#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rbp s ARG 2 N 0.00 2.41 -0.16 5.31 0.52 -1.26 -5.07 118.95 120.70 1rbp s ARG 2 Ca 0.00 -1.71 -0.29 0.00 -0.52 0.00 0.00 55.73 53.21 1rbp s ARG 2 Cb 0.00 -2.28 -0.05 0.00 0.52 0.00 0.00 34.95 33.13 1rbp s ARG 2 CO 0.00 -0.36 1.99 -0.51 0.02 0.00 0.00 175.30 176.44 1rbp s ASP 3 N -4.19 5.95 0.00 0.23 1.01 -1.26 -4.96 116.67 113.45 1rbp s ASP 3 Ca 0.45 1.99 0.24 0.00 0.71 0.00 0.00 52.55 55.94 1rbp s ASP 3 Cb -0.02 -2.52 0.58 0.00 1.01 0.00 0.00 42.92 41.96 1rbp s ASP 3 CO 0.26 -1.55 1.48 0.00 0.21 0.00 0.00 175.17 175.57 1rbp s ARG 5 N -1.87 4.42 0.25 0.00 0.52 -1.26 -4.42 118.95 116.59 1rbp s ARG 5 Ca 0.34 2.09 -0.04 0.00 -0.52 0.00 0.00 55.73 57.59 1rbp s ARG 5 Cb 0.20 -3.13 0.28 0.00 0.52 0.00 0.00 34.95 32.83 1rbp s ARG 5 CO 0.31 -0.13 1.79 0.28 0.02 0.00 0.00 175.30 177.57 1rbp h VAL 6 N 3.26 1.24 0.00 3.52 2.07 -1.58 -1.78 116.25 122.98 1rbp h VAL 6 Ca -0.47 -0.86 -0.00 0.00 0.82 0.00 0.00 66.70 66.19 1rbp h VAL 6 Cb 1.22 0.56 -0.00 0.00 -1.52 0.00 0.00 31.29 31.55 1rbp h VAL 6 CO 0.69 0.33 -0.00 0.77 0.02 0.00 0.00 177.57 179.38 1rbp h SER 7 N 0.95 0.00 0.60 0.57 4.64 -1.91 -1.72 113.55 116.68 1rbp h SER 7 Ca 0.21 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.53 1rbp h SER 7 Cb 0.30 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.39 1rbp h SER 7 CO -0.01 0.00 -0.67 -1.54 -0.87 0.00 0.00 176.83 173.75 1rbp n SER 8 N -4.11 0.60 -4.73 4.97 3.41 -0.68 -4.91 113.62 108.17 1rbp n SER 8 Ca -0.03 -0.12 -0.42 0.00 -0.26 0.00 0.00 58.87 58.04 1rbp n SER 8 Cb 0.08 0.35 -0.02 0.00 -0.26 0.00 0.00 64.21 64.36 1rbp n SER 8 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 1rbp s PHE 9 N -3.10 2.86 0.22 7.33 2.99 -0.65 -4.96 117.98 122.67 1rbp s PHE 9 Ca 0.08 0.55 -0.30 0.00 0.00 0.00 0.00 56.93 57.26 1rbp s PHE 9 Cb 0.15 -4.09 -0.09 0.00 0.00 0.00 0.00 43.02 39.00 1rbp s PHE 9 CO 0.73 -3.93 0.94 1.03 -0.00 0.00 0.00 175.22 174.00 1rbp s ARG 10 N 0.48 4.83 0.51 0.44 0.52 -1.26 -5.08 118.95 119.39 1rbp s ARG 10 Ca 0.70 1.48 0.03 0.00 -0.52 0.00 0.00 55.73 57.41 1rbp s ARG 10 Cb -0.48 -3.29 -0.00 0.00 0.52 0.00 0.00 34.95 31.69 1rbp s ARG 10 CO 0.38 0.48 0.12 0.14 0.02 0.00 0.00 175.30 176.45 1rbp s VAL 11 N -1.03 1.37 -0.14 3.52 -7.23 -1.26 -4.83 120.40 110.80 1rbp s VAL 11 Ca 0.42 -1.85 -0.29 0.00 -1.81 0.00 0.00 61.98 58.45 1rbp s VAL 11 Cb -0.26 -2.22 -0.06 0.00 0.56 0.00 0.00 36.38 34.41 1rbp s VAL 11 CO 0.32 0.00 2.09 -0.75 -0.31 0.00 0.00 175.10 176.45 1rbp s LYS 12 N -3.98 3.50 0.12 4.82 2.47 -0.54 -4.92 119.74 121.20 1rbp s LYS 12 Ca 0.16 2.18 -0.31 0.00 -1.56 0.00 0.00 55.97 56.44 1rbp s LYS 12 Cb 0.01 -4.28 -0.09 0.00 -1.46 0.00 0.00 37.83 32.00 1rbp s LYS 12 CO 0.09 -1.68 1.66 -1.83 0.16 0.00 0.00 175.35 173.75 1rbp s GLU 13 N 5.62 4.19 -1.41 4.03 1.03 -1.26 -3.25 118.70 127.65 1rbp s GLU 13 Ca 0.94 2.40 -0.01 0.00 0.03 0.00 0.00 54.97 58.34 1rbp s GLU 13 Cb -0.35 -3.43 0.01 0.00 -0.80 0.00 0.00 34.13 29.55 1rbp s GLU 13 CO 0.37 -0.72 0.45 0.09 -1.33 0.00 0.00 175.26 174.12 1rbp n ASN 14 N 5.03 -0.49 -4.67 0.83 3.02 -1.26 -4.85 115.26 112.87 1rbp n ASN 14 Ca 0.16 -0.99 -0.52 0.00 -0.03 0.00 0.00 54.58 53.19 1rbp n ASN 14 Cb 0.39 -3.13 -0.06 0.00 -0.61 0.00 0.00 39.78 36.38 1rbp n ASN 14 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 1rbp n PHE 15 N -4.39 2.02 -3.33 3.10 -0.00 -1.20 -4.94 117.46 108.73 1rbp n PHE 15 Ca -0.30 0.39 -0.43 0.00 -0.00 0.00 0.00 57.45 57.12 1rbp n PHE 15 Cb 0.68 -2.49 -0.09 0.00 -0.00 0.00 0.00 39.48 37.58 1rbp n PHE 15 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.76 177.10 1rbp s ASP 16 N 2.58 6.20 0.23 -2.13 3.68 -1.26 -4.84 116.67 121.13 1rbp s ASP 16 Ca 0.91 -0.56 -0.07 0.00 2.13 0.00 0.00 52.55 54.96 1rbp s ASP 16 Cb -0.90 -2.22 0.20 0.00 -1.45 0.00 0.00 42.92 38.56 1rbp s ASP 16 CO 0.54 -0.54 1.84 0.11 0.13 0.00 0.00 175.17 177.25 1rbp h LYS 17 N 8.67 1.25 -0.23 4.34 1.57 -1.94 -2.71 116.57 127.51 1rbp h LYS 17 Ca -0.27 -0.16 -0.11 0.00 -1.87 0.00 0.00 60.65 58.24 1rbp h LYS 17 Cb 1.12 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 33.18 1rbp h LYS 17 CO 0.78 0.93 -0.33 0.00 -0.57 0.00 0.00 179.45 180.26 1rbp h ALA 18 N 1.25 1.00 0.00 3.86 0.00 -1.97 -3.13 119.26 120.27 1rbp h ALA 18 Ca 0.31 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1rbp h ALA 18 Cb 0.07 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1rbp h ALA 18 CO -0.04 0.60 0.00 0.00 0.00 0.00 0.00 179.25 179.80 1rbp h ARG 19 N 0.42 0.00 -0.01 0.00 3.08 -1.91 -2.44 114.38 113.52 1rbp h ARG 19 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.10 1rbp h ARG 19 Cb 0.78 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.83 1rbp h ARG 19 CO 0.06 0.00 -0.19 0.34 -1.07 0.00 0.00 179.97 179.11 1rbp n PHE 20 N -2.48 0.00 -1.89 3.04 -0.00 -1.17 -4.81 117.46 110.16 1rbp n PHE 20 Ca 0.04 0.00 -0.39 0.00 -0.00 0.00 0.00 57.45 57.10 1rbp n PHE 20 Cb 0.38 -0.10 0.02 0.00 -0.00 0.00 0.00 39.48 39.78 1rbp n PHE 20 CO 0.00 0.00 0.00 -1.12 -0.00 0.00 0.00 176.76 175.64 1rbp s SER 21 N -2.40 5.75 0.00 -2.13 0.01 -0.92 -4.69 113.70 109.31 1rbp s SER 21 Ca 0.27 2.75 0.00 0.00 1.31 0.00 0.00 55.95 60.28 1rbp s SER 21 Cb 0.20 -2.64 0.00 0.00 0.21 0.00 0.00 66.02 63.79 1rbp s SER 21 CO 0.48 -1.24 0.00 0.61 0.41 0.00 0.00 173.24 173.50 1rbp n GLY 22 N 0.64 0.14 3.67 3.44 0.00 0.96 -4.90 105.19 109.13 1rbp n GLY 22 Ca 0.07 -2.27 -0.42 0.00 0.00 0.00 0.00 46.02 43.41 1rbp n GLY 22 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rbp s THR 23 N 0.00 4.85 -0.06 2.61 2.01 -1.26 -0.61 115.64 123.17 1rbp s THR 23 Ca 0.00 1.68 0.05 0.00 0.31 0.00 0.00 61.69 63.74 1rbp s THR 23 Cb 0.00 -4.16 -0.01 0.00 0.01 0.00 0.00 72.50 68.34 1rbp s THR 23 CO 0.00 -0.00 -0.24 0.26 -0.69 0.00 0.00 174.62 173.95 1rbp s TRP 24 N 2.29 2.38 -0.26 4.92 0.52 -0.43 -4.66 118.94 123.71 1rbp s TRP 24 Ca 0.39 -0.76 -0.08 0.00 0.02 0.00 0.00 56.10 55.66 1rbp s TRP 24 Cb -0.16 -1.57 -0.04 0.00 -1.15 0.00 0.00 33.47 30.55 1rbp s TRP 24 CO 0.12 -0.25 0.10 0.71 0.02 0.00 0.00 176.95 177.65 1rbp s TYR 25 N -0.04 3.13 -0.01 -1.98 2.02 -0.09 -1.28 117.35 119.10 1rbp s TYR 25 Ca -0.07 -0.25 -0.30 0.00 -0.37 0.00 0.00 57.07 56.08 1rbp s TYR 25 Cb -0.14 -2.28 -0.04 0.00 -0.40 0.00 0.00 41.96 39.10 1rbp s TYR 25 CO 0.05 -0.29 1.14 0.00 -1.57 0.00 0.00 175.55 174.88 1rbp s ALA 26 N 1.63 3.39 -0.25 3.71 0.00 -0.56 -0.86 121.76 128.81 1rbp s ALA 26 Ca 0.06 0.66 0.00 0.00 0.00 0.00 0.00 51.96 52.69 1rbp s ALA 26 Cb -0.15 -3.45 -0.17 0.00 0.00 0.00 0.00 23.12 19.34 1rbp s ALA 26 CO 0.06 -0.54 -0.20 -0.12 0.00 0.00 0.00 175.76 174.95 1rbp n MET 27 N 4.51 0.65 -3.98 0.00 1.56 0.31 -4.74 117.12 115.44 1rbp n MET 27 Ca 0.09 0.17 -0.09 0.00 -0.27 0.00 0.00 57.70 57.60 1rbp n MET 27 Cb 0.47 -1.53 -0.10 0.00 2.15 0.00 0.00 33.22 34.22 1rbp n MET 27 CO 0.00 0.00 0.00 0.00 -0.73 0.00 0.00 175.97 175.24 1rbp s ALA 28 N -2.52 0.13 -0.09 -5.12 0.00 -1.18 -1.30 121.76 111.68 1rbp s ALA 28 Ca -0.35 -0.75 -0.17 0.00 0.00 0.00 0.00 51.96 50.70 1rbp s ALA 28 Cb 0.09 0.24 0.04 0.00 0.00 0.00 0.00 23.12 23.50 1rbp s ALA 28 CO 0.60 -0.31 0.42 0.21 0.00 0.00 0.00 175.76 176.68 1rbp s LYS 29 N -2.79 0.64 -0.26 0.00 2.20 -0.74 -1.61 119.74 117.18 1rbp s LYS 29 Ca -0.03 0.26 -0.00 0.00 -0.36 0.00 0.00 55.97 55.84 1rbp s LYS 29 Cb -0.00 0.30 0.04 0.00 -1.51 0.00 0.00 37.83 36.66 1rbp s LYS 29 CO -0.06 -0.14 -0.07 0.21 -0.36 0.00 0.00 175.35 174.93 1rbp s LYS 30 N -0.53 2.56 0.32 4.03 2.36 -0.34 -1.46 119.74 126.67 1rbp s LYS 30 Ca -0.06 -1.15 -0.27 0.00 -2.55 0.00 0.00 55.97 51.94 1rbp s LYS 30 Cb -0.03 -2.97 -0.09 0.00 -1.05 0.00 0.00 37.83 33.68 1rbp s LYS 30 CO 0.03 -0.49 0.99 -0.51 1.55 0.00 0.00 175.35 176.92 1rbp s ASP 31 N 1.24 7.25 0.29 1.43 1.11 -1.26 -1.36 116.67 125.36 1rbp s ASP 31 Ca -0.04 1.97 0.00 0.00 0.18 0.00 0.00 52.55 54.66 1rbp s ASP 31 Cb -0.18 -2.59 0.00 0.00 1.07 0.00 0.00 42.92 41.22 1rbp s ASP 31 CO -0.04 -0.14 0.00 -0.81 1.18 0.00 0.00 175.17 175.36 1rbp n PRO 32 N 0.66 0.93 -3.07 8.23 -0.04 -1.18 -4.68 135.00 135.85 1rbp n PRO 32 Ca 0.02 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 63.15 1rbp n PRO 32 Cb 0.49 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.88 1rbp n PRO 32 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 1rbp s GLU 33 N -0.66 4.05 2.11 0.54 2.12 -1.26 -4.89 118.70 120.71 1rbp s GLU 33 Ca 0.00 0.76 0.00 0.00 0.36 0.00 0.00 54.97 56.09 1rbp s GLU 33 Cb 0.00 -2.38 0.00 0.00 0.26 0.00 0.00 34.13 32.01 1rbp s GLU 33 CO 0.00 0.12 0.00 0.41 -0.54 0.00 0.00 175.26 175.25 1rbp n GLY 34 N -0.42 -0.74 3.70 -1.50 0.00 -1.26 -4.87 105.19 100.10 1rbp n GLY 34 Ca 0.04 -1.12 -0.43 0.00 0.00 0.00 0.00 46.02 44.51 1rbp n GLY 34 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1rbp n LEU 35 N 0.00 3.80 -4.03 0.99 7.94 -1.26 -5.01 117.00 119.43 1rbp n LEU 35 Ca 0.00 1.03 -0.11 0.00 -1.11 0.00 0.00 56.01 55.83 1rbp n LEU 35 Cb 0.00 -1.52 -0.05 0.00 0.53 0.00 0.00 43.42 42.38 1rbp n LEU 35 CO 0.00 0.07 0.15 0.12 -1.11 0.00 0.00 177.39 176.62 1rbp s PHE 36 N 1.86 0.58 0.15 1.96 5.99 -1.26 -5.01 117.98 122.25 1rbp s PHE 36 Ca 0.79 -0.91 -0.30 0.00 0.00 0.00 0.00 56.93 56.51 1rbp s PHE 36 Cb -0.54 0.09 -0.08 0.00 0.00 0.00 0.00 43.02 42.49 1rbp s PHE 36 CO 0.36 -1.02 1.25 -0.51 -0.00 0.00 0.00 175.22 175.30 1rbp s LEU 37 N -3.08 4.41 -0.02 6.12 1.43 -1.26 -4.63 118.68 121.65 1rbp s LEU 37 Ca 0.25 2.24 -0.03 0.00 -1.03 0.00 0.00 54.13 55.57 1rbp s LEU 37 Cb -0.00 -3.60 -0.01 0.00 0.03 0.00 0.00 46.19 42.61 1rbp s LEU 37 CO 0.12 -0.47 0.24 1.56 0.23 0.00 0.00 176.35 178.03 1rbp h GLN 38 N 5.82 -0.09 0.00 1.70 7.50 -0.83 -3.49 115.11 125.71 1rbp h GLN 38 Ca -0.44 0.01 -0.08 0.00 0.50 0.00 0.00 58.65 58.64 1rbp h GLN 38 Cb 1.21 0.02 -0.01 0.00 0.05 0.00 0.00 27.48 28.75 1rbp h GLN 38 CO 0.78 -0.06 0.03 -0.40 -1.50 0.00 0.00 178.83 177.68 1rbp n ASP 39 N -3.03 -0.90 -2.70 1.46 3.85 -1.22 -4.78 116.55 109.24 1rbp n ASP 39 Ca -0.01 -1.87 -0.20 0.00 -0.71 0.00 0.00 54.79 52.00 1rbp n ASP 39 Cb 0.04 1.57 0.03 0.00 -1.35 0.00 0.00 41.12 41.41 1rbp n ASP 39 CO 0.00 0.00 0.00 0.59 -1.01 0.00 0.00 177.20 176.78 1rbp n ASN 40 N -1.58 -5.64 -4.63 -1.12 3.02 0.11 -0.84 115.26 104.59 1rbp n ASN 40 Ca -0.02 -0.26 -0.40 0.00 -0.03 0.00 0.00 54.58 53.88 1rbp n ASN 40 Cb 0.29 -4.47 -0.07 0.00 -0.61 0.00 0.00 39.78 34.92 1rbp n ASN 40 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1rbp s ILE 41 N -3.11 5.07 -0.05 2.41 1.01 -1.26 -4.02 121.20 121.26 1rbp s ILE 41 Ca 0.27 0.91 -0.02 0.00 0.00 0.00 0.00 60.65 61.81 1rbp s ILE 41 Cb -0.12 -3.84 0.03 0.00 0.01 0.00 0.00 42.46 38.54 1rbp s ILE 41 CO 0.33 0.10 0.05 -0.69 0.00 0.00 0.00 174.94 174.74 1rbp s VAL 42 N 2.16 -0.02 0.12 2.92 1.01 -0.96 -1.50 120.40 124.13 1rbp s VAL 42 Ca 0.22 0.35 0.04 0.00 0.00 0.00 0.00 61.98 62.59 1rbp s VAL 42 Cb -0.16 -0.24 -0.04 0.00 0.00 0.00 0.00 36.38 35.95 1rbp s VAL 42 CO 0.09 0.18 0.12 0.00 0.00 0.00 0.00 175.10 175.48 1rbp s ALA 43 N 2.13 3.60 -0.27 5.51 0.00 -0.40 -1.34 121.76 130.98 1rbp s ALA 43 Ca 0.05 -1.10 -0.00 0.00 0.00 0.00 0.00 51.96 50.91 1rbp s ALA 43 Cb -0.12 -1.43 0.08 0.00 0.00 0.00 0.00 23.12 21.65 1rbp s ALA 43 CO -0.04 0.63 0.04 -2.00 0.00 0.00 0.00 175.76 174.40 1rbp s GLU 44 N -2.75 1.04 0.17 0.00 2.56 0.05 -1.31 118.70 118.45 1rbp s GLU 44 Ca 0.30 -1.04 -0.18 0.00 0.00 0.00 0.00 54.97 54.05 1rbp s GLU 44 Cb -0.11 -2.32 -0.08 0.00 2.00 0.00 0.00 34.13 33.62 1rbp s GLU 44 CO 0.23 -0.82 0.64 -0.06 -0.56 0.00 0.00 175.26 174.69 1rbp s PHE 45 N 1.51 3.68 -0.09 5.30 0.08 0.22 -1.41 117.98 127.27 1rbp s PHE 45 Ca 0.04 1.28 -0.13 0.00 0.12 0.00 0.00 56.93 58.24 1rbp s PHE 45 Cb -0.18 -2.52 0.03 0.00 -0.57 0.00 0.00 43.02 39.78 1rbp s PHE 45 CO -0.15 0.42 0.32 0.45 -0.10 0.00 0.00 175.22 176.16 1rbp s SER 46 N -1.55 -0.29 -0.11 1.36 0.15 -0.78 -0.03 113.70 112.46 1rbp s SER 46 Ca 0.38 0.47 -0.00 0.00 0.70 0.00 0.00 55.95 57.50 1rbp s SER 46 Cb -0.17 0.55 0.02 0.00 -1.71 0.00 0.00 66.02 64.72 1rbp s SER 46 CO 0.20 -0.23 -0.08 0.54 1.20 0.00 0.00 173.24 174.88 1rbp s VAL 47 N -0.34 1.01 0.21 4.45 0.11 -1.26 -0.69 120.40 123.90 1rbp s VAL 47 Ca -0.05 -0.29 -0.04 0.00 -2.93 0.00 0.00 61.98 58.68 1rbp s VAL 47 Cb -0.03 -1.03 0.05 0.00 -1.53 0.00 0.00 36.38 33.84 1rbp s VAL 47 CO 0.02 0.36 0.27 -0.90 -3.33 0.00 0.00 175.10 171.52 1rbp n ASP 48 N 4.85 -0.19 0.25 3.54 3.85 -0.24 -4.91 116.55 123.69 1rbp n ASP 48 Ca -0.13 -1.02 0.08 0.00 -0.71 0.00 0.00 54.79 53.01 1rbp n ASP 48 Cb 0.50 -0.21 0.62 0.00 -1.35 0.00 0.00 41.12 40.68 1rbp n ASP 48 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 177.20 176.11 1rbp h GLU 49 N 0.00 0.00 -0.27 0.11 4.22 -2.02 -2.76 114.58 113.86 1rbp h GLU 49 Ca -0.09 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.35 1rbp h GLU 49 Cb 0.25 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.50 1rbp h GLU 49 CO 0.06 0.12 0.00 0.25 -2.18 0.00 0.00 179.01 177.26 1rbp n THR 50 N -4.16 0.36 -0.60 0.32 -2.24 -1.26 -4.92 114.28 101.78 1rbp n THR 50 Ca -0.02 -0.40 0.00 0.00 -2.27 0.00 0.00 64.05 61.36 1rbp n THR 50 Cb 0.20 0.24 0.00 0.00 -2.10 0.00 0.00 70.33 68.67 1rbp n THR 50 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1rbp n GLY 51 N 1.04 0.73 3.67 3.38 0.00 -1.04 -5.03 105.19 107.93 1rbp n GLY 51 Ca 0.12 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.72 1rbp n GLY 51 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1rbp s GLN 52 N -0.40 4.34 -0.07 1.61 2.00 -1.26 -4.86 119.66 121.01 1rbp s GLN 52 Ca 0.00 1.32 -0.11 0.00 -2.00 0.00 0.00 55.36 54.57 1rbp s GLN 52 Cb 0.00 -3.59 -0.05 0.00 0.80 0.00 0.00 33.01 30.17 1rbp s GLN 52 CO 0.00 -0.45 0.26 1.41 -0.50 0.00 0.00 175.29 176.02 1rbp s MET 53 N 2.52 3.70 0.38 1.67 -2.45 -1.26 -1.07 119.30 122.79 1rbp s MET 53 Ca 0.45 0.11 0.03 0.00 -1.25 0.00 0.00 55.69 55.03 1rbp s MET 53 Cb -0.17 -3.22 -0.01 0.00 1.25 0.00 0.00 34.83 32.68 1rbp s MET 53 CO 0.12 0.70 0.10 -1.13 1.05 0.00 0.00 175.02 175.86 1rbp n SER 54 N 2.03 1.68 -3.49 1.11 3.41 0.14 -1.36 113.62 117.13 1rbp n SER 54 Ca -0.17 -2.92 -0.12 0.00 -0.26 0.00 0.00 58.87 55.40 1rbp n SER 54 Cb 0.54 0.77 -0.04 0.00 -0.26 0.00 0.00 64.21 65.22 1rbp n SER 54 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1rbp s ALA 55 N -2.92 -1.76 0.02 7.33 0.00 0.17 -1.86 121.76 122.73 1rbp s ALA 55 Ca 0.14 1.03 0.08 0.00 0.00 0.00 0.00 51.96 53.20 1rbp s ALA 55 Cb 0.01 0.27 -0.02 0.00 0.00 0.00 0.00 23.12 23.38 1rbp s ALA 55 CO 0.10 -0.57 -0.23 0.95 0.00 0.00 0.00 175.76 176.01 1rbp s THR 56 N -2.48 1.81 0.02 0.00 -4.23 -0.50 -1.28 115.64 108.99 1rbp s THR 56 Ca -0.02 -1.13 0.07 0.00 -1.18 0.00 0.00 61.69 59.44 1rbp s THR 56 Cb -0.01 -1.54 -0.02 0.00 1.34 0.00 0.00 72.50 72.28 1rbp s THR 56 CO -0.03 0.37 -0.21 0.00 -0.54 0.00 0.00 174.62 174.20 1rbp s ALA 57 N -0.68 1.79 0.00 3.99 0.00 0.48 -0.77 121.76 126.57 1rbp s ALA 57 Ca 0.09 -1.01 0.07 0.00 0.00 0.00 0.00 51.96 51.11 1rbp s ALA 57 Cb -0.09 -0.40 -0.03 0.00 0.00 0.00 0.00 23.12 22.61 1rbp s ALA 57 CO 0.01 0.42 -0.21 0.21 0.00 0.00 0.00 175.76 176.19 1rbp s LYS 58 N -0.87 2.14 -0.16 0.00 2.20 -0.45 -0.50 119.74 122.10 1rbp s LYS 58 Ca 0.08 -0.92 -0.35 0.00 -0.36 0.00 0.00 55.97 54.42 1rbp s LYS 58 Cb -0.09 -2.15 0.14 0.00 -1.51 0.00 0.00 37.83 34.23 1rbp s LYS 58 CO 0.01 0.56 1.31 0.20 -0.36 0.00 0.00 175.35 177.07 1rbp s GLY 59 N -0.98 -0.33 -0.15 5.54 0.00 -0.88 -2.26 107.32 108.27 1rbp s GLY 59 Ca 0.12 1.36 -0.14 0.00 0.00 0.00 0.00 44.72 46.06 1rbp s GLY 59 CO 0.02 0.40 0.31 -1.60 0.00 0.00 0.00 173.10 172.22 1rbp s ARG 60 N -2.25 4.21 0.01 2.90 3.52 -0.02 0.04 118.95 127.36 1rbp s ARG 60 Ca 0.12 0.13 0.08 0.00 -0.13 0.00 0.00 55.73 55.93 1rbp s ARG 60 Cb 0.02 -3.40 -0.02 0.00 -1.56 0.00 0.00 34.95 29.98 1rbp s ARG 60 CO -0.04 0.28 -0.23 0.08 -0.81 0.00 0.00 175.30 174.58 1rbp s VAL 61 N 0.32 1.83 -0.45 7.11 1.01 -0.28 -0.04 120.40 129.90 1rbp s VAL 61 Ca 0.18 -1.13 -0.13 0.00 0.00 0.00 0.00 61.98 60.89 1rbp s VAL 61 Cb -0.13 -1.55 0.07 0.00 0.00 0.00 0.00 36.38 34.76 1rbp s VAL 61 CO 0.05 0.39 0.34 -0.60 0.00 0.00 0.00 175.10 175.28 1rbp s ARG 62 N -0.88 2.87 0.63 2.72 3.52 -1.26 -3.32 118.95 123.22 1rbp s ARG 62 Ca 0.09 -1.35 -0.16 0.00 -0.13 0.00 0.00 55.73 54.18 1rbp s ARG 62 Cb -0.09 -4.01 -0.02 0.00 -1.56 0.00 0.00 34.95 29.27 1rbp s ARG 62 CO 0.01 -0.98 1.10 -0.51 -0.81 0.00 0.00 175.30 174.10 1rbp s LEU 63 N 1.58 3.47 0.32 -0.88 2.01 -1.14 -4.88 118.68 119.15 1rbp s LEU 63 Ca 0.04 1.97 0.08 0.00 0.01 0.00 0.00 54.13 56.23 1rbp s LEU 63 Cb -0.23 -4.55 0.83 0.00 0.01 0.00 0.00 46.19 42.25 1rbp s LEU 63 CO 0.06 -1.44 1.76 -0.07 1.01 0.00 0.00 176.35 177.66 1rbp h LEU 64 N 0.30 0.71 -1.10 1.79 -0.00 -1.97 0.24 115.31 115.27 1rbp h LEU 64 Ca -0.47 0.11 0.00 0.00 -0.00 0.00 0.00 57.88 57.52 1rbp h LEU 64 Cb 1.24 -0.01 0.00 0.00 -0.00 0.00 0.00 40.66 41.89 1rbp h LEU 64 CO 0.55 0.19 0.00 -0.46 -0.00 0.00 0.00 178.44 178.72 1rbp n ASN 65 N -4.80 0.48 -0.76 -0.43 0.23 -1.26 -4.83 115.26 103.89 1rbp n ASN 65 Ca 0.25 0.71 0.00 0.00 -0.53 0.00 0.00 54.58 55.01 1rbp n ASN 65 Cb 0.67 -0.78 0.00 0.00 -2.08 0.00 0.00 39.78 37.59 1rbp n ASN 65 CO 0.00 0.00 0.00 0.59 -0.93 0.00 0.00 177.26 176.92 1rbp n ASN 66 N -2.13 -1.98 -4.86 0.53 4.13 0.83 -5.08 115.26 106.70 1rbp n ASN 66 Ca -0.01 0.00 -0.31 0.00 1.68 0.00 0.00 54.58 55.94 1rbp n ASN 66 Cb 0.06 -0.50 0.02 0.00 -1.54 0.00 0.00 39.78 37.83 1rbp n ASN 66 CO 0.00 0.00 0.00 0.26 0.28 0.00 0.00 177.26 177.80 1rbp s TRP 67 N -2.98 3.48 -0.46 3.10 0.23 -1.11 -4.88 118.94 116.30 1rbp s TRP 67 Ca 0.00 1.31 0.07 0.00 -2.03 0.00 0.00 56.10 55.46 1rbp s TRP 67 Cb 0.00 -2.78 0.25 0.00 0.03 0.00 0.00 33.47 30.97 1rbp s TRP 67 CO 0.00 -0.86 0.59 -0.25 0.96 0.00 0.00 176.95 177.39 1rbp n ASP 68 N -2.86 1.27 -4.76 2.95 9.92 -1.26 -2.89 116.55 118.92 1rbp n ASP 68 Ca 0.06 -2.93 -0.40 0.00 -0.53 0.00 0.00 54.79 51.00 1rbp n ASP 68 Cb 0.54 -0.65 -0.06 0.00 -0.64 0.00 0.00 41.12 40.31 1rbp n ASP 68 CO 0.00 0.00 0.00 0.68 0.13 0.00 0.00 177.20 178.01 1rbp s VAL 69 N -1.60 4.00 -0.50 2.53 -7.23 -1.21 -4.90 120.40 111.48 1rbp s VAL 69 Ca 0.37 1.96 -0.20 0.00 -1.81 0.00 0.00 61.98 62.30 1rbp s VAL 69 Cb 0.17 -4.23 0.05 0.00 0.56 0.00 0.00 36.38 32.93 1rbp s VAL 69 CO -0.08 0.43 0.66 0.00 -0.31 0.00 0.00 175.10 175.80 1rbp s ALA 71 N 2.80 3.30 -0.40 0.00 0.00 0.11 -4.89 121.76 122.69 1rbp s ALA 71 Ca 0.18 0.70 -0.05 0.00 0.00 0.00 0.00 51.96 52.78 1rbp s ALA 71 Cb -0.18 -3.33 0.09 0.00 0.00 0.00 0.00 23.12 19.70 1rbp s ALA 71 CO 0.13 -0.15 0.20 -0.51 0.00 0.00 0.00 175.76 175.43 1rbp s ASP 72 N 0.12 5.34 -0.04 0.00 1.01 -1.26 -2.07 116.67 119.77 1rbp s ASP 72 Ca 0.49 -1.76 -0.04 0.00 0.71 0.00 0.00 52.55 51.96 1rbp s ASP 72 Cb -0.26 -1.87 -0.04 0.00 1.01 0.00 0.00 42.92 41.76 1rbp s ASP 72 CO 0.32 -0.51 0.16 -0.04 0.21 0.00 0.00 175.17 175.31 1rbp s MET 73 N 1.25 3.41 -0.07 8.23 -1.94 0.35 -0.77 119.30 129.76 1rbp s MET 73 Ca 0.04 -0.28 0.04 0.00 -1.71 0.00 0.00 55.69 53.79 1rbp s MET 73 Cb -0.23 -3.11 -0.00 0.00 2.01 0.00 0.00 34.83 33.51 1rbp s MET 73 CO -0.02 0.70 -0.20 0.08 -0.01 0.00 0.00 175.02 175.57 1rbp s VAL 74 N -1.23 1.73 -0.05 -6.03 1.01 -0.22 -0.39 120.40 115.22 1rbp s VAL 74 Ca 0.23 -0.85 0.03 0.00 0.00 0.00 0.00 61.98 61.39 1rbp s VAL 74 Cb -0.12 -1.49 0.00 0.00 0.00 0.00 0.00 36.38 34.77 1rbp s VAL 74 CO 0.14 0.49 -0.15 -0.83 0.00 0.00 0.00 175.10 174.75 1rbp s GLY 75 N 0.21 0.85 -0.05 4.51 0.00 -0.40 -1.51 107.32 110.93 1rbp s GLY 75 Ca -0.11 -0.55 0.02 0.00 0.00 0.00 0.00 44.72 44.08 1rbp s GLY 75 CO 0.05 -0.13 -0.07 -0.51 0.00 0.00 0.00 173.10 172.44 1rbp s THR 76 N 0.33 3.65 -0.14 0.90 -4.23 -0.71 -0.66 115.64 114.78 1rbp s THR 76 Ca -0.09 -0.56 0.01 0.00 -1.18 0.00 0.00 61.69 59.86 1rbp s THR 76 Cb -0.13 -2.51 -0.01 0.00 1.34 0.00 0.00 72.50 71.19 1rbp s THR 76 CO 0.03 0.55 -0.15 -0.36 -0.54 0.00 0.00 174.62 174.15 1rbp s PHE 77 N -0.85 2.76 -0.22 3.99 0.40 -0.47 -1.53 117.98 122.07 1rbp s PHE 77 Ca 0.13 -0.87 -0.15 0.00 -0.60 0.00 0.00 56.93 55.45 1rbp s PHE 77 Cb -0.11 -1.85 -0.04 0.00 0.51 0.00 0.00 43.02 41.53 1rbp s PHE 77 CO 0.03 -0.35 0.37 0.99 0.70 0.00 0.00 175.22 176.96 1rbp s THR 78 N 0.55 5.21 0.40 0.64 2.01 -0.19 -4.21 115.64 120.06 1rbp s THR 78 Ca -0.10 0.64 -0.25 0.00 0.31 0.00 0.00 61.69 62.29 1rbp s THR 78 Cb -0.16 -3.70 -0.09 0.00 0.01 0.00 0.00 72.50 68.56 1rbp s THR 78 CO 0.04 0.24 1.11 -1.81 -0.69 0.00 0.00 174.62 173.51 1rbp s ASP 79 N 1.16 6.64 0.28 3.53 1.01 -1.26 -1.76 116.67 126.27 1rbp s ASP 79 Ca 0.17 2.20 0.01 0.00 0.71 0.00 0.00 52.55 55.64 1rbp s ASP 79 Cb -0.15 -2.60 0.01 0.00 1.01 0.00 0.00 42.92 41.19 1rbp s ASP 79 CO 0.08 -0.58 0.09 0.35 0.21 0.00 0.00 175.17 175.32 1rbp n THR 80 N 0.03 0.00 1.40 -1.27 -2.24 -1.23 -4.93 114.28 106.04 1rbp n THR 80 Ca 0.05 -1.23 0.13 0.00 -2.27 0.00 0.00 64.05 60.72 1rbp n THR 80 Cb 0.48 0.04 0.70 0.00 -2.10 0.00 0.00 70.33 69.45 1rbp n THR 80 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 1rbp n GLU 81 N -0.90 0.58 -3.90 -0.78 0.00 -1.26 -4.44 120.64 109.95 1rbp n GLU 81 Ca -0.07 0.03 -0.36 0.00 0.00 0.00 0.00 57.16 56.76 1rbp n GLU 81 Cb 0.34 -1.50 -0.12 0.00 0.00 0.00 0.00 31.44 30.16 1rbp n GLU 81 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.13 177.47 1rbp s ASP 82 N -2.29 5.11 0.54 -1.84 2.15 -1.26 -5.02 116.67 114.06 1rbp s ASP 82 Ca 0.31 -0.16 0.24 0.00 0.43 0.00 0.00 52.55 53.37 1rbp s ASP 82 Cb 0.17 -1.90 1.51 0.00 -0.30 0.00 0.00 42.92 42.41 1rbp s ASP 82 CO 0.34 0.03 2.16 1.55 -0.17 0.00 0.00 175.17 179.08 1rbp h PRO 83 N 7.77 0.00 -0.02 4.34 0.13 -1.90 -2.82 132.00 139.50 1rbp h PRO 83 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 1rbp h PRO 83 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1rbp h PRO 83 CO 0.60 0.05 -0.04 0.00 -0.23 0.00 0.00 178.00 178.38 1rbp n ALA 84 N -2.39 2.63 -3.60 -0.56 0.00 -1.26 -4.69 120.51 110.63 1rbp n ALA 84 Ca -0.03 -0.51 -0.35 0.00 0.00 0.00 0.00 53.44 52.56 1rbp n ALA 84 Cb 0.13 -1.06 -0.14 0.00 0.00 0.00 0.00 19.45 18.38 1rbp n ALA 84 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1rbp s LYS 85 N -2.07 3.31 0.34 0.00 1.02 -1.07 -1.09 119.74 120.19 1rbp s LYS 85 Ca 0.34 -0.66 0.10 0.00 0.02 0.00 0.00 55.97 55.76 1rbp s LYS 85 Cb 0.20 -2.92 -0.06 0.00 -0.52 0.00 0.00 37.83 34.53 1rbp s LYS 85 CO 0.35 -0.19 -0.10 -0.06 -0.92 0.00 0.00 175.35 174.43 1rbp s PHE 86 N 1.42 2.40 -0.13 3.18 0.08 -0.28 -3.47 117.98 121.18 1rbp s PHE 86 Ca 0.05 -0.47 -0.03 0.00 0.12 0.00 0.00 56.93 56.60 1rbp s PHE 86 Cb -0.14 -1.34 -0.03 0.00 -0.57 0.00 0.00 43.02 40.94 1rbp s PHE 86 CO -0.05 0.60 -0.02 0.15 -0.10 0.00 0.00 175.22 175.80 1rbp s LYS 87 N -3.60 3.45 -0.20 0.44 3.01 -0.72 -0.75 119.74 121.36 1rbp s LYS 87 Ca 0.32 -0.48 0.01 0.00 -1.01 0.00 0.00 55.97 54.82 1rbp s LYS 87 Cb 0.01 -2.88 0.04 0.00 -1.01 0.00 0.00 37.83 33.99 1rbp s LYS 87 CO 0.16 0.40 -0.15 1.41 0.51 0.00 0.00 175.35 177.68 1rbp s MET 88 N -0.05 2.52 -0.08 1.68 1.75 0.12 -1.02 119.30 124.22 1rbp s MET 88 Ca 0.02 -0.94 -0.19 0.00 -1.25 0.00 0.00 55.69 53.33 1rbp s MET 88 Cb -0.13 -2.58 -0.04 0.00 2.84 0.00 0.00 34.83 34.92 1rbp s MET 88 CO 0.02 -0.35 0.51 0.21 -0.65 0.00 0.00 175.02 174.76 1rbp s LYS 89 N 1.28 4.31 0.04 4.11 2.20 -0.58 -1.49 119.74 129.61 1rbp s LYS 89 Ca 0.00 0.54 -0.00 0.00 -0.36 0.00 0.00 55.97 56.15 1rbp s LYS 89 Cb -0.15 -3.40 -0.03 0.00 -1.51 0.00 0.00 37.83 32.73 1rbp s LYS 89 CO -0.10 0.23 -0.03 1.52 -0.36 0.00 0.00 175.35 176.61 1rbp s TYR 90 N 0.35 0.44 0.15 4.03 1.13 -0.07 -1.73 117.35 121.65 1rbp s TYR 90 Ca 0.28 -0.79 -0.22 0.00 -1.41 0.00 0.00 57.07 54.93 1rbp s TYR 90 Cb -0.16 -0.31 0.07 0.00 -1.10 0.00 0.00 41.96 40.45 1rbp s TYR 90 CO 0.13 -0.27 0.57 1.67 -2.51 0.00 0.00 175.55 175.14 1rbp s TRP 91 N -2.68 -0.49 0.29 -3.49 -2.14 -0.57 -1.34 118.94 108.52 1rbp s TRP 91 Ca -0.04 0.28 0.00 0.00 2.66 0.00 0.00 56.10 59.00 1rbp s TRP 91 Cb -0.01 0.52 -0.04 0.00 -3.10 0.00 0.00 33.47 30.84 1rbp s TRP 91 CO -0.05 -0.83 0.48 0.20 -2.66 0.00 0.00 176.95 174.09 1rbp s GLY 92 N -2.74 1.49 0.35 3.67 0.00 -1.25 -1.05 107.32 107.78 1rbp s GLY 92 Ca 0.01 -0.90 0.17 0.00 0.00 0.00 0.00 44.72 43.99 1rbp s GLY 92 CO -0.13 -0.85 1.71 -0.39 0.00 0.00 0.00 173.10 173.44 1rbp h VAL 93 N 1.08 1.02 -3.49 1.40 -1.51 -1.33 -3.42 116.25 110.00 1rbp h VAL 93 Ca -0.49 -1.64 -0.53 0.00 -1.23 0.00 0.00 66.70 62.80 1rbp h VAL 93 Cb 1.21 1.96 -0.03 0.00 -2.13 0.00 0.00 31.29 32.30 1rbp h VAL 93 CO 0.63 0.42 0.05 0.00 -1.23 0.00 0.00 177.57 177.45 1rbp s ALA 94 N -3.63 3.46 0.23 5.19 0.00 -1.26 -5.00 121.76 120.75 1rbp s ALA 94 Ca -0.00 0.08 -0.07 0.00 0.00 0.00 0.00 51.96 51.97 1rbp s ALA 94 Cb 0.11 -2.74 0.22 0.00 0.00 0.00 0.00 23.12 20.71 1rbp s ALA 94 CO 0.70 0.36 1.87 0.77 0.00 0.00 0.00 175.76 179.46 1rbp h SER 95 N 3.49 1.13 0.43 0.00 0.02 -2.01 -2.79 113.55 113.82 1rbp h SER 95 Ca -0.48 -0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.38 1rbp h SER 95 Cb 1.19 -0.29 0.00 0.00 0.14 0.00 0.00 62.40 63.45 1rbp h SER 95 CO 0.65 0.89 0.00 2.19 -1.14 0.00 0.00 176.83 179.43 1rbp h PHE 96 N 1.28 0.00 -3.75 3.45 -5.15 -1.94 -3.45 116.94 107.38 1rbp h PHE 96 Ca 0.32 0.00 -0.49 0.00 -0.20 0.00 0.00 57.97 57.60 1rbp h PHE 96 Cb 0.00 0.00 -0.03 0.00 0.22 0.00 0.00 35.95 36.14 1rbp h PHE 96 CO 0.01 0.00 0.18 -0.51 -2.00 0.00 0.00 178.31 175.99 1rbp s LEU 97 N -4.66 4.19 0.21 2.10 1.43 -1.06 -4.96 118.68 115.94 1rbp s LEU 97 Ca 0.01 1.49 -0.32 0.00 -1.03 0.00 0.00 54.13 54.28 1rbp s LEU 97 Cb 0.08 -3.96 -0.12 0.00 0.03 0.00 0.00 46.19 42.23 1rbp s LEU 97 CO 0.32 -0.12 1.71 -1.58 0.23 0.00 0.00 176.35 176.91 1rbp s GLN 98 N -2.48 4.13 0.01 1.70 0.74 -1.26 -4.21 119.66 118.29 1rbp s GLN 98 Ca 0.51 2.59 0.03 0.00 0.05 0.00 0.00 55.36 58.54 1rbp s GLN 98 Cb -0.14 -3.08 -0.04 0.00 1.10 0.00 0.00 33.01 30.86 1rbp s GLN 98 CO 0.19 -0.74 -0.04 0.15 -0.55 0.00 0.00 175.29 174.30 1rbp s LYS 99 N 1.09 2.62 0.01 1.67 1.02 -1.26 -3.93 119.74 120.96 1rbp s LYS 99 Ca 0.74 -0.70 -0.09 0.00 0.02 0.00 0.00 55.97 55.93 1rbp s LYS 99 Cb -0.49 -2.56 0.03 0.00 -0.52 0.00 0.00 37.83 34.29 1rbp s LYS 99 CO 0.33 0.60 0.42 0.41 -0.92 0.00 0.00 175.35 176.19 1rbp n GLY 100 N 1.38 0.66 2.69 -3.33 0.00 -0.45 -4.98 105.19 101.16 1rbp n GLY 100 Ca -0.15 -0.94 -0.21 0.00 0.00 0.00 0.00 46.02 44.73 1rbp n GLY 100 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1rbp s ASN 101 N -1.96 1.42 0.15 1.61 2.47 -1.26 -0.89 114.94 116.49 1rbp s ASN 101 Ca 0.10 -0.09 0.07 0.00 0.42 0.00 0.00 52.86 53.36 1rbp s ASN 101 Cb -0.00 -0.05 -0.04 0.00 -1.45 0.00 0.00 41.25 39.71 1rbp s ASN 101 CO 0.00 -0.28 -0.16 -1.81 -3.72 0.00 0.00 177.10 171.13 1rbp s ASP 102 N 2.20 2.34 0.49 -4.21 1.01 -0.55 -4.94 116.67 113.01 1rbp s ASP 102 Ca 0.04 -0.87 -0.21 0.00 0.71 0.00 0.00 52.55 52.22 1rbp s ASP 102 Cb -0.13 -0.11 -0.07 0.00 1.01 0.00 0.00 42.92 43.61 1rbp s ASP 102 CO -0.06 -0.11 1.12 -1.81 0.21 0.00 0.00 175.17 174.52 1rbp s ASP 103 N -2.69 6.06 -0.26 0.27 -0.00 -1.26 0.12 116.67 118.91 1rbp s ASP 103 Ca 0.14 2.16 -0.02 0.00 -0.00 0.00 0.00 52.55 54.83 1rbp s ASP 103 Cb -0.04 -2.58 0.08 0.00 -0.00 0.00 0.00 42.92 40.38 1rbp s ASP 103 CO 0.05 -0.98 0.08 -2.28 -0.00 0.00 0.00 175.17 172.03 1rbp s HIS 104 N -1.72 1.18 -0.17 4.23 2.46 0.07 -4.49 115.29 116.86 1rbp s HIS 104 Ca 0.68 -1.23 -0.05 0.00 0.47 0.00 0.00 55.06 54.92 1rbp s HIS 104 Cb -0.24 -1.29 -0.03 0.00 -0.13 0.00 0.00 32.58 30.88 1rbp s HIS 104 CO 0.28 -0.76 0.01 -1.58 -2.47 0.00 0.00 174.74 170.22 1rbp s TRP 105 N 1.80 3.12 -0.74 3.88 0.51 -0.70 -1.12 118.94 125.70 1rbp s TRP 105 Ca 0.05 -0.14 -0.21 0.00 -2.12 0.00 0.00 56.10 53.69 1rbp s TRP 105 Cb -0.17 -2.02 0.10 0.00 -0.81 0.00 0.00 33.47 30.57 1rbp s TRP 105 CO -0.21 0.04 0.97 0.42 -0.51 0.00 0.00 176.95 177.66 1rbp s ILE 106 N 0.39 4.56 0.12 2.03 -1.09 -0.25 -1.74 121.20 125.22 1rbp s ILE 106 Ca -0.01 -0.90 -0.13 0.00 -2.23 0.00 0.00 60.65 57.38 1rbp s ILE 106 Cb -0.13 -4.68 -0.06 0.00 -1.58 0.00 0.00 42.46 36.01 1rbp s ILE 106 CO 0.02 -1.41 1.46 0.58 -1.23 0.00 0.00 174.94 174.35 1rbp h VAL 107 N 5.90 1.29 -2.02 2.92 2.07 -1.08 -1.42 116.25 123.91 1rbp h VAL 107 Ca -0.14 -1.46 0.03 0.00 0.82 0.00 0.00 66.70 65.95 1rbp h VAL 107 Cb 1.06 1.45 -0.19 0.00 -1.52 0.00 0.00 31.29 32.09 1rbp h VAL 107 CO 1.14 0.48 0.38 -0.62 0.02 0.00 0.00 177.57 178.97 1rbp s ASP 108 N -6.64 -0.49 0.03 0.57 3.68 -1.20 -2.13 116.67 110.49 1rbp s ASP 108 Ca -0.12 0.38 -0.27 0.00 2.13 0.00 0.00 52.55 54.67 1rbp s ASP 108 Cb 0.10 0.43 0.09 0.00 -1.45 0.00 0.00 42.92 42.09 1rbp s ASP 108 CO 0.85 -0.56 0.75 0.28 0.13 0.00 0.00 175.17 176.61 1rbp s THR 109 N -1.85 0.00 -0.16 1.71 -1.32 -1.26 0.15 115.64 112.91 1rbp s THR 109 Ca -0.03 0.00 0.17 0.00 -1.21 0.00 0.00 61.69 60.62 1rbp s THR 109 Cb -0.00 -1.00 0.34 0.00 -1.51 0.00 0.00 72.50 70.33 1rbp s THR 109 CO 0.01 0.00 1.23 -0.90 -2.21 0.00 0.00 174.62 172.74 1rbp n ASP 110 N 0.04 2.81 0.00 8.08 5.75 -0.81 -5.00 116.55 127.42 1rbp n ASP 110 Ca -0.14 -2.97 0.00 0.00 -0.01 0.00 0.00 54.79 51.67 1rbp n ASP 110 Cb 0.62 -0.43 0.00 0.00 -1.03 0.00 0.00 41.12 40.27 1rbp n ASP 110 CO 0.00 0.00 0.00 -1.22 -0.11 0.00 0.00 177.20 175.87 1rbp n TYR 111 N -1.04 0.00 0.66 2.11 4.01 -1.26 -4.45 117.16 117.19 1rbp n TYR 111 Ca 0.16 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.98 1rbp n TYR 111 Cb 0.69 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.69 1rbp n TYR 111 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 1rbp n ASP 112 N 0.44 1.25 0.00 7.72 10.43 -1.26 -4.81 116.55 130.31 1rbp n ASP 112 Ca 0.00 -1.12 0.00 0.00 2.57 0.00 0.00 54.79 56.24 1rbp n ASP 112 Cb 0.00 0.65 0.00 0.00 1.84 0.00 0.00 41.12 43.61 1rbp n ASP 112 CO 0.00 0.00 0.00 0.41 -1.07 0.00 0.00 177.20 176.54 1rbp n THR 113 N -0.54 0.00 -3.92 -3.53 -1.04 -1.26 -4.65 114.28 99.34 1rbp n THR 113 Ca 0.05 0.00 -0.10 0.00 -2.04 0.00 0.00 64.05 61.96 1rbp n THR 113 Cb 0.28 -0.51 -0.10 0.00 -1.82 0.00 0.00 70.33 68.18 1rbp n THR 113 CO 0.00 0.00 0.00 -0.72 -0.64 0.00 0.00 175.07 173.71 1rbp s TYR 114 N -1.72 0.14 0.02 -1.42 -0.85 -1.26 -1.02 117.35 111.24 1rbp s TYR 114 Ca 0.00 -0.33 0.01 0.00 -0.52 0.00 0.00 57.07 56.23 1rbp s TYR 114 Cb 0.00 -0.11 -0.02 0.00 0.38 0.00 0.00 41.96 42.21 1rbp s TYR 114 CO 0.00 -0.27 -0.05 0.00 -1.52 0.00 0.00 175.55 173.71 1rbp s ALA 115 N -1.65 0.31 -0.14 9.51 0.00 -0.83 -1.93 121.76 127.02 1rbp s ALA 115 Ca -0.13 -0.53 0.00 0.00 0.00 0.00 0.00 51.96 51.29 1rbp s ALA 115 Cb -0.07 0.06 0.03 0.00 0.00 0.00 0.00 23.12 23.14 1rbp s ALA 115 CO -0.00 -0.06 -0.11 0.08 0.00 0.00 0.00 175.76 175.67 1rbp s VAL 116 N -1.08 1.37 0.27 0.00 1.01 0.12 -0.83 120.40 121.26 1rbp s VAL 116 Ca -0.10 -0.56 0.07 0.00 0.00 0.00 0.00 61.98 61.39 1rbp s VAL 116 Cb -0.08 -1.35 -0.03 0.00 0.00 0.00 0.00 36.38 34.92 1rbp s VAL 116 CO -0.00 0.37 0.21 -1.58 0.00 0.00 0.00 175.10 174.10 1rbp s GLN 117 N 1.56 2.90 -0.13 2.72 -0.44 -0.45 -0.47 119.66 125.35 1rbp s GLN 117 Ca 0.04 -1.09 -0.23 0.00 -2.50 0.00 0.00 55.36 51.58 1rbp s GLN 117 Cb -0.13 -2.55 0.05 0.00 -1.64 0.00 0.00 33.01 28.74 1rbp s GLN 117 CO -0.09 0.35 0.56 -0.47 0.50 0.00 0.00 175.29 176.14 1rbp s TYR 118 N -2.16 -0.56 -0.07 1.67 6.14 -0.71 -2.73 117.35 118.93 1rbp s TYR 118 Ca 0.34 1.18 -0.03 0.00 0.64 0.00 0.00 57.07 59.20 1rbp s TYR 118 Cb -0.08 0.26 0.04 0.00 0.42 0.00 0.00 41.96 42.60 1rbp s TYR 118 CO 0.25 -0.42 0.13 0.45 0.64 0.00 0.00 175.55 176.60 1rbp s SER 119 N -0.49 0.33 -0.28 4.32 0.15 -0.73 -1.71 113.70 115.29 1rbp s SER 119 Ca -0.06 0.27 -0.11 0.00 0.70 0.00 0.00 55.95 56.75 1rbp s SER 119 Cb -0.03 0.17 -0.04 0.00 -1.71 0.00 0.00 66.02 64.41 1rbp s SER 119 CO 0.04 -0.19 0.18 0.00 1.20 0.00 0.00 173.24 174.47 1rbp h ARG 121 N 8.36 0.00 -1.98 0.00 2.47 -0.79 -3.43 114.38 119.02 1rbp h ARG 121 Ca -0.35 0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 58.37 1rbp h ARG 121 Cb 1.18 0.00 -0.21 0.00 -1.65 0.00 0.00 29.97 29.29 1rbp h ARG 121 CO 0.56 0.36 0.09 -1.17 0.56 0.00 0.00 179.97 180.37 1rbp s LEU 122 N -6.10 -0.84 -0.14 3.04 2.96 -1.11 -4.98 118.68 111.52 1rbp s LEU 122 Ca 0.01 1.46 -0.07 0.00 -0.22 0.00 0.00 54.13 55.30 1rbp s LEU 122 Cb 0.08 2.40 -0.04 0.00 0.50 0.00 0.00 46.19 49.12 1rbp s LEU 122 CO 0.77 -0.24 0.13 -0.76 -1.32 0.00 0.00 176.35 174.93 1rbp s LEU 123 N 1.05 4.30 0.86 -0.68 1.02 -1.26 0.10 118.68 124.07 1rbp s LEU 123 Ca -0.05 0.40 -0.12 0.00 0.02 0.00 0.00 54.13 54.38 1rbp s LEU 123 Cb -0.05 -2.06 0.11 0.00 0.02 0.00 0.00 46.19 44.21 1rbp s LEU 123 CO -0.10 0.36 1.11 0.20 0.02 0.00 0.00 176.35 177.94 1rbp s ASN 124 N -0.73 3.96 0.51 2.29 0.01 0.45 -4.71 114.94 116.73 1rbp s ASN 124 Ca 0.13 1.17 0.29 0.00 -0.71 0.00 0.00 52.86 53.74 1rbp s ASN 124 Cb -0.12 -1.83 1.32 0.00 0.41 0.00 0.00 41.25 41.03 1rbp s ASN 124 CO 0.03 -2.29 1.98 -0.07 -1.51 0.00 0.00 177.10 175.24 1rbp h LEU 125 N -1.31 0.00 -0.09 0.60 -0.00 -1.99 -1.90 115.31 110.61 1rbp h LEU 125 Ca -0.49 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.39 1rbp h LEU 125 Cb 1.30 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.96 1rbp h LEU 125 CO 0.60 0.12 -0.01 -0.90 -0.00 0.00 0.00 178.44 178.24 1rbp n ASP 126 N -3.36 0.16 0.00 -0.43 5.68 -1.26 -4.92 116.55 112.41 1rbp n ASP 126 Ca -0.01 -0.73 0.00 0.00 -0.50 0.00 0.00 54.79 53.56 1rbp n ASP 126 Cb 0.31 -0.09 0.00 0.00 -1.14 0.00 0.00 41.12 40.20 1rbp n ASP 126 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1rbp n GLY 127 N 1.13 1.55 3.84 6.12 0.00 -0.71 -4.89 105.19 112.23 1rbp n GLY 127 Ca 0.20 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.92 1rbp n GLY 127 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1rbp s THR 128 N -2.43 1.93 -0.25 2.61 -4.23 -1.26 -1.51 115.64 110.50 1rbp s THR 128 Ca 0.00 0.00 -0.08 0.00 -1.18 0.00 0.00 61.69 60.43 1rbp s THR 128 Cb 0.00 -2.86 -0.03 0.00 1.34 0.00 0.00 72.50 70.94 1rbp s THR 128 CO 0.00 0.00 0.09 0.00 -0.54 0.00 0.00 174.62 174.17 1rbp n ALA 130 N 4.75 2.88 -3.15 0.00 0.00 0.28 -4.74 120.51 120.52 1rbp n ALA 130 Ca -0.16 -0.21 0.04 0.00 0.00 0.00 0.00 53.44 53.12 1rbp n ALA 130 Cb 0.52 -1.29 -0.01 0.00 0.00 0.00 0.00 19.45 18.67 1rbp n ALA 130 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1rbp s ASP 131 N -3.40 -1.17 0.25 0.00 3.68 -1.03 -4.93 116.67 110.06 1rbp s ASP 131 Ca 0.11 0.66 0.02 0.00 2.13 0.00 0.00 52.55 55.48 1rbp s ASP 131 Cb 0.17 1.95 -0.05 0.00 -1.45 0.00 0.00 42.92 43.54 1rbp s ASP 131 CO 0.63 -0.22 0.04 -0.94 0.13 0.00 0.00 175.17 174.82 1rbp s SER 132 N 2.88 1.59 0.04 -0.34 1.04 -1.26 0.01 113.70 117.65 1rbp s SER 132 Ca 0.15 -1.30 0.00 0.00 0.48 0.00 0.00 55.95 55.28 1rbp s SER 132 Cb -0.13 0.07 -0.03 0.00 0.10 0.00 0.00 66.02 66.03 1rbp s SER 132 CO -0.19 -0.62 -0.04 -0.72 0.98 0.00 0.00 173.24 172.65 1rbp s TYR 133 N -3.56 0.44 -0.01 5.02 -0.85 -0.46 -3.12 117.35 114.81 1rbp s TYR 133 Ca 0.33 -0.74 -0.07 0.00 -0.52 0.00 0.00 57.07 56.06 1rbp s TYR 133 Cb 0.07 -0.30 0.01 0.00 0.38 0.00 0.00 41.96 42.11 1rbp s TYR 133 CO 0.11 -0.24 0.15 0.45 -1.52 0.00 0.00 175.55 174.50 1rbp s SER 134 N -2.09 -0.02 0.07 -0.18 0.15 -0.46 -1.78 113.70 109.38 1rbp s SER 134 Ca -0.05 -0.09 0.06 0.00 0.70 0.00 0.00 55.95 56.56 1rbp s SER 134 Cb -0.03 0.24 -0.03 0.00 -1.71 0.00 0.00 66.02 64.49 1rbp s SER 134 CO -0.04 -0.32 -0.16 -0.36 1.20 0.00 0.00 173.24 173.56 1rbp s PHE 135 N -1.12 1.37 -0.31 3.44 0.08 -1.11 -1.20 117.98 119.14 1rbp s PHE 135 Ca -0.12 -0.41 -0.03 0.00 0.12 0.00 0.00 56.93 56.49 1rbp s PHE 135 Cb -0.06 -0.78 0.05 0.00 -0.57 0.00 0.00 43.02 41.65 1rbp s PHE 135 CO 0.01 0.08 0.02 0.08 -0.10 0.00 0.00 175.22 175.32 1rbp s VAL 136 N -1.10 3.18 0.20 -0.44 1.01 -0.64 -1.34 120.40 121.27 1rbp s VAL 136 Ca 0.01 -1.32 -0.02 0.00 0.00 0.00 0.00 61.98 60.64 1rbp s VAL 136 Cb -0.09 -2.82 -0.05 0.00 0.00 0.00 0.00 36.38 33.42 1rbp s VAL 136 CO 0.02 -0.12 0.41 -0.36 0.00 0.00 0.00 175.10 175.05 1rbp s PHE 137 N 1.29 3.48 0.00 5.22 0.08 -0.01 -0.53 117.98 127.51 1rbp s PHE 137 Ca -0.04 0.44 0.03 0.00 0.12 0.00 0.00 56.93 57.48 1rbp s PHE 137 Cb -0.20 -1.93 -0.01 0.00 -0.57 0.00 0.00 43.02 40.31 1rbp s PHE 137 CO -0.00 0.37 -0.09 0.45 -0.10 0.00 0.00 175.22 175.84 1rbp s SER 138 N -2.95 1.05 0.22 1.36 0.15 -0.04 -1.97 113.70 111.52 1rbp s SER 138 Ca 0.40 -0.22 0.02 0.00 0.70 0.00 0.00 55.95 56.85 1rbp s SER 138 Cb -0.11 -0.10 0.20 0.00 -1.71 0.00 0.00 66.02 64.30 1rbp s SER 138 CO 0.28 0.07 1.53 -0.09 1.20 0.00 0.00 173.24 176.23 1rbp h ARG 139 N 5.70 0.32 -5.62 5.44 9.65 -1.34 -0.21 114.38 128.32 1rbp h ARG 139 Ca -0.32 -0.22 -0.59 0.00 -1.10 0.00 0.00 59.98 57.75 1rbp h ARG 139 Cb 1.18 0.03 -0.09 0.00 -1.39 0.00 0.00 29.97 29.71 1rbp h ARG 139 CO 0.48 0.83 -0.28 0.34 2.80 0.00 0.00 179.97 184.14 1rbp s ASP 140 N -6.91 6.53 0.64 -3.80 2.15 -1.26 -4.80 116.67 109.21 1rbp s ASP 140 Ca -0.05 0.62 0.36 0.00 0.43 0.00 0.00 52.55 53.91 1rbp s ASP 140 Cb 0.12 -2.20 2.02 0.00 -0.30 0.00 0.00 42.92 42.55 1rbp s ASP 140 CO 0.81 0.13 2.22 1.55 -0.17 0.00 0.00 175.17 179.71 1rbp h PRO 141 N 6.32 0.00 -0.06 4.34 0.13 -1.95 -2.38 132.00 138.40 1rbp h PRO 141 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 1rbp h PRO 141 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1rbp h PRO 141 CO 0.73 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.59 1rbp n ASN 142 N -3.36 1.63 0.00 1.44 3.02 -1.26 -5.04 115.26 111.70 1rbp n ASN 142 Ca -0.02 -1.58 0.00 0.00 -0.03 0.00 0.00 54.58 52.96 1rbp n ASN 142 Cb 0.18 -0.03 0.00 0.00 -0.61 0.00 0.00 39.78 39.32 1rbp n ASN 142 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1rbp n GLY 143 N 1.18 -0.66 3.75 7.41 0.00 -0.90 -5.02 105.19 110.95 1rbp n GLY 143 Ca 0.18 -2.17 -0.33 0.00 0.00 0.00 0.00 46.02 43.70 1rbp n GLY 143 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rbp s LEU 144 N 0.00 3.79 0.75 0.99 1.43 -1.26 -4.53 118.68 119.85 1rbp s LEU 144 Ca 0.00 0.13 -0.14 0.00 -1.03 0.00 0.00 54.13 53.09 1rbp s LEU 144 Cb 0.00 -2.14 0.05 0.00 0.03 0.00 0.00 46.19 44.13 1rbp s LEU 144 CO 0.00 0.29 1.18 -2.16 0.23 0.00 0.00 176.35 175.90 1rbp s PRO 145 N -1.55 2.03 0.36 1.29 0.04 -1.26 -4.77 135.00 131.14 1rbp s PRO 145 Ca 0.20 1.66 0.12 0.00 0.04 0.00 0.00 61.00 63.02 1rbp s PRO 145 Cb -0.12 -1.83 0.93 0.00 0.04 0.00 0.00 34.50 33.52 1rbp s PRO 145 CO 0.11 -1.89 1.80 -1.35 0.04 0.00 0.00 177.00 175.71 1rbp h PRO 146 N -0.56 0.55 0.26 0.56 0.11 -1.99 -0.76 132.00 130.17 1rbp h PRO 146 Ca -0.47 -0.03 0.01 0.00 0.11 0.00 0.00 66.00 65.62 1rbp h PRO 146 Cb 1.28 -0.13 -0.03 0.00 0.11 0.00 0.00 31.00 32.23 1rbp h PRO 146 CO 0.49 0.37 -0.40 0.93 -0.21 0.00 0.00 178.00 179.18 1rbp h GLU 147 N 0.57 -0.69 -0.89 1.05 3.07 -2.01 -2.19 114.58 113.49 1rbp h GLU 147 Ca 0.55 0.05 -0.02 0.00 -0.50 0.00 0.00 59.36 59.43 1rbp h GLU 147 Cb 1.12 0.16 -0.04 0.00 -0.84 0.00 0.00 28.75 29.14 1rbp h GLU 147 CO -0.30 -0.46 0.47 0.00 -1.40 0.00 0.00 179.01 177.32 1rbp h ALA 148 N -0.27 1.17 -0.38 3.43 0.00 -1.65 -3.03 119.26 118.53 1rbp h ALA 148 Ca -0.01 -0.14 0.07 0.00 0.00 0.00 0.00 54.91 54.84 1rbp h ALA 148 Cb 0.69 -0.35 -0.06 0.00 0.00 0.00 0.00 17.79 18.07 1rbp h ALA 148 CO -0.15 0.66 -0.01 0.37 0.00 0.00 0.00 179.25 180.13 1rbp h GLN 149 N 1.24 0.09 -0.62 0.00 4.15 -0.93 -1.04 115.11 118.01 1rbp h GLN 149 Ca 0.31 -0.01 0.07 0.00 0.77 0.00 0.00 58.65 59.79 1rbp h GLN 149 Cb 0.04 -0.02 -0.06 0.00 0.21 0.00 0.00 27.48 27.65 1rbp h GLN 149 CO -0.05 0.06 0.31 -0.22 -1.93 0.00 0.00 178.83 177.00 1rbp h LYS 150 N 0.09 0.54 -0.15 1.69 3.64 -1.28 -0.16 116.57 120.95 1rbp h LYS 150 Ca 0.18 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.51 1rbp h LYS 150 Cb 0.26 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 31.95 1rbp h LYS 150 CO -0.32 0.36 0.02 0.82 -2.27 0.00 0.00 179.45 178.06 1rbp h ILE 151 N 0.56 1.23 -0.09 2.00 2.04 -1.43 -1.90 117.51 119.92 1rbp h ILE 151 Ca 0.29 -0.73 0.02 0.00 1.00 0.00 0.00 64.86 65.44 1rbp h ILE 151 Cb 0.25 1.43 -0.03 0.00 -0.74 0.00 0.00 36.82 37.73 1rbp h ILE 151 CO -0.22 0.22 -0.06 0.58 0.00 0.00 0.00 178.15 178.67 1rbp h VAL 152 N 0.02 0.82 -0.57 1.67 2.07 -0.86 -0.47 116.25 118.92 1rbp h VAL 152 Ca 0.04 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.55 1rbp h VAL 152 Cb 0.32 0.82 -0.03 0.00 -1.52 0.00 0.00 31.29 30.87 1rbp h VAL 152 CO 0.00 0.00 0.31 -0.09 0.02 0.00 0.00 177.57 177.81 1rbp h ARG 153 N -0.06 0.79 -0.37 1.57 9.65 -0.94 -1.26 114.38 123.75 1rbp h ARG 153 Ca 0.06 -0.08 0.07 0.00 -1.10 0.00 0.00 59.98 58.93 1rbp h ARG 153 Cb 0.15 -0.16 -0.06 0.00 -1.39 0.00 0.00 29.97 28.50 1rbp h ARG 153 CO -0.13 0.58 -0.03 0.37 2.80 0.00 0.00 179.97 183.56 1rbp h GLN 154 N 0.79 0.06 -0.45 0.20 4.15 -0.46 -1.19 115.11 118.22 1rbp h GLN 154 Ca 0.20 -0.00 -0.09 0.00 0.77 0.00 0.00 58.65 59.53 1rbp h GLN 154 Cb 0.03 -0.01 -0.02 0.00 0.21 0.00 0.00 27.48 27.69 1rbp h GLN 154 CO -0.03 0.04 -0.08 0.00 -1.93 0.00 0.00 178.83 176.83 1rbp h ARG 155 N 0.07 0.79 -0.66 1.69 2.47 -0.40 -1.20 114.38 117.14 1rbp h ARG 155 Ca 0.18 -0.25 -0.07 0.00 -1.26 0.00 0.00 59.98 58.59 1rbp h ARG 155 Cb 0.26 -0.07 -0.03 0.00 -1.65 0.00 0.00 29.97 28.48 1rbp h ARG 155 CO -0.33 0.85 0.16 1.96 0.56 0.00 0.00 179.97 183.16 1rbp h GLN 156 N 0.72 1.06 -0.40 0.04 4.20 -0.47 -1.31 115.11 118.95 1rbp h GLN 156 Ca 0.13 -0.26 -0.03 0.00 0.06 0.00 0.00 58.65 58.55 1rbp h GLN 156 Cb 0.55 -0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.18 1rbp h GLN 156 CO 0.03 0.95 0.13 1.49 -0.67 0.00 0.00 178.83 180.76 1rbp h GLU 157 N 0.99 0.63 -0.32 1.46 4.57 -1.00 -0.64 114.58 120.27 1rbp h GLU 157 Ca 0.21 -0.14 0.07 0.00 -1.18 0.00 0.00 59.36 58.33 1rbp h GLU 157 Cb 0.37 -0.09 -0.01 0.00 -0.16 0.00 0.00 28.75 28.86 1rbp h GLU 157 CO 0.00 0.63 0.22 0.93 -1.18 0.00 0.00 179.01 179.61 1rbp h GLU 158 N 0.51 0.09 -0.15 1.92 5.08 -0.74 -1.23 114.58 120.06 1rbp h GLU 158 Ca 0.13 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 1rbp h GLU 158 Cb 0.26 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.49 1rbp h GLU 158 CO -0.00 0.06 0.00 1.28 -1.00 0.00 0.00 179.01 179.35 1rbp n LEU 159 N -4.46 1.43 -2.60 1.33 4.77 -0.54 -4.88 117.00 112.05 1rbp n LEU 159 Ca 0.04 -0.61 -0.20 0.00 -0.03 0.00 0.00 56.01 55.21 1rbp n LEU 159 Cb 0.33 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.33 1rbp n LEU 159 CO 0.35 0.30 -0.18 0.00 -1.33 0.00 0.00 177.39 176.54 1rbp n LEU 161 N -3.29 1.97 -4.75 0.00 4.77 -0.30 -5.04 117.00 110.35 1rbp n LEU 161 Ca -0.19 -2.24 -0.41 0.00 -0.03 0.00 0.00 56.01 53.14 1rbp n LEU 161 Cb 0.66 -0.14 -0.02 0.00 -2.33 0.00 0.00 43.42 41.59 1rbp n LEU 161 CO 0.33 0.54 1.06 0.00 -1.33 0.00 0.00 177.39 177.99 1rbp s ALA 162 N -1.54 3.58 -0.44 -1.18 0.00 -0.88 -1.92 121.76 119.37 1rbp s ALA 162 Ca 0.11 1.31 0.00 0.00 0.00 0.00 0.00 51.96 53.38 1rbp s ALA 162 Cb 0.09 -3.53 0.00 0.00 0.00 0.00 0.00 23.12 19.68 1rbp s ALA 162 CO 0.01 -0.72 0.00 0.54 0.00 0.00 0.00 175.76 175.59 1rbp n ARG 163 N 1.73 -0.40 -0.15 0.00 1.74 -1.26 -4.92 116.66 113.41 1rbp n ARG 163 Ca 0.04 0.57 0.09 0.00 -0.77 0.00 0.00 57.85 57.78 1rbp n ARG 163 Cb 0.41 -4.22 0.16 0.00 -1.02 0.00 0.00 32.46 27.79 1rbp n ARG 163 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 1rbp n GLN 164 N -2.66 1.76 -4.36 5.56 6.02 -0.81 -4.99 117.38 117.90 1rbp n GLN 164 Ca -0.04 -2.56 -0.31 0.00 -0.01 0.00 0.00 57.00 54.08 1rbp n GLN 164 Cb 0.16 -1.54 -0.10 0.00 1.02 0.00 0.00 30.24 29.79 1rbp n GLN 164 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 1rbp s TYR 165 N -2.72 2.83 0.04 1.08 2.02 -1.26 -4.35 117.35 114.98 1rbp s TYR 165 Ca 0.32 -0.09 0.08 0.00 -0.37 0.00 0.00 57.07 57.01 1rbp s TYR 165 Cb 0.27 -1.53 -0.03 0.00 -0.40 0.00 0.00 41.96 40.27 1rbp s TYR 165 CO 0.04 0.39 -0.21 1.03 -1.57 0.00 0.00 175.55 175.23 1rbp s ARG 166 N -1.78 1.97 0.56 -0.62 0.52 -0.54 -4.92 118.95 114.14 1rbp s ARG 166 Ca 0.19 -1.03 -0.20 0.00 -0.52 0.00 0.00 55.73 54.17 1rbp s ARG 166 Cb -0.11 -2.11 -0.04 0.00 0.52 0.00 0.00 34.95 33.21 1rbp s ARG 166 CO 0.11 0.53 1.25 -0.51 0.02 0.00 0.00 175.30 176.70 1rbp s LEU 167 N -1.34 3.78 -0.18 2.53 1.02 -1.26 -1.79 118.68 121.44 1rbp s LEU 167 Ca 0.13 2.51 -0.07 0.00 0.02 0.00 0.00 54.13 56.72 1rbp s LEU 167 Cb -0.10 -4.44 -0.04 0.00 0.02 0.00 0.00 46.19 41.63 1rbp s LEU 167 CO 0.04 -1.50 0.05 -0.63 0.02 0.00 0.00 176.35 174.33 1rbp s ILE 168 N -1.47 4.72 0.15 -0.59 1.01 -0.42 -4.88 121.20 119.71 1rbp s ILE 168 Ca 0.74 -0.06 -0.26 0.00 0.00 0.00 0.00 60.65 61.06 1rbp s ILE 168 Cb -0.34 -3.12 -0.07 0.00 0.01 0.00 0.00 42.46 38.94 1rbp s ILE 168 CO 0.38 0.47 0.82 -0.69 0.00 0.00 0.00 174.94 175.92 1rbp s VAL 169 N 0.32 4.41 -0.30 2.92 1.01 -1.26 -4.88 120.40 122.62 1rbp s VAL 169 Ca 0.03 1.79 0.01 0.00 0.00 0.00 0.00 61.98 63.81 1rbp s VAL 169 Cb -0.12 -4.18 0.09 0.00 0.00 0.00 0.00 36.38 32.16 1rbp s VAL 169 CO 0.00 0.46 0.05 -1.00 0.00 0.00 0.00 175.10 174.61 1rbp s HIS 170 N -0.80 2.54 -0.19 5.22 3.76 -1.26 0.08 115.29 124.64 1rbp s HIS 170 Ca 0.38 -2.14 0.13 0.00 -0.15 0.00 0.00 55.06 53.28 1rbp s HIS 170 Cb -0.23 -2.07 0.43 0.00 1.11 0.00 0.00 32.58 31.82 1rbp s HIS 170 CO 0.27 -0.87 1.20 0.27 -0.85 0.00 0.00 174.74 174.76 1rbp n ASN 171 N 4.61 2.13 -2.20 1.40 0.23 -1.26 -5.00 115.26 115.17 1rbp n ASN 171 Ca -0.03 -3.53 -0.16 0.00 -0.53 0.00 0.00 54.58 50.33 1rbp n ASN 171 Cb 0.43 -0.46 -0.02 0.00 -2.08 0.00 0.00 39.78 37.64 1rbp n ASN 171 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1rbp n GLY 172 N -0.79 -0.03 0.34 4.83 0.00 -1.26 -4.87 105.19 103.41 1rbp n GLY 172 Ca 0.21 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.19 1rbp n GLY 172 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 1rbp h TYR 173 N 0.00 1.09 -1.64 1.61 3.20 -1.96 -3.43 116.97 115.84 1rbp h TYR 173 Ca -0.37 -0.07 -0.43 0.00 3.14 0.00 0.00 58.73 61.00 1rbp h TYR 173 Cb 1.23 -0.33 0.01 0.00 1.54 0.00 0.00 36.73 39.18 1rbp h TYR 173 CO 0.60 0.82 -0.31 0.00 -1.64 0.00 0.00 178.16 177.63