 0.61 -1.27 -0.26 0.00 0.43 0.00 0.00 52.55 52.06 1brp s ASP 16 Cb -0.55 -1.21 0.05 0.00 -0.30 0.00 0.00 42.92 40.92 1brp s ASP 16 CO 0.55 -0.25 1.55 0.11 -0.17 0.00 0.00 175.17 176.95 1brp h LYS 17 N 7.93 -0.04 -0.15 4.34 1.57 -1.94 -1.72 116.57 126.56 1brp h LYS 17 Ca -0.17 0.00 0.03 0.00 -1.87 0.00 0.00 60.65 58.64 1brp h LYS 17 Cb 1.06 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 33.36 1brp h LYS 17 CO 0.42 -0.03 -0.03 0.00 -0.57 0.00 0.00 179.45 179.25 1brp h ALA 18 N 0.80 0.11 -0.96 3.86 0.00 -1.97 -1.64 119.26 119.45 1brp h ALA 18 Ca 0.22 0.05 0.19 0.00 0.00 0.00 0.00 54.91 55.38 1brp h ALA 18 Cb 0.50 0.10 -0.09 0.00 0.00 0.00 0.00 17.79 18.31 1brp h ALA 18 CO -0.91 -0.47 0.61 0.00 0.00 0.00 0.00 179.25 178.48 1brp h ARG 19 N 0.01 0.62 0.00 0.00 3.08 -1.77 -2.30 114.38 114.02 1brp h ARG 19 Ca 0.07 -0.04 -0.06 0.00 0.07 0.00 0.00 59.98 60.03 1brp h ARG 19 Cb 0.10 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 1brp h ARG 19 CO -0.15 0.41 -0.27 0.35 -1.07 0.00 0.00 179.97 179.24 1brp h PHE 20 N 0.64 0.00 -3.30 3.04 3.57 -0.70 -3.46 116.94 116.73 1brp h PHE 20 Ca 0.53 0.00 -0.53 0.00 3.53 0.00 0.00 57.97 61.50 1brp h PHE 20 Cb 0.98 0.00 0.22 0.00 2.79 0.00 0.00 35.95 39.94 1brp h PHE 20 CO -0.00 0.27 -0.66 0.43 -2.23 0.00 0.00 178.31 176.12 1brp n SER 21 N -3.22 -2.31 0.00 0.41 7.64 -0.70 -4.81 113.62 110.64 1brp n SER 21 Ca 0.02 0.31 0.00 0.00 1.01 0.00 0.00 58.87 60.21 1brp n SER 21 Cb 0.59 -1.18 0.00 0.00 -1.01 0.00 0.00 64.21 62.61 1brp n SER 21 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1brp n GLY 22 N 1.62 0.20 3.88 0.23 0.00 0.29 -4.90 105.19 106.51 1brp n GLY 22 Ca 0.06 -2.30 -0.32 0.00 0.00 0.00 0.00 46.02 43.46 1brp n GLY 22 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1brp s THR 23 N 0.00 5.05 -0.06 2.61 2.01 -1.26 -0.46 115.64 123.53 1brp s THR 23 Ca 0.00 0.31 -0.06 0.00 0.31 0.00 0.00 61.69 62.25 1brp s THR 23 Cb 0.00 -3.63 0.01 0.00 0.01 0.00 0.00 72.50 68.89 1brp s THR 23 CO 0.00 0.05 0.16 0.26 -0.69 0.00 0.00 174.62 174.40 1brp s TRP 24 N -1.67 -0.16 -0.08 4.92 0.52 -0.05 -4.73 118.94 117.69 1brp s TRP 24 Ca 0.42 0.40 0.01 0.00 0.02 0.00 0.00 56.10 56.95 1brp s TRP 24 Cb -0.12 0.05 -0.02 0.00 -1.15 0.00 0.00 33.47 32.23 1brp s TRP 24 CO 0.22 -0.10 -0.11 0.71 0.02 0.00 0.00 176.95 177.69 1brp s TYR 25 N -0.01 2.81 -0.62 -1.98 1.51 0.92 -0.35 117.35 119.62 1brp s TYR 25 Ca -0.01 -0.23 -0.24 0.00 -1.01 0.00 0.00 57.07 55.57 1brp s TYR 25 Cb -0.02 -1.73 0.05 0.00 -0.11 0.00 0.00 41.96 40.16 1brp s TYR 25 CO 0.00 0.12 1.02 0.00 -1.11 0.00 0.00 175.55 175.58 1brp s ALA 26 N -0.42 3.06 -0.06 3.71 0.00 -0.61 0.69 121.76 128.13 1brp s ALA 26 Ca 0.05 -1.45 -0.14 0.00 0.00 0.00 0.00 51.96 50.42 1brp s ALA 26 Cb -0.12 -3.89 -0.30 0.00 0.00 0.00 0.00 23.12 18.80 1brp s ALA 26 CO 0.02 -2.70 0.68 0.52 0.00 0.00 0.00 175.76 174.28 1brp h MET 27 N 9.54 0.36 -3.79 0.00 0.00 -1.62 -3.42 114.93 116.00 1brp h MET 27 Ca -0.27 -0.62 -0.16 0.00 0.00 0.00 0.00 59.70 58.64 1brp h MET 27 Cb 1.07 0.23 -0.21 0.00 0.00 0.00 0.00 31.60 32.69 1brp h MET 27 CO 1.16 1.30 -0.62 0.00 0.00 0.00 0.00 176.91 178.75 1brp s ALA 28 N -2.54 -0.06 0.03 6.32 0.00 -1.15 -0.61 121.76 123.75 1brp s ALA 28 Ca -0.16 -0.41 0.01 0.00 0.00 0.00 0.00 51.96 51.40 1brp s ALA 28 Cb 0.05 0.13 -0.02 0.00 0.00 0.00 0.00 23.12 23.28 1brp s ALA 28 CO 0.84 -0.18 -0.04 0.21 0.00 0.00 0.00 175.76 176.59 1brp s LYS 29 N -1.42 0.37 -0.26 0.00 2.20 -0.66 0.25 119.74 120.22 1brp s LYS 29 Ca -0.15 -0.64 0.03 0.00 -0.36 0.00 0.00 55.97 54.84 1brp s LYS 29 Cb -0.09 -0.02 0.07 0.00 -1.51 0.00 0.00 37.83 36.28 1brp s LYS 29 CO 0.00 -0.02 -0.08 0.21 -0.36 0.00 0.00 175.35 175.11 1brp s LYS 30 N -1.46 2.00 0.41 4.03 2.36 -0.99 -0.32 119.74 125.77 1brp s LYS 30 Ca -0.14 -1.33 -0.22 0.00 -2.55 0.00 0.00 55.97 51.73 1brp s LYS 30 Cb -0.10 -2.85 -0.10 0.00 -1.05 0.00 0.00 37.83 33.73 1brp s LYS 30 CO -0.01 -0.62 0.98 -0.51 1.55 0.00 0.00 175.35 176.74 1brp s ASP 31 N 1.15 6.90 0.42 1.43 1.01 -1.26 -2.03 116.67 124.29 1brp s ASP 31 Ca -0.06 1.82 0.01 0.00 0.71 0.00 0.00 52.55 55.03 1brp s ASP 31 Cb -0.20 -2.56 0.04 0.00 1.01 0.00 0.00 42.92 41.22 1brp s ASP 31 CO -0.06 -0.39 0.29 -0.81 0.21 0.00 0.00 175.17 174.42 1brp n PRO 32 N -0.34 0.50 -2.45 8.23 -0.04 -1.22 -4.72 135.00 134.96 1brp n PRO 32 Ca 0.06 -0.86 -0.37 0.00 -0.04 0.00 0.00 63.50 62.28 1brp n PRO 32 Cb 0.52 -0.18 -0.03 0.00 -0.04 0.00 0.00 33.50 33.77 1brp n PRO 32 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 1brp s GLU 33 N -3.13 4.16 2.49 0.54 2.12 -1.26 -4.81 118.70 118.80 1brp s GLU 33 Ca 0.20 1.64 0.00 0.00 0.36 0.00 0.00 54.97 57.17 1brp s GLU 33 Cb -0.01 -2.63 0.00 0.00 0.26 0.00 0.00 34.13 31.74 1brp s GLU 33 CO 0.13 -0.18 0.00 0.41 -0.54 0.00 0.00 175.26 175.08 1brp n GLY 34 N 0.52 -0.56 3.66 -1.50 0.00 -1.26 -4.87 105.19 101.17 1brp n GLY 34 Ca 0.04 -1.12 -0.46 0.00 0.00 0.00 0.00 46.02 44.49 1brp n GLY 34 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1brp n LEU 35 N 0.00 2.93 -3.52 0.99 7.94 -1.26 -5.00 117.00 119.08 1brp n LEU 35 Ca 0.00 1.11 -0.09 0.00 -1.11 0.00 0.00 56.01 55.92 1brp n LEU 35 Cb 0.00 -1.40 -0.02 0.00 0.53 0.00 0.00 43.42 42.53 1brp n LEU 35 CO 0.00 -0.48 0.57 0.12 -1.11 0.00 0.00 177.39 176.49 1brp s PHE 36 N 0.39 -0.39 0.10 1.96 5.36 -1.26 -4.94 117.98 119.20 1brp s PHE 36 Ca 0.74 0.19 -0.31 0.00 -0.96 0.00 0.00 56.93 56.59 1brp s PHE 36 Cb -0.69 0.57 -0.09 0.00 -0.34 0.00 0.00 43.02 42.46 1brp s PHE 36 CO 0.44 -0.74 1.70 -0.51 -1.46 0.00 0.00 175.22 174.66 1brp s LEU 37 N -2.66 4.38 -0.02 6.12 1.43 -1.26 -4.58 118.68 122.08 1brp s LEU 37 Ca 0.05 2.58 -0.03 0.00 -1.03 0.00 0.00 54.13 55.70 1brp s LEU 37 Cb -0.01 -3.57 -0.01 0.00 0.03 0.00 0.00 46.19 42.62 1brp s LEU 37 CO -0.08 -0.92 0.24 1.56 0.23 0.00 0.00 176.35 177.38 1brp h GLN 38 N 8.25 -0.09 0.00 1.70 7.50 -0.92 -3.49 115.11 128.05 1brp h GLN 38 Ca -0.44 0.01 -0.15 0.00 0.50 0.00 0.00 58.65 58.57 1brp h GLN 38 Cb 1.21 0.02 -0.03 0.00 0.05 0.00 0.00 27.48 28.73 1brp h GLN 38 CO 0.93 -0.06 0.02 -0.40 -1.50 0.00 0.00 178.83 177.83 1brp n ASP 39 N -3.01 -1.47 -3.63 1.46 5.68 -1.24 -4.85 116.55 109.48 1brp n ASP 39 Ca -0.01 -2.49 -0.24 0.00 -0.50 0.00 0.00 54.79 51.55 1brp n ASP 39 Cb 0.04 2.59 0.07 0.00 -1.14 0.00 0.00 41.12 42.67 1brp n ASP 39 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1brp n ASN 40 N -1.59 -5.69 -4.65 -1.12 3.02 0.74 -1.40 115.26 104.56 1brp n ASN 40 Ca -0.03 -0.59 -0.40 0.00 -0.03 0.00 0.00 54.58 53.54 1brp n ASN 40 Cb 0.50 -4.86 -0.07 0.00 -0.61 0.00 0.00 39.78 34.74 1brp n ASN 40 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1brp s ILE 41 N -3.33 5.07 -0.06 2.41 1.01 -1.26 -3.98 121.20 121.06 1brp s ILE 41 Ca 0.54 1.02 0.03 0.00 0.00 0.00 0.00 60.65 62.24 1brp s ILE 41 Cb -0.24 -3.88 0.01 0.00 0.01 0.00 0.00 42.46 38.36 1brp s ILE 41 CO 0.75 0.13 -0.14 -0.69 0.00 0.00 0.00 174.94 174.99 1brp s VAL 42 N 1.88 1.27 0.24 2.92 1.01 -0.60 -1.58 120.40 125.54 1brp s VAL 42 Ca 0.25 -0.57 0.11 0.00 0.00 0.00 0.00 61.98 61.77 1brp s VAL 42 Cb -0.16 -1.13 -0.05 0.00 0.00 0.00 0.00 36.38 35.05 1brp s VAL 42 CO 0.10 0.38 -0.13 0.00 0.00 0.00 0.00 175.10 175.44 1brp s ALA 43 N 0.51 2.86 -0.26 5.51 0.00 0.52 -1.96 121.76 128.95 1brp s ALA 43 Ca -0.13 -1.69 -0.04 0.00 0.00 0.00 0.00 51.96 50.10 1brp s ALA 43 Cb -0.15 -0.51 0.09 0.00 0.00 0.00 0.00 23.12 22.55 1brp s ALA 43 CO 0.04 0.34 0.13 -2.00 0.00 0.00 0.00 175.76 174.27 1brp s GLU 44 N -3.26 0.17 0.34 0.00 2.56 0.11 -0.87 118.70 117.74 1brp s GLU 44 Ca 0.28 -0.41 -0.19 0.00 0.00 0.00 0.00 54.97 54.64 1brp s GLU 44 Cb -0.07 -1.29 -0.10 0.00 2.00 0.00 0.00 34.13 34.68 1brp s GLU 44 CO 0.15 -0.94 0.83 -0.06 -0.56 0.00 0.00 175.26 174.68 1brp s PHE 45 N 2.12 3.44 0.06 5.30 0.40 0.40 -1.99 117.98 127.70 1brp s PHE 45 Ca 0.07 1.45 -0.17 0.00 -0.60 0.00 0.00 56.93 57.68 1brp s PHE 45 Cb -0.16 -2.70 0.03 0.00 0.51 0.00 0.00 43.02 40.70 1brp s PHE 45 CO -0.31 0.08 0.39 -1.12 0.70 0.00 0.00 175.22 174.97 1brp s SER 46 N -2.05 -0.25 0.01 1.36 0.01 -0.79 -0.55 113.70 111.44 1brp s SER 46 Ca 0.54 -0.08 -0.01 0.00 1.31 0.00 0.00 55.95 57.71 1brp s SER 46 Cb -0.12 0.42 -0.01 0.00 0.21 0.00 0.00 66.02 66.52 1brp s SER 46 CO 0.17 -0.69 -0.00 0.54 0.41 0.00 0.00 173.24 173.67 1brp s VAL 47 N -2.71 0.07 0.54 3.43 0.11 -1.26 0.15 120.40 120.73 1brp s VAL 47 Ca -0.04 -0.58 0.07 0.00 -2.93 0.00 0.00 61.98 58.50 1brp s VAL 47 Cb -0.00 -0.19 0.04 0.00 -1.53 0.00 0.00 36.38 34.70 1brp s VAL 47 CO -0.04 -0.32 0.51 1.51 -3.33 0.00 0.00 175.10 173.43 1brp s ASP 48 N -0.95 4.83 0.54 3.54 1.47 -0.62 -4.91 116.67 120.57 1brp s ASP 48 Ca -0.10 -1.06 0.37 0.00 1.18 0.00 0.00 52.55 52.94 1brp s ASP 48 Cb -0.06 0.25 1.55 0.00 -0.34 0.00 0.00 42.92 44.31 1brp s ASP 48 CO -0.00 -1.11 1.80 -0.08 0.68 0.00 0.00 175.17 176.45 1brp h GLU 49 N 0.62 0.01 0.00 2.11 4.22 -2.03 0.38 114.58 119.88 1brp h GLU 49 Ca -0.35 -0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.09 1brp h GLU 49 Cb 1.29 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.54 1brp h GLU 49 CO 0.52 0.00 0.00 1.79 -2.18 0.00 0.00 179.01 179.15 1brp h THR 50 N 0.01 0.00 0.00 0.32 1.35 -2.06 -3.47 112.91 109.06 1brp h THR 50 Ca 0.57 -0.48 0.00 0.00 -0.55 0.00 0.00 66.41 65.96 1brp h THR 50 Cb 2.29 1.44 0.00 0.00 -1.73 0.00 0.00 68.15 70.15 1brp h THR 50 CO -0.01 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.87 1brp n GLY 51 N 1.08 0.97 3.29 5.82 0.00 0.13 -5.05 105.19 111.44 1brp n GLY 51 Ca 0.05 -0.56 -0.35 0.00 0.00 0.00 0.00 46.02 45.17 1brp n GLY 51 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1brp s GLN 52 N -2.70 3.34 0.56 1.61 -2.07 -1.26 -4.88 119.66 114.26 1brp s GLN 52 Ca 0.00 -0.65 -0.12 0.00 -1.82 0.00 0.00 55.36 52.77 1brp s GLN 52 Cb 0.00 -2.95 -0.05 0.00 -1.09 0.00 0.00 33.01 28.91 1brp s GLN 52 CO 0.00 -0.18 0.97 1.41 -1.32 0.00 0.00 175.29 176.17 1brp s MET 53 N 1.42 3.71 0.09 9.60 -2.45 -1.26 -1.59 119.30 128.82 1brp s MET 53 Ca 0.05 0.73 -0.03 0.00 -1.25 0.00 0.00 55.69 55.19 1brp s MET 53 Cb -0.14 -2.15 0.01 0.00 1.25 0.00 0.00 34.83 33.80 1brp s MET 53 CO -0.04 -0.40 0.17 -1.13 1.05 0.00 0.00 175.02 174.67 1brp n SER 54 N -2.23 -0.48 0.00 1.11 3.41 0.40 -2.51 113.62 113.31 1brp n SER 54 Ca 0.05 -1.37 0.00 0.00 -0.26 0.00 0.00 58.87 57.29 1brp n SER 54 Cb 0.54 0.81 0.00 0.00 -0.26 0.00 0.00 64.21 65.31 1brp n SER 54 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1brp n ALA 55 N -2.46 0.00 -2.54 7.33 0.00 -0.86 -1.88 120.51 120.09 1brp n ALA 55 Ca -0.04 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.20 1brp n ALA 55 Cb 0.13 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.47 1brp n ALA 55 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1brp s THR 56 N -2.00 1.44 0.15 0.00 -4.23 -0.84 -0.89 115.64 109.27 1brp s THR 56 Ca 0.00 -1.62 -0.03 0.00 -1.18 0.00 0.00 61.69 58.86 1brp s THR 56 Cb 0.00 -1.49 -0.03 0.00 1.34 0.00 0.00 72.50 72.32 1brp s THR 56 CO 0.00 -0.28 0.13 0.00 -0.54 0.00 0.00 174.62 173.93 1brp s ALA 57 N -1.73 0.70 -0.20 3.99 0.00 -0.76 -0.72 121.76 123.04 1brp s ALA 57 Ca 0.07 -1.37 -0.27 0.00 0.00 0.00 0.00 51.96 50.39 1brp s ALA 57 Cb -0.07 0.96 0.10 0.00 0.00 0.00 0.00 23.12 24.11 1brp s ALA 57 CO 0.04 -0.55 0.85 0.21 0.00 0.00 0.00 175.76 176.31 1brp s LYS 58 N -4.05 0.75 0.00 0.00 2.20 -0.83 -0.25 119.74 117.57 1brp s LYS 58 Ca 0.25 0.54 0.00 0.00 -0.36 0.00 0.00 55.97 56.40 1brp s LYS 58 Cb 0.06 0.36 0.00 0.00 -1.51 0.00 0.00 37.83 36.74 1brp s LYS 58 CO 0.03 -0.16 0.00 0.41 -0.36 0.00 0.00 175.35 175.27 1brp n GLY 59 N 1.73 0.56 3.76 5.54 0.00 -1.11 -1.55 105.19 114.12 1brp n GLY 59 Ca -0.14 -0.73 -0.37 0.00 0.00 0.00 0.00 46.02 44.78 1brp n GLY 59 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1brp s ARG 60 N -2.00 3.36 -0.01 1.61 3.52 -0.50 -2.45 118.95 122.47 1brp s ARG 60 Ca 0.00 1.90 0.01 0.00 -0.13 0.00 0.00 55.73 57.51 1brp s ARG 60 Cb 0.00 -2.21 0.01 0.00 -1.56 0.00 0.00 34.95 31.19 1brp s ARG 60 CO 0.00 -0.92 -0.01 0.08 -0.81 0.00 0.00 175.30 173.64 1brp s VAL 61 N -1.51 0.16 -0.79 7.11 1.01 -0.98 -0.22 120.40 125.19 1brp s VAL 61 Ca 0.70 -0.01 -0.12 0.00 0.00 0.00 0.00 61.98 62.55 1brp s VAL 61 Cb -0.32 -0.19 0.21 0.00 0.00 0.00 0.00 36.38 36.08 1brp s VAL 61 CO 0.37 0.09 0.71 -0.60 0.00 0.00 0.00 175.10 175.67 1brp s ARG 62 N 0.41 3.41 0.91 2.72 3.52 -1.26 -2.15 118.95 126.51 1brp s ARG 62 Ca -0.04 -2.47 -0.10 0.00 -0.13 0.00 0.00 55.73 52.98 1brp s ARG 62 Cb -0.06 -4.30 0.14 0.00 -1.56 0.00 0.00 34.95 29.16 1brp s ARG 62 CO -0.01 -1.27 1.11 1.28 -0.81 0.00 0.00 175.30 175.61 1brp n LEU 63 N 3.88 3.25 -2.68 -0.88 7.99 0.96 -4.76 117.00 124.77 1brp n LEU 63 Ca 0.12 0.43 -0.36 0.00 -0.01 0.00 0.00 56.01 56.20 1brp n LEU 63 Cb 0.45 -1.47 -0.05 0.00 -0.11 0.00 0.00 43.42 42.24 1brp n LEU 63 CO 0.33 -2.19 0.43 0.00 -1.51 0.00 0.00 177.39 174.45 1brp n LEU 64 N -4.01 0.19 -2.28 2.23 -0.00 -1.26 -2.71 117.00 109.16 1brp n LEU 64 Ca 0.12 0.68 -0.17 0.00 -0.00 0.00 0.00 56.01 56.64 1brp n LEU 64 Cb 0.52 -0.53 0.02 0.00 -0.00 0.00 0.00 43.42 43.43 1brp n LEU 64 CO 0.49 -0.94 -0.06 -0.46 -0.00 0.00 0.00 177.39 176.42 1brp n ASN 65 N 1.29 -5.11 -2.25 1.45 0.23 -1.26 -4.33 115.26 105.28 1brp n ASN 65 Ca 0.14 -0.17 -0.02 0.00 -0.53 0.00 0.00 54.58 54.00 1brp n ASN 65 Cb 0.02 -4.02 -0.01 0.00 -2.08 0.00 0.00 39.78 33.69 1brp n ASN 65 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1brp n ASN 66 N -1.49 -3.77 -2.92 0.53 4.13 -1.10 -5.03 115.26 105.61 1brp n ASN 66 Ca -0.12 0.91 0.03 0.00 1.68 0.00 0.00 54.58 57.08 1brp n ASN 66 Cb 0.61 -3.79 0.00 0.00 -1.54 0.00 0.00 39.78 35.07 1brp n ASN 66 CO 0.00 0.00 0.00 0.86 0.28 0.00 0.00 177.26 178.40 1brp s TRP 67 N -0.79 -0.42 -0.58 3.10 -0.00 -1.22 -5.00 118.94 114.03 1brp s TRP 67 Ca -0.08 0.13 -0.20 0.00 -0.00 0.00 0.00 56.10 55.95 1brp s TRP 67 Cb 0.01 0.08 0.08 0.00 -0.00 0.00 0.00 33.47 33.63 1brp s TRP 67 CO 0.51 -0.27 0.76 -0.51 -0.00 0.00 0.00 176.95 177.44 1brp s ASP 68 N 2.34 6.21 0.62 5.86 1.01 -1.26 -0.02 116.67 131.42 1brp s ASP 68 Ca 0.20 -1.09 0.01 0.00 0.71 0.00 0.00 52.55 52.38 1brp s ASP 68 Cb 0.01 -2.34 0.07 0.00 1.01 0.00 0.00 42.92 41.68 1brp s ASP 68 CO -0.18 -1.14 0.86 0.68 0.21 0.00 0.00 175.17 175.60 1brp s VAL 69 N 3.11 2.42 -0.49 -1.27 -7.23 -0.91 -4.91 120.40 111.11 1brp s VAL 69 Ca 0.17 -0.66 0.03 0.00 -1.81 0.00 0.00 61.98 59.70 1brp s VAL 69 Cb -0.20 -2.75 0.14 0.00 0.56 0.00 0.00 36.38 34.13 1brp s VAL 69 CO 0.10 0.00 0.28 0.00 -0.31 0.00 0.00 175.10 175.17 1brp s ALA 71 N -0.03 2.05 -0.12 0.00 0.00 -1.03 -4.87 121.76 117.76 1brp s ALA 71 Ca 0.19 0.69 -0.04 0.00 0.00 0.00 0.00 51.96 52.81 1brp s ALA 71 Cb -0.21 -3.42 0.06 0.00 0.00 0.00 0.00 23.12 19.55 1brp s ALA 71 CO -0.03 -1.96 0.14 0.34 0.00 0.00 0.00 175.76 174.25 1brp s ASP 72 N -2.41 1.36 0.41 0.00 -1.08 -1.26 -2.77 116.67 110.92 1brp s ASP 72 Ca 0.70 -0.07 0.07 0.00 -0.52 0.00 0.00 52.55 52.73 1brp s ASP 72 Cb -0.25 0.09 -0.07 0.00 -1.46 0.00 0.00 42.92 41.22 1brp s ASP 72 CO 0.49 -0.29 0.04 -0.04 0.52 0.00 0.00 175.17 175.89 1brp s MET 73 N 2.24 2.01 -0.04 4.34 -1.94 0.66 -2.90 119.30 123.67 1brp s MET 73 Ca 0.04 -2.05 -0.00 0.00 -1.71 0.00 0.00 55.69 51.97 1brp s MET 73 Cb -0.14 -1.71 0.03 0.00 2.01 0.00 0.00 34.83 35.02 1brp s MET 73 CO -0.07 -0.06 0.00 0.08 -0.01 0.00 0.00 175.02 174.96 1brp s VAL 74 N -2.68 0.22 0.21 -6.03 1.01 0.15 -1.83 120.40 111.45 1brp s VAL 74 Ca 0.36 0.12 0.11 0.00 0.00 0.00 0.00 61.98 62.57 1brp s VAL 74 Cb 0.08 -0.34 -0.05 0.00 0.00 0.00 0.00 36.38 36.08 1brp s VAL 74 CO 0.19 0.18 -0.22 -0.83 0.00 0.00 0.00 175.10 174.43 1brp s GLY 75 N 1.39 1.71 -0.09 4.51 0.00 -0.07 -1.39 107.32 113.38 1brp s GLY 75 Ca -0.04 -1.69 -0.03 0.00 0.00 0.00 0.00 44.72 42.96 1brp s GLY 75 CO -0.03 -1.74 0.05 -0.51 0.00 0.00 0.00 173.10 170.88 1brp s THR 76 N -2.00 0.08 -0.37 0.90 -4.23 0.80 -2.03 115.64 108.79 1brp s THR 76 Ca 0.23 0.14 -0.24 0.00 -1.18 0.00 0.00 61.69 60.63 1brp s THR 76 Cb -0.07 -0.42 0.01 0.00 1.34 0.00 0.00 72.50 73.37 1brp s THR 76 CO 0.11 0.07 0.85 -0.36 -0.54 0.00 0.00 174.62 174.75 1brp s PHE 77 N 2.08 3.09 -0.19 3.99 0.40 -1.05 -1.90 117.98 124.41 1brp s PHE 77 Ca 0.04 0.64 -0.20 0.00 -0.60 0.00 0.00 56.93 56.81 1brp s PHE 77 Cb -0.13 -3.53 -0.03 0.00 0.51 0.00 0.00 43.02 39.83 1brp s PHE 77 CO -0.05 -0.79 0.59 0.99 0.70 0.00 0.00 175.22 176.65 1brp s THR 78 N 3.29 5.06 1.40 0.64 2.01 0.38 -4.37 115.64 124.06 1brp s THR 78 Ca 0.35 1.11 -0.22 0.00 0.31 0.00 0.00 61.69 63.23 1brp s THR 78 Cb -0.12 -3.91 0.35 0.00 0.01 0.00 0.00 72.50 68.83 1brp s THR 78 CO 0.18 0.15 0.81 0.47 -0.69 0.00 0.00 174.62 175.54 1brp n ASP 79 N 4.80 -3.93 -3.08 3.53 9.92 -1.26 0.57 116.55 127.11 1brp n ASP 79 Ca -0.03 -0.78 -0.11 0.00 -0.53 0.00 0.00 54.79 53.34 1brp n ASP 79 Cb 0.50 -0.98 -0.00 0.00 -0.64 0.00 0.00 41.12 39.99 1brp n ASP 79 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 1brp s THR 80 N -2.12 0.00 0.45 -3.53 -4.23 -1.22 -4.47 115.64 100.53 1brp s THR 80 Ca 0.63 -1.25 0.18 0.00 -1.18 0.00 0.00 61.69 60.07 1brp s THR 80 Cb -0.12 -2.76 0.22 0.00 1.34 0.00 0.00 72.50 71.18 1brp s THR 80 CO 0.53 0.00 2.03 -0.33 -0.54 0.00 0.00 174.62 176.32 1brp h GLU 81 N 2.04 0.00 -5.68 3.99 3.07 -1.98 -3.39 114.58 112.63 1brp h GLU 81 Ca -0.30 0.00 -0.59 0.00 -0.50 0.00 0.00 59.36 57.97 1brp h GLU 81 Cb 1.25 0.00 -0.09 0.00 -0.84 0.00 0.00 28.75 29.06 1brp h GLU 81 CO 0.39 0.15 0.03 0.34 -1.40 0.00 0.00 179.01 178.52 1brp s ASP 82 N -6.78 6.68 0.48 1.42 -1.08 -1.26 -4.95 116.67 111.19 1brp s ASP 82 Ca -0.04 0.82 0.32 0.00 -0.52 0.00 0.00 52.55 53.13 1brp s ASP 82 Cb 0.15 -2.33 1.35 0.00 -1.46 0.00 0.00 42.92 40.63 1brp s ASP 82 CO 0.66 -0.18 1.94 1.55 0.52 0.00 0.00 175.17 179.66 1brp h PRO 83 N 7.27 0.00 -0.54 4.34 0.13 -1.91 -2.09 132.00 139.19 1brp h PRO 83 Ca -0.35 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 1brp h PRO 83 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1brp h PRO 83 CO 0.76 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.53 1brp n ALA 84 N -2.00 2.37 -3.14 -0.56 0.00 -1.26 -4.63 120.51 111.29 1brp n ALA 84 Ca 0.01 -1.15 -0.27 0.00 0.00 0.00 0.00 53.44 52.03 1brp n ALA 84 Cb 0.26 -0.84 -0.16 0.00 0.00 0.00 0.00 19.45 18.71 1brp n ALA 84 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1brp s LYS 85 N -1.19 2.02 0.19 0.00 1.02 -0.79 0.20 119.74 121.19 1brp s LYS 85 Ca 0.41 -0.61 -0.01 0.00 0.02 0.00 0.00 55.97 55.79 1brp s LYS 85 Cb 0.23 -1.67 -0.04 0.00 -0.52 0.00 0.00 37.83 35.83 1brp s LYS 85 CO 0.30 0.17 0.10 -0.06 -0.92 0.00 0.00 175.35 174.94 1brp s PHE 86 N 0.29 1.13 -0.19 3.18 0.40 -0.41 -3.37 117.98 119.02 1brp s PHE 86 Ca -0.10 -1.29 -0.03 0.00 -0.60 0.00 0.00 56.93 54.91 1brp s PHE 86 Cb -0.14 -0.59 -0.01 0.00 0.51 0.00 0.00 43.02 42.78 1brp s PHE 86 CO 0.04 -0.54 -0.07 0.15 0.70 0.00 0.00 175.22 175.50 1brp s LYS 87 N -4.10 3.42 -0.29 0.44 3.01 0.19 -0.97 119.74 121.45 1brp s LYS 87 Ca 0.34 -0.63 -0.06 0.00 -1.01 0.00 0.00 55.97 54.62 1brp s LYS 87 Cb 0.07 -2.89 0.02 0.00 -1.01 0.00 0.00 37.83 34.02 1brp s LYS 87 CO 0.09 -0.02 0.06 1.41 0.51 0.00 0.00 175.35 177.40 1brp s MET 88 N 1.00 2.93 -0.18 1.68 -2.45 0.98 0.14 119.30 123.40 1brp s MET 88 Ca -0.00 -0.95 -0.18 0.00 -1.25 0.00 0.00 55.69 53.30 1brp s MET 88 Cb -0.15 -3.31 -0.03 0.00 1.25 0.00 0.00 34.83 32.59 1brp s MET 88 CO -0.00 -0.48 0.50 0.21 1.05 0.00 0.00 175.02 176.29 1brp s LYS 89 N 1.44 4.22 0.25 4.11 2.20 -0.80 0.78 119.74 131.94 1brp s LYS 89 Ca 0.01 0.40 0.05 0.00 -0.36 0.00 0.00 55.97 56.06 1brp s LYS 89 Cb -0.18 -3.54 -0.05 0.00 -1.51 0.00 0.00 37.83 32.55 1brp s LYS 89 CO 0.01 -0.08 -0.03 1.52 -0.36 0.00 0.00 175.35 176.41 1brp s TYR 90 N 1.41 1.70 -0.12 4.03 1.13 0.02 -0.14 117.35 125.39 1brp s TYR 90 Ca 0.24 -0.82 -0.33 0.00 -1.41 0.00 0.00 57.07 54.75 1brp s TYR 90 Cb -0.15 -0.97 0.12 0.00 -1.10 0.00 0.00 41.96 39.86 1brp s TYR 90 CO 0.10 0.10 1.08 1.67 -2.51 0.00 0.00 175.55 175.98 1brp s TRP 91 N -3.25 -0.22 0.71 -3.49 -2.14 -0.49 -1.86 118.94 108.20 1brp s TRP 91 Ca 0.28 0.14 0.01 0.00 2.66 0.00 0.00 56.10 59.18 1brp s TRP 91 Cb 0.05 0.52 0.12 0.00 -3.10 0.00 0.00 33.47 31.07 1brp s TRP 91 CO 0.09 -0.34 0.97 0.20 -2.66 0.00 0.00 176.95 175.21 1brp s GLY 92 N -2.29 1.75 0.15 3.67 0.00 -1.22 0.29 107.32 109.67 1brp s GLY 92 Ca 0.08 -1.81 0.21 0.00 0.00 0.00 0.00 44.72 43.20 1brp s GLY 92 CO -0.06 -1.25 0.94 3.33 0.00 0.00 0.00 173.10 176.05 1brp n VAL 93 N -2.76 0.70 -3.76 1.40 0.24 -1.14 -4.77 118.33 108.23 1brp n VAL 93 Ca 0.15 -0.58 -0.30 0.00 -2.04 0.00 0.00 64.34 61.57 1brp n VAL 93 Cb 0.61 -0.39 -0.04 0.00 -1.47 0.00 0.00 33.84 32.54 1brp n VAL 93 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1brp s ALA 94 N -3.28 3.87 -0.90 2.33 0.00 -1.26 -5.01 121.76 117.51 1brp s ALA 94 Ca -0.02 -0.72 0.27 0.00 0.00 0.00 0.00 51.96 51.49 1brp s ALA 94 Cb 0.10 -2.00 0.95 0.00 0.00 0.00 0.00 23.12 22.17 1brp s ALA 94 CO 0.81 0.65 1.77 -1.13 0.00 0.00 0.00 175.76 177.86 1brp n SER 95 N -0.07 0.34 0.14 0.00 3.41 -1.26 -3.68 113.62 112.49 1brp n SER 95 Ca -0.04 0.39 0.07 0.00 -0.26 0.00 0.00 58.87 59.03 1brp n SER 95 Cb 0.52 -0.42 0.04 0.00 -0.26 0.00 0.00 64.21 64.09 1brp n SER 95 CO 0.00 0.00 0.00 2.19 -0.16 0.00 0.00 175.04 177.07 1brp h PHE 96 N 0.00 0.00 -4.30 7.33 -0.00 -1.96 -3.46 116.94 114.56 1brp h PHE 96 Ca 0.00 0.00 -0.51 0.00 -0.00 0.00 0.00 57.97 57.46 1brp h PHE 96 Cb 0.58 0.00 0.12 0.00 -0.00 0.00 0.00 35.95 36.66 1brp h PHE 96 CO 0.00 0.25 0.33 -0.51 -0.00 0.00 0.00 178.31 178.39 1brp s LEU 97 N -6.02 3.10 0.30 2.10 1.43 -1.24 -4.93 118.68 113.42 1brp s LEU 97 Ca 0.03 1.82 -0.29 0.00 -1.03 0.00 0.00 54.13 54.65 1brp s LEU 97 Cb 0.07 -4.52 -0.13 0.00 0.03 0.00 0.00 46.19 41.65 1brp s LEU 97 CO 0.74 -1.89 1.35 1.67 0.23 0.00 0.00 176.35 178.45 1brp n GLN 98 N -3.31 2.14 -4.46 1.70 7.27 -1.26 -4.48 117.38 114.98 1brp n GLN 98 Ca 0.09 0.75 -0.25 0.00 0.07 0.00 0.00 57.00 57.67 1brp n GLN 98 Cb 0.53 -2.37 -0.10 0.00 2.41 0.00 0.00 30.24 30.71 1brp n GLN 98 CO 0.00 0.00 0.00 0.15 0.07 0.00 0.00 177.06 177.28 1brp s LYS 99 N -1.29 1.87 0.00 3.69 1.02 -1.26 -3.40 119.74 120.37 1brp s LYS 99 Ca 0.60 -1.80 0.00 0.00 0.02 0.00 0.00 55.97 54.79 1brp s LYS 99 Cb -0.59 -1.81 0.00 0.00 -0.52 0.00 0.00 37.83 34.91 1brp s LYS 99 CO 0.57 0.22 0.00 0.41 -0.92 0.00 0.00 175.35 175.63 1brp n GLY 100 N -0.78 -1.71 2.85 -3.33 0.00 -0.78 -4.95 105.19 96.48 1brp n GLY 100 Ca -0.05 -1.11 -0.23 0.00 0.00 0.00 0.00 46.02 44.63 1brp n GLY 100 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1brp s ASN 101 N -0.52 1.53 0.03 1.61 2.47 -1.26 -0.80 114.94 118.00 1brp s ASN 101 Ca 0.00 -0.15 0.03 0.00 0.42 0.00 0.00 52.86 53.16 1brp s ASN 101 Cb 0.00 -0.55 -0.02 0.00 -1.45 0.00 0.00 41.25 39.23 1brp s ASN 101 CO 0.00 -0.12 -0.10 -1.81 -3.72 0.00 0.00 177.10 171.34 1brp s ASP 102 N 1.53 1.20 0.41 -4.21 1.01 0.23 -4.94 116.67 111.91 1brp s ASP 102 Ca -0.01 -0.40 -0.24 0.00 0.71 0.00 0.00 52.55 52.61 1brp s ASP 102 Cb -0.13 -0.06 -0.08 0.00 1.01 0.00 0.00 42.92 43.66 1brp s ASP 102 CO -0.04 -0.03 1.10 -1.81 0.21 0.00 0.00 175.17 174.60 1brp s ASP 103 N -1.04 6.58 -0.12 0.27 1.01 -1.26 -0.01 116.67 122.09 1brp s ASP 103 Ca -0.02 2.16 -0.02 0.00 0.71 0.00 0.00 52.55 55.39 1brp s ASP 103 Cb -0.07 -2.60 0.04 0.00 1.01 0.00 0.00 42.92 41.30 1brp s ASP 103 CO 0.01 -0.62 -0.00 -2.28 0.21 0.00 0.00 175.17 172.48 1brp s HIS 104 N -1.58 0.96 0.10 4.23 2.46 -0.14 -4.59 115.29 116.74 1brp s HIS 104 Ca 0.59 -0.51 0.10 0.00 0.47 0.00 0.00 55.06 55.70 1brp s HIS 104 Cb -0.25 -0.97 -0.04 0.00 -0.13 0.00 0.00 32.58 31.20 1brp s HIS 104 CO 0.31 -0.46 -0.25 -1.58 -2.47 0.00 0.00 174.74 170.30 1brp s TRP 105 N 1.88 2.14 -0.49 3.88 0.51 -0.82 -1.29 118.94 124.75 1brp s TRP 105 Ca 0.03 -0.39 -0.14 0.00 -2.12 0.00 0.00 56.10 53.48 1brp s TRP 105 Cb -0.14 -1.20 0.10 0.00 -0.81 0.00 0.00 33.47 31.42 1brp s TRP 105 CO -0.07 0.24 0.41 0.42 -0.51 0.00 0.00 176.95 177.45 1brp s ILE 106 N -1.01 4.95 0.22 2.03 -1.09 0.13 -2.59 121.20 123.84 1brp s ILE 106 Ca 0.11 -1.36 -0.06 0.00 -2.23 0.00 0.00 60.65 57.11 1brp s ILE 106 Cb -0.10 -4.08 0.12 0.00 -1.58 0.00 0.00 42.46 36.81 1brp s ILE 106 CO 0.04 -0.70 1.73 0.58 -1.23 0.00 0.00 174.94 175.37 1brp h VAL 107 N 5.90 1.25 0.00 2.92 2.07 -1.24 0.12 116.25 127.27 1brp h VAL 107 Ca -0.27 -0.99 0.00 0.00 0.82 0.00 0.00 66.70 66.26 1brp h VAL 107 Cb 1.10 0.66 0.00 0.00 -1.52 0.00 0.00 31.29 31.53 1brp h VAL 107 CO 0.92 0.37 0.00 -0.67 0.02 0.00 0.00 177.57 178.21 1brp n ASP 108 N -4.22 0.00 -3.83 0.57 2.03 -1.16 -2.75 116.55 107.19 1brp n ASP 108 Ca 0.04 0.00 -0.08 0.00 0.52 0.00 0.00 54.79 55.27 1brp n ASP 108 Cb 0.28 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.65 1brp n ASP 108 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 1brp s THR 109 N -1.48 0.00 -0.03 5.18 -1.32 -1.26 0.55 115.64 117.28 1brp s THR 109 Ca 0.00 -1.11 0.05 0.00 -1.21 0.00 0.00 61.69 59.43 1brp s THR 109 Cb 0.00 -2.11 0.09 0.00 -1.51 0.00 0.00 72.50 68.97 1brp s THR 109 CO 0.00 0.00 1.04 -0.90 -2.21 0.00 0.00 174.62 172.55 1brp n ASP 110 N -0.52 0.50 0.00 8.08 5.75 -0.36 -4.96 116.55 125.04 1brp n ASP 110 Ca -0.04 -2.21 0.00 0.00 -0.01 0.00 0.00 54.79 52.53 1brp n ASP 110 Cb 0.60 -0.25 0.00 0.00 -1.03 0.00 0.00 41.12 40.44 1brp n ASP 110 CO 0.00 0.00 0.00 -1.22 -0.11 0.00 0.00 177.20 175.87 1brp n TYR 111 N -0.21 0.00 0.97 2.11 4.01 -1.26 -4.26 117.16 118.53 1brp n TYR 111 Ca 0.03 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 57.87 1brp n TYR 111 Cb 0.73 0.00 -0.12 0.00 -0.31 0.00 0.00 39.34 39.64 1brp n TYR 111 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 1brp n ASP 112 N 0.00 0.97 0.08 7.72 8.00 -1.26 -4.83 116.55 127.23 1brp n ASP 112 Ca 0.00 -0.98 0.00 0.00 0.71 0.00 0.00 54.79 54.52 1brp n ASP 112 Cb 0.00 1.01 0.00 0.00 -0.02 0.00 0.00 41.12 42.11 1brp n ASP 112 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 1brp n THR 113 N -1.50 0.66 -4.41 -3.53 -1.04 -1.26 -4.72 114.28 98.48 1brp n THR 113 Ca 0.04 0.22 -0.20 0.00 -2.04 0.00 0.00 64.05 62.07 1brp n THR 113 Cb 0.33 -1.09 -0.10 0.00 -1.82 0.00 0.00 70.33 67.64 1brp n THR 113 CO 0.00 0.00 0.00 -0.72 -0.64 0.00 0.00 175.07 173.71 1brp s TYR 114 N -1.91 1.85 -0.14 -1.42 1.13 -1.26 -0.59 117.35 115.01 1brp s TYR 114 Ca 0.00 -0.86 -0.19 0.00 -1.41 0.00 0.00 57.07 54.61 1brp s TYR 114 Cb 0.00 -1.12 0.05 0.00 -1.10 0.00 0.00 41.96 39.78 1brp s TYR 114 CO 0.00 0.09 0.50 0.00 -2.51 0.00 0.00 175.55 173.62 1brp s ALA 115 N -3.24 -1.24 -0.13 9.51 0.00 -0.34 -1.23 121.76 125.09 1brp s ALA 115 Ca 0.32 1.22 -0.00 0.00 0.00 0.00 0.00 51.96 53.50 1brp s ALA 115 Cb 0.06 -0.55 0.03 0.00 0.00 0.00 0.00 23.12 22.66 1brp s ALA 115 CO 0.12 -0.26 -0.09 0.08 0.00 0.00 0.00 175.76 175.61 1brp s VAL 116 N -0.22 1.20 0.17 0.00 1.01 0.19 0.76 120.40 123.51 1brp s VAL 116 Ca -0.04 -0.45 0.08 0.00 0.00 0.00 0.00 61.98 61.57 1brp s VAL 116 Cb -0.03 -1.21 -0.04 0.00 0.00 0.00 0.00 36.38 35.09 1brp s VAL 116 CO 0.03 0.35 -0.06 -1.58 0.00 0.00 0.00 175.10 173.83 1brp s GLN 117 N 1.63 2.19 0.01 2.72 -0.44 -0.20 -0.77 119.66 124.80 1brp s GLN 117 Ca 0.04 -1.19 -0.05 0.00 -2.50 0.00 0.00 55.36 51.66 1brp s GLN 117 Cb -0.13 -2.24 -0.01 0.00 -1.64 0.00 0.00 33.01 28.99 1brp s GLN 117 CO -0.09 0.45 0.08 -0.47 0.50 0.00 0.00 175.29 175.76 1brp s TYR 118 N -1.68 0.10 -0.22 1.67 5.04 -1.07 -0.99 117.35 120.20 1brp s TYR 118 Ca 0.26 -0.23 -0.09 0.00 -2.44 0.00 0.00 57.07 54.56 1brp s TYR 118 Cb -0.09 -0.09 0.09 0.00 0.35 0.00 0.00 41.96 42.22 1brp s TYR 118 CO 0.16 -0.24 0.49 0.45 -1.34 0.00 0.00 175.55 175.07 1brp s SER 119 N -1.31 -0.56 -0.34 4.32 0.15 0.03 -1.95 113.70 114.04 1brp s SER 119 Ca -0.14 1.13 -0.05 0.00 0.70 0.00 0.00 55.95 57.60 1brp s SER 119 Cb -0.08 1.38 0.05 0.00 -1.71 0.00 0.00 66.02 65.66 1brp s SER 119 CO 0.01 -0.22 0.09 0.00 1.20 0.00 0.00 173.24 174.31 1brp h ARG 121 N 8.15 0.33 -2.77 0.00 3.08 0.24 -3.43 114.38 119.97 1brp h ARG 121 Ca -0.22 -0.55 -0.20 0.00 0.07 0.00 0.00 59.98 59.08 1brp h ARG 121 Cb 1.07 0.20 -0.32 0.00 0.08 0.00 0.00 29.97 31.01 1brp h ARG 121 CO 0.59 1.26 -0.51 -1.17 -1.07 0.00 0.00 179.97 179.07 1brp s LEU 122 N -7.25 -0.35 0.52 3.04 2.96 -1.02 -4.97 118.68 111.61 1brp s LEU 122 Ca -0.05 0.60 -0.18 0.00 -0.22 0.00 0.00 54.13 54.28 1brp s LEU 122 Cb 0.07 0.78 -0.07 0.00 0.50 0.00 0.00 46.19 47.46 1brp s LEU 122 CO 0.90 -0.24 1.02 -0.76 -1.32 0.00 0.00 176.35 175.94 1brp s LEU 123 N 2.44 3.71 0.62 -0.68 1.43 -1.26 0.28 118.68 125.22 1brp s LEU 123 Ca 0.01 1.79 -0.01 0.00 -1.03 0.00 0.00 54.13 54.89 1brp s LEU 123 Cb -0.12 -4.54 0.06 0.00 0.03 0.00 0.00 46.19 41.62 1brp s LEU 123 CO -0.09 -0.80 0.88 0.20 0.23 0.00 0.00 176.35 176.76 1brp s ASN 124 N -2.47 4.98 0.00 2.29 0.01 0.56 -4.43 114.94 115.88 1brp s ASN 124 Ca 0.64 0.06 0.20 0.00 -0.71 0.00 0.00 52.86 53.05 1brp s ASN 124 Cb -0.14 -0.79 1.13 0.00 0.41 0.00 0.00 41.25 41.86 1brp s ASN 124 CO 0.26 -1.39 1.62 0.18 -1.51 0.00 0.00 177.10 176.26 1brp n LEU 125 N -2.59 0.00 -0.92 0.60 7.99 -1.26 -2.11 117.00 118.71 1brp n LEU 125 Ca 0.09 0.13 0.08 0.00 -0.01 0.00 0.00 56.01 56.30 1brp n LEU 125 Cb 0.60 -0.13 0.22 0.00 -0.11 0.00 0.00 43.42 44.00 1brp n LEU 125 CO 0.47 -0.05 0.69 -0.90 -1.51 0.00 0.00 177.39 176.09 1brp n ASP 126 N -1.13 3.46 0.00 -1.43 5.75 -1.26 -4.94 116.55 117.00 1brp n ASP 126 Ca 0.13 -2.16 0.00 0.00 -0.01 0.00 0.00 54.79 52.75 1brp n ASP 126 Cb 0.11 -0.36 0.00 0.00 -1.03 0.00 0.00 41.12 39.84 1brp n ASP 126 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1brp n GLY 127 N 0.71 1.45 3.94 6.12 0.00 -0.90 -4.93 105.19 111.59 1brp n GLY 127 Ca 0.17 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.95 1brp n GLY 127 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1brp s THR 128 N -2.71 3.70 0.22 2.61 -4.23 -1.26 -1.90 115.64 112.07 1brp s THR 128 Ca 0.00 -0.35 -0.30 0.00 -1.18 0.00 0.00 61.69 59.86 1brp s THR 128 Cb 0.00 -3.41 -0.08 0.00 1.34 0.00 0.00 72.50 70.35 1brp s THR 128 CO 0.00 -0.33 1.02 0.00 -0.54 0.00 0.00 174.62 174.77 1brp n ALA 130 N 1.75 1.81 -3.48 0.00 0.00 0.81 -4.61 120.51 116.79 1brp n ALA 130 Ca -0.00 -1.07 -0.18 0.00 0.00 0.00 0.00 53.44 52.19 1brp n ALA 130 Cb 0.46 -0.41 -0.12 0.00 0.00 0.00 0.00 19.45 19.39 1brp n ALA 130 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1brp s ASP 131 N -5.35 1.35 0.32 0.00 2.15 0.53 -4.95 116.67 110.73 1brp s ASP 131 Ca -0.09 -0.24 0.03 0.00 0.43 0.00 0.00 52.55 52.69 1brp s ASP 131 Cb 0.08 0.43 -0.04 0.00 -0.30 0.00 0.00 42.92 43.09 1brp s ASP 131 CO 0.84 -0.33 0.16 -0.94 -0.17 0.00 0.00 175.17 174.73 1brp s SER 132 N 2.34 1.77 0.07 -0.34 1.04 -1.26 0.97 113.70 118.29 1brp s SER 132 Ca 0.07 -1.57 -0.12 0.00 0.48 0.00 0.00 55.95 54.81 1brp s SER 132 Cb -0.16 0.39 0.02 0.00 0.10 0.00 0.00 66.02 66.37 1brp s SER 132 CO -0.14 -0.89 0.28 -0.72 0.98 0.00 0.00 173.24 172.75 1brp s TYR 133 N -3.52 -0.04 -0.03 5.02 1.13 0.10 -3.43 117.35 116.58 1brp s TYR 133 Ca 0.34 -0.20 -0.11 0.00 -1.41 0.00 0.00 57.07 55.69 1brp s TYR 133 Cb 0.05 0.07 0.02 0.00 -1.10 0.00 0.00 41.96 40.99 1brp s TYR 133 CO 0.17 -0.53 0.24 0.45 -2.51 0.00 0.00 175.55 173.37 1brp s SER 134 N -2.37 -0.14 -0.03 -0.18 0.15 -0.86 -0.79 113.70 109.47 1brp s SER 134 Ca -0.01 0.12 0.03 0.00 0.70 0.00 0.00 55.95 56.78 1brp s SER 134 Cb 0.01 0.34 0.00 0.00 -1.71 0.00 0.00 66.02 64.66 1brp s SER 134 CO -0.07 -0.32 -0.10 -0.36 1.20 0.00 0.00 173.24 173.59 1brp s PHE 135 N -0.92 1.11 -0.24 3.44 0.08 -0.16 -2.35 117.98 118.94 1brp s PHE 135 Ca -0.10 -0.30 -0.10 0.00 0.12 0.00 0.00 56.93 56.55 1brp s PHE 135 Cb -0.05 -0.79 -0.05 0.00 -0.57 0.00 0.00 43.02 41.56 1brp s PHE 135 CO 0.02 -0.13 0.15 0.08 -0.10 0.00 0.00 175.22 175.24 1brp s VAL 136 N 0.26 5.24 -0.02 -0.44 1.01 0.14 -1.03 120.40 125.56 1brp s VAL 136 Ca -0.05 0.14 0.03 0.00 0.00 0.00 0.00 61.98 62.10 1brp s VAL 136 Cb -0.10 -3.45 -0.03 0.00 0.00 0.00 0.00 36.38 32.80 1brp s VAL 136 CO 0.01 0.34 -0.10 -0.36 0.00 0.00 0.00 175.10 174.99 1brp s PHE 137 N 1.12 2.80 -0.04 5.22 0.08 0.23 -1.67 117.98 125.73 1brp s PHE 137 Ca 0.07 -0.09 0.05 0.00 0.12 0.00 0.00 56.93 57.08 1brp s PHE 137 Cb -0.14 -1.62 -0.01 0.00 -0.57 0.00 0.00 43.02 40.69 1brp s PHE 137 CO 0.05 0.30 -0.17 0.45 -0.10 0.00 0.00 175.22 175.74 1brp s SER 138 N -1.09 2.14 0.43 1.36 0.15 0.22 -1.20 113.70 115.71 1brp s SER 138 Ca 0.14 -0.35 0.28 0.00 0.70 0.00 0.00 55.95 56.73 1brp s SER 138 Cb -0.11 -0.52 0.98 0.00 -1.71 0.00 0.00 66.02 64.66 1brp s SER 138 CO 0.04 0.17 1.82 -0.09 1.20 0.00 0.00 173.24 176.37 1brp h ARG 139 N 6.13 0.00 -5.17 5.44 9.65 -1.12 0.26 114.38 129.57 1brp h ARG 139 Ca -0.34 0.00 -0.66 0.00 -1.10 0.00 0.00 59.98 57.89 1brp h ARG 139 Cb 1.17 0.00 -0.27 0.00 -1.39 0.00 0.00 29.97 29.48 1brp h ARG 139 CO 0.48 0.00 -0.74 0.34 2.80 0.00 0.00 179.97 182.84 1brp s ASP 140 N -5.43 4.15 0.00 -3.80 2.15 -1.26 -4.81 116.67 107.67 1brp s ASP 140 Ca 0.04 -0.35 0.02 0.00 0.43 0.00 0.00 52.55 52.69 1brp s ASP 140 Cb 0.08 -1.67 0.09 0.00 -0.30 0.00 0.00 42.92 41.12 1brp s ASP 140 CO 0.55 0.08 0.89 -0.81 -0.17 0.00 0.00 175.17 175.72 1brp n PRO 141 N 4.11 0.02 0.02 4.34 -0.04 -1.26 -1.73 135.00 140.45 1brp n PRO 141 Ca -0.18 0.30 0.11 0.00 -0.04 0.00 0.00 63.50 63.69 1brp n PRO 141 Cb 0.52 -1.50 0.03 0.00 -0.04 0.00 0.00 33.50 32.51 1brp n PRO 141 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1brp n ASN 142 N -1.32 0.64 0.00 3.54 3.02 -1.26 -5.03 115.26 114.85 1brp n ASN 142 Ca 0.01 -0.33 0.00 0.00 -0.03 0.00 0.00 54.58 54.23 1brp n ASN 142 Cb 0.02 0.77 0.00 0.00 -0.61 0.00 0.00 39.78 39.96 1brp n ASN 142 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1brp n GLY 143 N 1.40 1.38 3.98 7.41 0.00 -0.71 -5.09 105.19 113.56 1brp n GLY 143 Ca 0.03 -2.27 -0.20 0.00 0.00 0.00 0.00 46.02 43.57 1brp n GLY 143 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1brp s LEU 144 N 0.00 4.17 0.42 0.99 1.43 -1.26 -4.64 118.68 119.79 1brp s LEU 144 Ca 0.00 -0.04 -0.24 0.00 -1.03 0.00 0.00 54.13 52.82 1brp s LEU 144 Cb 0.00 -2.81 -0.08 0.00 0.03 0.00 0.00 46.19 43.33 1brp s LEU 144 CO 0.00 -0.22 1.15 -2.84 0.23 0.00 0.00 176.35 174.67 1brp s PRO 145 N -4.06 3.99 0.56 1.29 0.01 -1.26 -4.67 135.00 130.85 1brp s PRO 145 Ca 0.39 1.78 0.35 0.00 0.01 0.00 0.00 61.00 63.52 1brp s PRO 145 Cb -0.09 -2.59 1.49 0.00 0.01 0.00 0.00 34.50 33.32 1brp s PRO 145 CO 0.30 -0.36 1.78 -1.35 0.01 0.00 0.00 177.00 177.38 1brp h PRO 146 N 2.46 0.00 -0.12 5.54 0.11 -1.98 0.90 132.00 138.91 1brp h PRO 146 Ca -0.49 0.00 -0.22 0.00 0.11 0.00 0.00 66.00 65.40 1brp h PRO 146 Cb 1.24 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.35 1brp h PRO 146 CO 0.62 0.00 -0.79 0.93 -0.21 0.00 0.00 178.00 178.54 1brp h GLU 147 N 0.00 0.70 -0.17 1.05 3.07 -2.00 -2.41 114.58 114.81 1brp h GLU 147 Ca 0.50 -0.59 -0.17 0.00 -0.50 0.00 0.00 59.36 58.60 1brp h GLU 147 Cb 2.13 0.13 0.01 0.00 -0.84 0.00 0.00 28.75 30.18 1brp h GLU 147 CO -0.01 1.20 -0.57 0.00 -1.40 0.00 0.00 179.01 178.23 1brp h ALA 148 N 0.63 0.30 -0.79 3.43 0.00 0.17 -3.13 119.26 119.86 1brp h ALA 148 Ca -0.05 -0.52 0.04 0.00 0.00 0.00 0.00 54.91 54.38 1brp h ALA 148 Cb 1.42 -0.03 -0.05 0.00 0.00 0.00 0.00 17.79 19.13 1brp h ALA 148 CO 0.16 0.52 0.52 0.37 0.00 0.00 0.00 179.25 180.82 1brp h GLN 149 N 0.37 0.90 -0.54 0.00 4.15 0.03 -2.02 115.11 118.00 1brp h GLN 149 Ca -0.02 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.34 1brp h GLN 149 Cb 1.20 -0.20 -0.03 0.00 0.21 0.00 0.00 27.48 28.66 1brp h GLN 149 CO 0.12 0.60 0.34 -0.22 -1.93 0.00 0.00 178.83 177.73 1brp h LYS 150 N 0.93 0.72 -0.26 1.69 3.64 -1.38 -0.44 116.57 121.47 1brp h LYS 150 Ca 0.32 -0.06 -0.15 0.00 -1.27 0.00 0.00 60.65 59.50 1brp h LYS 150 Cb 0.11 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.77 1brp h LYS 150 CO -0.10 0.51 -0.44 0.82 -2.27 0.00 0.00 179.45 177.96 1brp h ILE 151 N 0.73 1.30 0.25 2.00 2.04 -1.42 -2.31 117.51 120.10 1brp h ILE 151 Ca 0.19 -1.64 -0.01 0.00 1.00 0.00 0.00 64.86 64.41 1brp h ILE 151 Cb -0.04 1.57 -0.01 0.00 -0.74 0.00 0.00 36.82 37.61 1brp h ILE 151 CO -0.04 0.52 -0.16 0.58 0.00 0.00 0.00 178.15 179.05 1brp h VAL 152 N 0.54 0.66 -0.37 1.67 2.07 -1.11 -0.09 116.25 119.62 1brp h VAL 152 Ca 0.04 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.66 1brp h VAL 152 Cb 0.98 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 31.40 1brp h VAL 152 CO 0.09 0.00 0.28 -0.09 0.02 0.00 0.00 177.57 177.87 1brp h ARG 153 N -0.40 0.00 -0.24 1.57 9.65 -1.01 0.37 114.38 124.33 1brp h ARG 153 Ca -0.02 0.00 -0.16 0.00 -1.10 0.00 0.00 59.98 58.70 1brp h ARG 153 Cb 0.34 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 28.91 1brp h ARG 153 CO 0.02 0.00 -0.50 0.37 2.80 0.00 0.00 179.97 182.66 1brp h GLN 154 N 0.00 0.65 -0.12 0.20 4.15 -0.50 -2.89 115.11 116.59 1brp h GLN 154 Ca 0.17 -0.38 -0.19 0.00 0.77 0.00 0.00 58.65 59.02 1brp h GLN 154 Cb 0.73 0.03 -0.00 0.00 0.21 0.00 0.00 27.48 28.46 1brp h GLN 154 CO -0.00 1.00 -0.71 0.00 -1.93 0.00 0.00 178.83 177.18 1brp h ARG 155 N 0.51 0.55 -0.40 1.69 2.47 0.12 -1.39 114.38 117.93 1brp h ARG 155 Ca 0.02 -0.43 0.01 0.00 -1.26 0.00 0.00 59.98 58.32 1brp h ARG 155 Cb 1.05 0.08 -0.02 0.00 -1.65 0.00 0.00 29.97 29.43 1brp h ARG 155 CO 0.10 1.06 0.27 1.96 0.56 0.00 0.00 179.97 183.91 1brp h GLN 156 N 0.38 0.50 -0.06 0.04 4.20 -0.51 -1.70 115.11 117.96 1brp h GLN 156 Ca -0.03 -0.03 -0.06 0.00 0.06 0.00 0.00 58.65 58.59 1brp h GLN 156 Cb 1.30 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 28.97 1brp h GLN 156 CO 0.13 0.33 -0.19 1.49 -0.67 0.00 0.00 178.83 179.92 1brp h GLU 157 N 0.51 0.24 0.00 1.46 4.81 -1.33 -0.70 114.58 119.57 1brp h GLU 157 Ca 0.15 -0.18 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 1brp h GLU 157 Cb -0.01 0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.40 1brp h GLU 157 CO -0.03 0.80 0.00 0.93 -0.73 0.00 0.00 179.01 179.97 1brp h GLU 158 N -0.26 0.00 -0.25 1.92 5.08 -0.64 -1.95 114.58 118.49 1brp h GLU 158 Ca -0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1brp h GLU 158 Cb 0.81 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.06 1brp h GLU 158 CO 0.04 0.00 0.00 1.28 -1.00 0.00 0.00 179.01 179.33 1brp n LEU 159 N -2.48 2.08 -2.65 1.33 4.77 -0.70 -4.91 117.00 114.45 1brp n LEU 159 Ca 0.00 -0.91 -0.20 0.00 -0.03 0.00 0.00 56.01 54.88 1brp n LEU 159 Cb 0.17 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.11 1brp n LEU 159 CO 0.18 0.45 -0.16 0.00 -1.33 0.00 0.00 177.39 176.54 1brp n LEU 161 N -3.31 0.82 -4.65 0.00 4.77 -0.72 -5.04 117.00 108.87 1brp n LEU 161 Ca -0.17 -0.82 -0.40 0.00 -0.03 0.00 0.00 56.01 54.58 1brp n LEU 161 Cb 0.64 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.76 1brp n LEU 161 CO 0.33 0.21 0.72 0.00 -1.33 0.00 0.00 177.39 177.31 1brp n ALA 162 N -0.02 0.69 -1.04 -1.18 0.00 -0.35 -1.09 120.51 117.51 1brp n ALA 162 Ca 0.00 0.19 -0.01 0.00 0.00 0.00 0.00 53.44 53.62 1brp n ALA 162 Cb 0.07 -2.18 -0.01 0.00 0.00 0.00 0.00 19.45 17.34 1brp n ALA 162 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1brp n ARG 163 N -0.21 -0.53 0.00 0.00 1.74 -1.26 -4.75 116.66 111.65 1brp n ARG 163 Ca 0.09 0.28 0.00 0.00 -0.77 0.00 0.00 57.85 57.45 1brp n ARG 163 Cb 0.41 -3.79 0.00 0.00 -1.02 0.00 0.00 32.46 28.07 1brp n ARG 163 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1brp n GLN 164 N -2.09 2.23 -1.36 5.56 6.02 -0.25 -5.05 117.38 122.43 1brp n GLN 164 Ca -0.01 0.00 -0.30 0.00 -0.01 0.00 0.00 57.00 56.68 1brp n GLN 164 Cb 0.16 -0.81 0.20 0.00 1.02 0.00 0.00 30.24 30.81 1brp n GLN 164 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 1brp s TYR 165 N -1.55 1.31 -0.14 1.08 1.51 -1.25 -4.69 117.35 113.61 1brp s TYR 165 Ca 0.00 0.58 -0.09 0.00 -1.01 0.00 0.00 57.07 56.55 1brp s TYR 165 Cb 0.00 -3.56 0.05 0.00 -0.11 0.00 0.00 41.96 38.34 1brp s TYR 165 CO 0.00 -3.22 0.36 -0.98 -1.11 0.00 0.00 175.55 170.60 1brp s ARG 166 N -5.43 0.36 0.53 -0.62 1.70 0.56 -4.96 118.95 111.09 1brp s ARG 166 Ca 0.69 0.64 -0.22 0.00 -0.47 0.00 0.00 55.73 56.37 1brp s ARG 166 Cb -0.11 0.02 -0.05 0.00 -0.57 0.00 0.00 34.95 34.24 1brp s ARG 166 CO 0.55 -0.13 1.36 -0.51 -1.08 0.00 0.00 175.30 175.49 1brp s LEU 167 N 1.01 3.89 -0.09 -1.89 2.01 -1.26 -1.65 118.68 120.70 1brp s LEU 167 Ca -0.07 2.77 0.00 0.00 0.01 0.00 0.00 54.13 56.84 1brp s LEU 167 Cb -0.07 -4.23 -0.03 0.00 0.01 0.00 0.00 46.19 41.88 1brp s LEU 167 CO -0.08 -1.49 -0.08 -0.63 1.01 0.00 0.00 176.35 175.08 1brp s ILE 168 N -1.30 3.61 0.47 -0.59 1.01 0.23 -4.86 121.20 119.76 1brp s ILE 168 Ca 0.70 -0.50 0.01 0.00 0.00 0.00 0.00 60.65 60.86 1brp s ILE 168 Cb -0.40 -2.49 0.01 0.00 0.01 0.00 0.00 42.46 39.58 1brp s ILE 168 CO 0.48 0.57 0.68 -0.69 0.00 0.00 0.00 174.94 175.99 1brp s VAL 169 N -0.48 3.63 -0.39 2.92 1.01 -1.26 -4.79 120.40 121.05 1brp s VAL 169 Ca 0.07 -0.59 0.04 0.00 0.00 0.00 0.00 61.98 61.51 1brp s VAL 169 Cb -0.12 -3.34 0.16 0.00 0.00 0.00 0.00 36.38 33.08 1brp s VAL 169 CO 0.02 -0.23 0.44 -1.00 0.00 0.00 0.00 175.10 174.33 1brp s HIS 170 N -2.58 -0.60 -1.24 5.22 3.76 -1.26 0.26 115.29 118.86 1brp s HIS 170 Ca 0.51 -0.63 0.16 0.00 -0.15 0.00 0.00 55.06 54.94 1brp s HIS 170 Cb -0.10 -0.25 -0.06 0.00 1.11 0.00 0.00 32.58 33.29 1brp s HIS 170 CO 0.37 -1.02 0.79 0.27 -0.85 0.00 0.00 174.74 174.31 1brp n ASN 171 N 4.20 1.34 0.00 1.40 0.23 -1.26 -4.98 115.26 116.19 1brp n ASN 171 Ca 0.12 -1.17 0.00 0.00 -0.53 0.00 0.00 54.58 53.00 1brp n ASN 171 Cb 0.48 0.64 0.00 0.00 -2.08 0.00 0.00 39.78 38.82 1brp n ASN 171 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1brp n GLY 172 N 1.22 1.98 0.18 4.83 0.00 -1.26 -5.05 105.19 107.10 1brp n GLY 172 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1brp n GLY 172 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1brp n TYR 173 N 0.00 0.04 -2.60 1.61 4.19 -1.26 -4.62 117.16 114.52 1brp n TYR 173 Ca 0.00 0.59 -0.41 0.00 3.31 0.00 0.00 57.90 61.39 1brp n TYR 173 Cb 0.00 -0.69 -0.04 0.00 0.49 0.00 0.00 39.34 39.10 1brp n TYR 173 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77