#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lru s VAL 2 N 0.00 4.88 0.16 -3.33 1.01 -1.26 -4.60 120.40 117.26 1lru s VAL 2 Ca 0.00 1.69 0.01 0.00 0.00 0.00 0.00 61.98 63.68 1lru s VAL 2 Cb 0.00 -4.15 -0.04 0.00 0.00 0.00 0.00 36.38 32.19 1lru s VAL 2 CO 0.00 0.26 0.32 -0.76 0.00 0.00 0.00 175.10 174.92 1lru s LEU 3 N 0.56 4.30 0.15 3.92 1.43 -1.26 -5.01 118.68 122.76 1lru s LEU 3 Ca 0.42 0.27 -0.30 0.00 -1.03 0.00 0.00 54.13 53.49 1lru s LEU 3 Cb -0.20 -3.01 -0.07 0.00 0.03 0.00 0.00 46.19 42.94 1lru s LEU 3 CO 0.23 0.02 1.02 -1.58 0.23 0.00 0.00 176.35 176.27 1lru s GLN 4 N -3.22 4.67 -0.31 1.70 2.00 -1.26 -4.92 119.66 118.32 1lru s GLN 4 Ca 0.36 1.56 -0.12 0.00 -2.00 0.00 0.00 55.36 55.17 1lru s GLN 4 Cb -0.11 -3.33 -0.03 0.00 0.80 0.00 0.00 33.01 30.34 1lru s GLN 4 CO 0.29 0.18 0.21 0.08 -0.50 0.00 0.00 175.29 175.55 1lru s VAL 5 N -0.19 5.23 0.66 1.34 1.01 -1.26 -4.34 120.40 122.85 1lru s VAL 5 Ca 0.47 -0.07 -0.17 0.00 0.00 0.00 0.00 61.98 62.21 1lru s VAL 5 Cb -0.26 -3.60 -0.00 0.00 0.00 0.00 0.00 36.38 32.52 1lru s VAL 5 CO 0.32 0.11 1.27 -0.76 0.00 0.00 0.00 175.10 176.03 1lru s LEU 6 N 1.73 3.52 0.16 3.92 1.43 0.21 -4.94 118.68 124.71 1lru s LEU 6 Ca 0.06 2.54 0.07 0.00 -1.03 0.00 0.00 54.13 55.77 1lru s LEU 6 Cb -0.17 -4.61 -0.04 0.00 0.03 0.00 0.00 46.19 41.40 1lru s LEU 6 CO 0.10 -2.03 -0.14 -1.00 0.23 0.00 0.00 176.35 173.51 1lru s HIS 7 N -1.55 1.53 0.61 0.29 3.76 -1.26 -4.27 115.29 114.40 1lru s HIS 7 Ca 0.80 -0.58 -0.17 0.00 -0.15 0.00 0.00 55.06 54.96 1lru s HIS 7 Cb -0.35 -0.76 -0.02 0.00 1.11 0.00 0.00 32.58 32.56 1lru s HIS 7 CO 0.40 0.22 1.13 0.96 -0.85 0.00 0.00 174.74 176.61 1lru s ILE 8 N -2.59 3.08 -0.99 0.60 -4.36 -0.88 -2.52 121.20 113.55 1lru s ILE 8 Ca 0.15 0.58 -0.06 0.00 -0.26 0.00 0.00 60.65 61.07 1lru s ILE 8 Cb -0.02 -3.15 0.03 0.00 1.25 0.00 0.00 42.46 40.57 1lru s ILE 8 CO 0.04 -0.23 2.71 -2.65 0.24 0.00 0.00 174.94 175.05 1lru n PRO 9 N -1.93 3.60 -2.68 0.37 -0.02 -1.26 -4.80 135.00 128.27 1lru n PRO 9 Ca 0.11 -2.72 -0.43 0.00 -2.02 0.00 0.00 63.50 58.45 1lru n PRO 9 Cb 0.51 -2.46 -0.02 0.00 -0.02 0.00 0.00 33.50 31.51 1lru n PRO 9 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1lru s ASP 10 N 0.80 7.15 0.35 2.55 3.68 -1.05 -4.92 116.67 125.23 1lru s ASP 10 Ca 0.59 1.43 0.27 0.00 2.13 0.00 0.00 52.55 56.97 1lru s ASP 10 Cb 0.25 -2.54 1.16 0.00 -1.45 0.00 0.00 42.92 40.34 1lru s ASP 10 CO -0.12 -0.56 1.80 -0.33 0.13 0.00 0.00 175.17 176.09 1lru h GLU 11 N 7.30 0.00 0.00 4.34 4.39 -2.00 -1.89 114.58 126.71 1lru h GLU 11 Ca -0.25 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.45 1lru h GLU 11 Cb 1.10 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.75 1lru h GLU 11 CO 0.92 0.00 0.00 0.00 -1.16 0.00 0.00 179.01 178.77 1lru h ARG 12 N 0.00 0.00 0.00 2.33 3.08 -1.97 -2.64 114.38 115.18 1lru h ARG 12 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1lru h ARG 12 Cb 0.35 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.40 1lru h ARG 12 CO 0.00 0.00 0.00 1.28 -1.07 0.00 0.00 179.97 180.18 1lru n LEU 13 N -2.30 0.00 -0.85 3.04 4.77 -0.71 -3.24 117.00 117.72 1lru n LEU 13 Ca 0.03 0.40 0.08 0.00 -0.03 0.00 0.00 56.01 56.49 1lru n LEU 13 Cb 0.30 -0.40 0.24 0.00 -2.33 0.00 0.00 43.42 41.23 1lru n LEU 13 CO 0.24 -0.03 0.69 0.54 -1.33 0.00 0.00 177.39 177.50 1lru n ARG 14 N -1.40 2.95 -3.27 3.23 5.12 -1.00 -4.39 116.66 117.90 1lru n ARG 14 Ca 0.10 -2.65 -0.37 0.00 -1.93 0.00 0.00 57.85 53.00 1lru n ARG 14 Cb 0.28 -1.71 -0.06 0.00 -1.16 0.00 0.00 32.46 29.81 1lru n ARG 14 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 1lru s LYS 15 N -2.37 4.12 -0.42 5.56 1.02 -1.20 -4.60 119.74 121.85 1lru s LYS 15 Ca 0.38 0.66 -0.23 0.00 0.02 0.00 0.00 55.97 56.80 1lru s LYS 15 Cb 0.29 -3.04 0.02 0.00 -0.52 0.00 0.00 37.83 34.58 1lru s LYS 15 CO 0.11 0.52 0.79 0.08 -0.92 0.00 0.00 175.35 175.93 1lru s VAL 16 N -1.34 4.67 0.58 3.17 1.01 -1.26 -3.55 120.40 123.68 1lru s VAL 16 Ca 0.36 0.58 -0.19 0.00 0.00 0.00 0.00 61.98 62.73 1lru s VAL 16 Cb -0.17 -4.29 -0.05 0.00 0.00 0.00 0.00 36.38 31.87 1lru s VAL 16 CO 0.20 -0.64 1.06 0.00 0.00 0.00 0.00 175.10 175.72 1lru n ALA 17 N 6.65 0.49 -2.83 5.51 0.00 0.25 -4.93 120.51 125.65 1lru n ALA 17 Ca 0.03 0.04 -0.33 0.00 0.00 0.00 0.00 53.44 53.18 1lru n ALA 17 Cb 0.48 -2.17 -0.06 0.00 0.00 0.00 0.00 19.45 17.71 1lru n ALA 17 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1lru s LYS 18 N -2.77 3.17 0.27 0.00 1.02 -0.19 -4.74 119.74 116.50 1lru s LYS 18 Ca 0.75 -0.47 -0.31 0.00 0.02 0.00 0.00 55.97 55.97 1lru s LYS 18 Cb -0.43 -2.92 -0.12 0.00 -0.52 0.00 0.00 37.83 33.85 1lru s LYS 18 CO 0.48 0.64 1.63 -2.14 -0.92 0.00 0.00 175.35 175.04 1lru s PRO 19 N -1.95 4.12 -0.14 -1.68 0.02 -1.26 -0.57 135.00 133.54 1lru s PRO 19 Ca 0.26 2.59 -0.29 0.00 0.02 0.00 0.00 61.00 63.58 1lru s PRO 19 Cb -0.12 -3.04 -0.05 0.00 0.02 0.00 0.00 34.50 31.31 1lru s PRO 19 CO 0.18 -0.67 1.89 0.08 -0.33 0.00 0.00 177.00 178.15 1lru s VAL 20 N 0.36 3.29 0.29 3.83 1.01 -1.26 -4.84 120.40 123.08 1lru s VAL 20 Ca 0.67 0.33 0.18 0.00 0.00 0.00 0.00 61.98 63.16 1lru s VAL 20 Cb -0.48 -3.29 0.14 0.00 0.00 0.00 0.00 36.38 32.74 1lru s VAL 20 CO 0.43 -0.12 1.81 -0.08 0.00 0.00 0.00 175.10 177.15 1lru h GLU 21 N 11.89 0.00 -1.71 2.72 4.57 -2.00 -3.45 114.58 126.60 1lru h GLU 21 Ca -0.41 0.00 0.08 0.00 -1.18 0.00 0.00 59.36 57.85 1lru h GLU 21 Cb 1.20 0.00 -0.24 0.00 -0.16 0.00 0.00 28.75 29.55 1lru h GLU 21 CO 0.97 0.35 0.20 -2.00 -1.18 0.00 0.00 179.01 177.35 1lru s GLU 22 N -3.90 0.52 -1.02 1.92 2.12 -1.26 -5.10 118.70 111.98 1lru s GLU 22 Ca -0.01 0.94 -0.19 0.00 0.36 0.00 0.00 54.97 56.06 1lru s GLU 22 Cb 0.13 0.17 0.11 0.00 0.26 0.00 0.00 34.13 34.79 1lru s GLU 22 CO 0.69 -0.12 1.32 0.08 -0.54 0.00 0.00 175.26 176.69 1lru s VAL 23 N 1.63 4.46 0.00 3.70 1.01 -1.26 -4.80 120.40 125.13 1lru s VAL 23 Ca -0.09 -1.48 0.00 0.00 0.00 0.00 0.00 61.98 60.41 1lru s VAL 23 Cb -0.05 -4.92 0.00 0.00 0.00 0.00 0.00 36.38 31.41 1lru s VAL 23 CO -0.17 -1.70 0.00 -0.46 0.00 0.00 0.00 175.10 172.77 1lru n ASN 24 N 7.33 1.61 -0.33 3.32 0.23 -1.26 -4.66 115.26 121.49 1lru n ASN 24 Ca 0.30 -1.00 0.09 0.00 -0.53 0.00 0.00 54.58 53.45 1lru n ASN 24 Cb 0.49 0.00 0.29 0.00 -2.08 0.00 0.00 39.78 38.48 1lru n ASN 24 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1lru h ALA 25 N 0.90 1.64 -0.33 -2.53 0.00 -1.98 0.96 119.26 117.92 1lru h ALA 25 Ca 0.00 0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 1lru h ALA 25 Cb 0.00 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1lru h ALA 25 CO 0.00 0.10 0.05 1.49 0.00 0.00 0.00 179.25 180.89 1lru h GLU 26 N 0.87 0.55 -0.64 0.00 4.81 -1.96 -0.92 114.58 117.30 1lru h GLU 26 Ca 0.49 -0.15 -0.05 0.00 -0.13 0.00 0.00 59.36 59.52 1lru h GLU 26 Cb 0.62 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.90 1lru h GLU 26 CO -0.26 0.64 0.18 0.82 -0.73 0.00 0.00 179.01 179.66 1lru h ILE 27 N 0.38 1.25 -0.38 2.32 1.08 -1.61 -1.17 117.51 119.39 1lru h ILE 27 Ca 0.10 -0.88 -0.01 0.00 -0.39 0.00 0.00 64.86 63.68 1lru h ILE 27 Cb 0.35 0.61 -0.02 0.00 -3.07 0.00 0.00 36.82 34.69 1lru h ILE 27 CO 0.01 0.33 0.17 1.56 -0.69 0.00 0.00 178.15 179.53 1lru h GLN 28 N 0.92 0.52 -0.20 2.37 4.20 -0.66 0.47 115.11 122.74 1lru h GLN 28 Ca 0.20 -0.06 -0.04 0.00 0.06 0.00 0.00 58.65 58.81 1lru h GLN 28 Cb 0.32 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.99 1lru h GLN 28 CO -0.00 0.42 -0.04 -0.09 -0.67 0.00 0.00 178.83 178.45 1lru h ARG 29 N 0.53 0.38 -0.94 1.46 2.43 -0.25 -1.70 114.38 116.29 1lru h ARG 29 Ca 0.13 -0.14 0.07 0.00 -0.81 0.00 0.00 59.98 59.24 1lru h ARG 29 Cb 0.07 -0.02 -0.07 0.00 -0.42 0.00 0.00 29.97 29.53 1lru h ARG 29 CO -0.02 0.62 0.59 0.82 -1.51 0.00 0.00 179.97 180.48 1lru h ILE 30 N 0.11 1.04 0.05 1.20 2.04 -0.32 -1.53 117.51 120.09 1lru h ILE 30 Ca 0.05 -0.36 -0.00 0.00 1.00 0.00 0.00 64.86 65.55 1lru h ILE 30 Cb 0.47 -0.11 0.00 0.00 -0.74 0.00 0.00 36.82 36.44 1lru h ILE 30 CO 0.02 0.19 -0.02 0.58 0.00 0.00 0.00 178.15 178.92 1lru h VAL 31 N 1.06 0.99 -0.67 1.67 2.07 -0.66 -1.09 116.25 119.62 1lru h VAL 31 Ca 0.42 -0.12 0.02 0.00 0.82 0.00 0.00 66.70 67.84 1lru h VAL 31 Cb 0.23 1.07 -0.04 0.00 -1.52 0.00 0.00 31.29 31.03 1lru h VAL 31 CO -0.19 0.03 0.43 0.44 0.02 0.00 0.00 177.57 178.30 1lru h ASP 32 N -0.11 0.72 -0.82 0.57 5.19 -0.77 -1.95 116.42 119.25 1lru h ASP 32 Ca -0.01 -0.01 -0.04 0.00 -0.62 0.00 0.00 57.03 56.36 1lru h ASP 32 Cb 0.10 -0.16 -0.04 0.00 0.18 0.00 0.00 39.33 39.41 1lru h ASP 32 CO 0.01 0.51 0.37 0.44 -3.12 0.00 0.00 179.24 177.45 1lru h ASP 33 N 0.85 1.09 -0.21 6.45 3.32 -1.08 -1.71 116.42 125.13 1lru h ASP 33 Ca 0.26 -0.15 -0.04 0.00 0.02 0.00 0.00 57.03 57.12 1lru h ASP 33 Cb -0.03 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.22 1lru h ASP 33 CO -0.08 0.93 0.02 0.24 -1.72 0.00 0.00 179.24 178.63 1lru h MET 34 N 1.17 0.46 -0.21 3.56 2.86 -0.65 -0.51 114.93 121.61 1lru h MET 34 Ca 0.28 -0.08 -0.12 0.00 -2.06 0.00 0.00 59.70 57.71 1lru h MET 34 Cb 0.15 -0.07 -0.00 0.00 0.06 0.00 0.00 31.60 31.73 1lru h MET 34 CO -0.03 0.47 -0.34 0.74 1.06 0.00 0.00 176.91 178.81 1lru h PHE 35 N 0.45 0.75 -0.73 -0.22 0.05 -0.72 0.17 116.94 116.69 1lru h PHE 35 Ca 0.10 -0.26 0.03 0.00 3.82 0.00 0.00 57.97 61.66 1lru h PHE 35 Cb 0.26 -0.15 -0.04 0.00 2.00 0.00 0.00 35.95 38.02 1lru h PHE 35 CO 0.01 1.00 0.46 0.93 -0.18 0.00 0.00 178.31 180.52 1lru h GLU 36 N 0.29 0.88 0.30 1.51 5.08 -0.93 -0.15 114.58 121.56 1lru h GLU 36 Ca 0.02 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 1lru h GLU 36 Cb 0.92 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.98 1lru h GLU 36 CO 0.08 0.58 -0.14 1.15 -1.00 0.00 0.00 179.01 179.68 1lru h THR 37 N 0.90 0.73 -0.50 1.13 2.02 -1.00 0.38 112.91 116.57 1lru h THR 37 Ca 0.29 -0.26 0.06 0.00 0.77 0.00 0.00 66.41 67.27 1lru h THR 37 Cb 0.00 0.88 -0.05 0.00 -1.74 0.00 0.00 68.15 67.24 1lru h THR 37 CO -0.10 0.06 0.21 -0.03 0.37 0.00 0.00 175.52 176.02 1lru h MET 38 N -0.54 0.41 -0.37 6.66 1.85 -0.32 -0.20 114.93 122.42 1lru h MET 38 Ca -0.04 -0.02 -0.12 0.00 -0.61 0.00 0.00 59.70 58.90 1lru h MET 38 Cb 0.40 -0.09 -0.01 0.00 0.43 0.00 0.00 31.60 32.32 1lru h MET 38 CO 0.07 0.27 -0.27 1.88 -0.40 0.00 0.00 176.91 178.46 1lru h TYR 39 N 0.42 0.90 -0.69 1.39 0.99 -0.99 -0.63 116.97 118.36 1lru h TYR 39 Ca 0.23 -0.22 -0.04 0.00 2.00 0.00 0.00 58.73 60.70 1lru h TYR 39 Cb 0.21 -0.21 -0.03 0.00 1.00 0.00 0.00 36.73 37.70 1lru h TYR 39 CO -0.13 0.96 0.27 0.00 -0.00 0.00 0.00 178.16 179.25 1lru h ALA 40 N 1.03 1.17 -0.01 3.88 0.00 -0.18 -2.51 119.26 122.65 1lru h ALA 40 Ca 0.08 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1lru h ALA 40 Cb 0.79 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1lru h ALA 40 CO 0.07 0.60 -0.19 0.39 0.00 0.00 0.00 179.25 180.12 1lru n GLU 41 N -4.29 0.69 -3.21 0.00 -0.58 -0.16 -4.96 120.64 108.14 1lru n GLU 41 Ca 0.06 -0.32 -0.15 0.00 -0.42 0.00 0.00 57.16 56.33 1lru n GLU 41 Cb 0.18 -1.49 0.07 0.00 -0.57 0.00 0.00 31.44 29.63 1lru n GLU 41 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 1lru n GLU 42 N -0.87 -5.61 -3.87 3.49 1.02 -0.38 -5.04 120.64 109.38 1lru n GLU 42 Ca 0.13 0.70 -0.23 0.00 -0.02 0.00 0.00 57.16 57.74 1lru n GLU 42 Cb 0.31 -5.29 -0.05 0.00 -0.02 0.00 0.00 31.44 26.39 1lru n GLU 42 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1lru s GLY 43 N -4.03 2.14 0.00 0.62 0.00 -0.39 -5.03 107.32 100.63 1lru s GLY 43 Ca 0.05 -1.94 0.15 0.00 0.00 0.00 0.00 44.72 42.99 1lru s GLY 43 CO 0.60 -1.77 1.01 0.29 0.00 0.00 0.00 173.10 173.23 1lru n ILE 44 N -1.36 0.11 -3.50 0.90 -5.35 -1.26 -4.65 119.36 104.24 1lru n ILE 44 Ca 0.00 -0.55 -0.09 0.00 -0.27 0.00 0.00 62.75 61.84 1lru n ILE 44 Cb 0.62 1.22 -0.02 0.00 -1.74 0.00 0.00 39.64 39.72 1lru n ILE 44 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1lru s GLY 45 N -1.20 -0.46 -0.25 3.28 0.00 -1.26 -1.04 107.32 106.39 1lru s GLY 45 Ca 0.19 1.07 -0.19 0.00 0.00 0.00 0.00 44.72 45.79 1lru s GLY 45 CO 0.19 0.38 0.64 -2.27 0.00 0.00 0.00 173.10 172.04 1lru s LEU 46 N -2.38 -0.60 -0.06 0.66 1.98 0.53 -4.98 118.68 113.84 1lru s LEU 46 Ca 0.04 1.33 -0.02 0.00 -2.89 0.00 0.00 54.13 52.60 1lru s LEU 46 Cb -0.01 2.18 -0.04 0.00 0.66 0.00 0.00 46.19 48.99 1lru s LEU 46 CO -0.08 -0.23 0.05 0.00 -1.89 0.00 0.00 176.35 174.21 1lru s ALA 47 N 0.92 3.49 0.31 5.97 0.00 -1.26 -1.03 121.76 130.17 1lru s ALA 47 Ca -0.05 -0.81 0.07 0.00 0.00 0.00 0.00 51.96 51.17 1lru s ALA 47 Cb -0.05 -1.59 0.76 0.00 0.00 0.00 0.00 23.12 22.24 1lru s ALA 47 CO -0.08 0.64 1.78 0.00 0.00 0.00 0.00 175.76 178.10 1lru h ALA 48 N 4.68 1.71 -0.55 0.00 0.00 -1.45 0.01 119.26 123.66 1lru h ALA 48 Ca -0.51 0.07 0.16 0.00 0.00 0.00 0.00 54.91 54.64 1lru h ALA 48 Cb 1.19 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.88 1lru h ALA 48 CO 0.58 -0.08 0.48 1.15 0.00 0.00 0.00 179.25 181.38 1lru h THR 49 N 0.75 0.49 0.00 0.00 2.02 -1.63 -1.14 112.91 113.41 1lru h THR 49 Ca 0.57 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.75 1lru h THR 49 Cb 0.92 0.64 0.00 0.00 -1.74 0.00 0.00 68.15 67.97 1lru h THR 49 CO -0.37 0.00 0.00 1.56 0.37 0.00 0.00 175.52 177.08 1lru h GLN 50 N 0.00 0.00 -0.22 6.66 4.20 -1.26 -3.19 115.11 121.30 1lru h GLN 50 Ca 0.26 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.88 1lru h GLN 50 Cb 1.22 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 28.94 1lru h GLN 50 CO -0.00 0.00 -0.16 1.33 -0.67 0.00 0.00 178.83 179.32 1lru n VAL 51 N -2.80 2.36 -1.88 -0.54 0.24 -0.47 -0.62 118.33 114.63 1lru n VAL 51 Ca 0.04 -2.71 -0.15 0.00 -2.04 0.00 0.00 64.34 59.48 1lru n VAL 51 Cb 0.44 -0.28 -0.04 0.00 -1.47 0.00 0.00 33.84 32.49 1lru n VAL 51 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 1lru n ASP 52 N -1.08 -4.75 -4.24 -1.34 2.03 -1.20 -4.87 116.55 101.10 1lru n ASP 52 Ca 0.26 0.18 -0.36 0.00 0.52 0.00 0.00 54.79 55.39 1lru n ASP 52 Cb 0.89 -3.75 -0.13 0.00 -0.72 0.00 0.00 41.12 37.41 1lru n ASP 52 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1lru s ILE 53 N -2.68 3.43 -1.08 5.18 1.01 -0.96 -5.02 121.20 121.08 1lru s ILE 53 Ca 0.00 -1.18 -0.03 0.00 0.00 0.00 0.00 60.65 59.44 1lru s ILE 53 Cb 0.00 -2.92 0.30 0.00 0.01 0.00 0.00 42.46 39.84 1lru s ILE 53 CO 0.00 -0.10 1.69 1.41 0.00 0.00 0.00 174.94 177.94 1lru n HIS 54 N 4.73 2.49 -4.08 3.97 8.25 -1.26 -1.91 115.22 127.42 1lru n HIS 54 Ca -0.13 -2.59 -0.13 0.00 -0.26 0.00 0.00 57.72 54.61 1lru n HIS 54 Cb 0.45 -1.30 -0.12 0.00 1.12 0.00 0.00 29.99 30.14 1lru n HIS 54 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 1lru s GLN 55 N -3.14 0.50 -0.90 -0.41 -0.21 -1.25 -1.02 119.66 113.22 1lru s GLN 55 Ca 0.36 -0.64 -0.24 0.00 0.02 0.00 0.00 55.36 54.85 1lru s GLN 55 Cb 0.11 -0.30 -0.02 0.00 1.00 0.00 0.00 33.01 33.80 1lru s GLN 55 CO 0.00 0.06 1.81 1.03 -2.12 0.00 0.00 175.29 176.07 1lru s ARG 56 N -1.29 2.81 -0.08 2.91 0.52 0.26 -4.55 118.95 119.53 1lru s ARG 56 Ca -0.08 -0.41 -0.04 0.00 -0.52 0.00 0.00 55.73 54.68 1lru s ARG 56 Cb -0.08 -5.06 0.04 0.00 0.52 0.00 0.00 34.95 30.36 1lru s ARG 56 CO 0.00 -3.04 0.18 0.42 0.02 0.00 0.00 175.30 172.89 1lru s ILE 57 N 8.74 -0.04 0.04 1.52 1.01 -1.26 -1.14 121.20 130.07 1lru s ILE 57 Ca 0.64 0.14 0.02 0.00 0.00 0.00 0.00 60.65 61.45 1lru s ILE 57 Cb -0.06 -0.29 -0.02 0.00 0.01 0.00 0.00 42.46 42.10 1lru s ILE 57 CO -0.01 0.06 -0.08 -0.63 0.00 0.00 0.00 174.94 174.27 1lru s ILE 58 N 1.04 0.60 -0.02 2.92 1.01 -0.35 -1.34 121.20 125.06 1lru s ILE 58 Ca -0.08 -1.04 0.02 0.00 0.00 0.00 0.00 60.65 59.56 1lru s ILE 58 Cb -0.10 -0.64 0.00 0.00 0.01 0.00 0.00 42.46 41.74 1lru s ILE 58 CO -0.06 -0.32 -0.07 -0.69 0.00 0.00 0.00 174.94 173.79 1lru s VAL 59 N -1.26 0.66 0.04 2.92 1.01 -0.19 -1.50 120.40 122.07 1lru s VAL 59 Ca -0.08 -0.30 -0.05 0.00 0.00 0.00 0.00 61.98 61.55 1lru s VAL 59 Cb -0.09 -0.59 -0.01 0.00 0.00 0.00 0.00 36.38 35.68 1lru s VAL 59 CO 0.01 0.21 0.09 -0.63 0.00 0.00 0.00 175.10 174.78 1lru s ILE 60 N 0.20 0.14 -0.32 2.22 1.01 0.54 -0.34 121.20 124.65 1lru s ILE 60 Ca -0.03 -1.12 0.02 0.00 0.00 0.00 0.00 60.65 59.52 1lru s ILE 60 Cb -0.08 -0.92 0.19 0.00 0.01 0.00 0.00 42.46 41.67 1lru s ILE 60 CO 0.00 -0.62 0.70 -0.62 0.00 0.00 0.00 174.94 174.41 1lru s ASP 61 N -2.16 -1.33 0.04 3.58 -1.08 -0.20 -0.95 116.67 114.56 1lru s ASP 61 Ca -0.04 -0.04 0.23 0.00 -0.52 0.00 0.00 52.55 52.18 1lru s ASP 61 Cb -0.01 1.80 0.16 0.00 -1.46 0.00 0.00 42.92 43.41 1lru s ASP 61 CO -0.05 -0.22 1.14 0.52 0.52 0.00 0.00 175.17 177.08 1lru n VAL 62 N 5.08 0.12 -1.47 1.11 0.31 -1.26 -4.52 118.33 117.69 1lru n VAL 62 Ca 0.07 -0.15 -0.38 0.00 -0.01 0.00 0.00 64.34 63.87 1lru n VAL 62 Cb 0.56 0.29 0.04 0.00 -0.91 0.00 0.00 33.84 33.82 1lru n VAL 62 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1lru n SER 63 N -1.79 -0.98 0.20 4.52 3.41 -1.26 -4.89 113.62 112.83 1lru n SER 63 Ca 0.03 0.74 0.07 0.00 -0.26 0.00 0.00 58.87 59.45 1lru n SER 63 Cb 0.40 -1.18 0.38 0.00 -0.26 0.00 0.00 64.21 63.55 1lru n SER 63 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1lru h GLU 64 N 0.25 0.00 -0.43 4.33 5.08 -2.00 -2.48 114.58 119.32 1lru h GLU 64 Ca -0.46 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.90 1lru h GLU 64 Cb 1.40 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.65 1lru h GLU 64 CO 0.47 0.33 0.00 0.09 -1.00 0.00 0.00 179.01 178.90 1lru n ASN 65 N -3.52 4.06 -3.99 1.42 3.02 -1.26 -4.99 115.26 110.00 1lru n ASN 65 Ca -0.00 -2.55 -0.28 0.00 -0.03 0.00 0.00 54.58 51.71 1lru n ASN 65 Cb 0.48 -0.48 -0.01 0.00 -0.61 0.00 0.00 39.78 39.15 1lru n ASN 65 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1lru n ARG 66 N 0.38 -3.66 -0.62 3.52 1.74 -0.94 -4.90 116.66 112.18 1lru n ARG 66 Ca 0.21 0.44 0.05 0.00 -0.77 0.00 0.00 57.85 57.78 1lru n ARG 66 Cb 0.79 -4.82 0.10 0.00 -1.02 0.00 0.00 32.46 27.51 1lru n ARG 66 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 1lru n ASP 67 N -2.90 1.34 -3.80 0.55 5.68 -1.26 -4.98 116.55 111.17 1lru n ASP 67 Ca -0.18 -2.82 -0.29 0.00 -0.50 0.00 0.00 54.79 51.00 1lru n ASP 67 Cb 0.62 -0.37 -0.15 0.00 -1.14 0.00 0.00 41.12 40.07 1lru n ASP 67 CO 0.00 0.00 0.00 -1.61 -1.33 0.00 0.00 177.20 174.26 1lru s GLU 68 N -1.68 0.94 -0.09 0.11 0.41 -1.26 -5.09 118.70 112.04 1lru s GLU 68 Ca 0.27 -0.96 -0.16 0.00 -0.41 0.00 0.00 54.97 53.71 1lru s GLU 68 Cb 0.26 -2.23 -0.05 0.00 -1.78 0.00 0.00 34.13 30.34 1lru s GLU 68 CO -0.05 -0.82 0.39 1.03 -0.49 0.00 0.00 175.26 175.32 1lru s ARG 69 N 1.58 4.16 -0.04 1.61 0.52 -1.26 -4.26 118.95 121.26 1lru s ARG 69 Ca 0.04 0.32 0.03 0.00 -0.52 0.00 0.00 55.73 55.60 1lru s ARG 69 Cb -0.18 -3.36 0.00 0.00 0.52 0.00 0.00 34.95 31.94 1lru s ARG 69 CO -0.16 0.36 -0.13 -1.17 0.02 0.00 0.00 175.30 174.22 1lru s LEU 70 N 0.02 1.80 -0.09 2.53 2.96 -0.13 -5.01 118.68 120.76 1lru s LEU 70 Ca 0.22 -0.27 0.04 0.00 -0.22 0.00 0.00 54.13 53.90 1lru s LEU 70 Cb -0.15 -0.77 -0.00 0.00 0.50 0.00 0.00 46.19 45.77 1lru s LEU 70 CO 0.09 0.09 -0.24 -0.69 -1.32 0.00 0.00 176.35 174.28 1lru s VAL 71 N 0.25 2.09 -0.31 1.68 1.01 -1.26 -0.34 120.40 123.52 1lru s VAL 71 Ca -0.06 -1.02 0.01 0.00 0.00 0.00 0.00 61.98 60.91 1lru s VAL 71 Cb -0.11 -1.78 0.09 0.00 0.00 0.00 0.00 36.38 34.58 1lru s VAL 71 CO 0.02 0.56 0.06 -0.76 0.00 0.00 0.00 175.10 174.98 1lru s LEU 72 N 0.21 3.06 -0.16 3.92 1.43 -0.56 -4.41 118.68 122.17 1lru s LEU 72 Ca -0.15 -1.73 -0.06 0.00 -1.03 0.00 0.00 54.13 51.16 1lru s LEU 72 Cb -0.17 -1.14 -0.04 0.00 0.03 0.00 0.00 46.19 44.87 1lru s LEU 72 CO 0.08 -0.38 0.06 -0.63 0.23 0.00 0.00 176.35 175.70 1lru s ILE 73 N 1.37 4.76 -1.44 -0.59 1.01 -0.94 -1.22 121.20 124.16 1lru s ILE 73 Ca 0.08 -0.05 -0.08 0.00 0.00 0.00 0.00 60.65 60.59 1lru s ILE 73 Cb -0.18 -3.11 0.05 0.00 0.01 0.00 0.00 42.46 39.22 1lru s ILE 73 CO -0.17 0.50 0.89 0.59 0.00 0.00 0.00 174.94 176.75 1lru n ASN 74 N 3.15 -3.53 -4.73 3.58 4.13 -0.30 -1.56 115.26 115.99 1lru n ASN 74 Ca -0.17 -0.78 -0.37 0.00 1.68 0.00 0.00 54.58 54.94 1lru n ASN 74 Cb 0.53 -4.02 0.07 0.00 -1.54 0.00 0.00 39.78 34.81 1lru n ASN 74 CO 0.00 0.00 0.00 -2.16 0.28 0.00 0.00 177.26 175.38 1lru s PRO 75 N -6.36 2.58 -0.04 3.52 0.04 -1.26 -4.59 135.00 128.90 1lru s PRO 75 Ca 0.41 2.04 -0.01 0.00 0.04 0.00 0.00 61.00 63.47 1lru s PRO 75 Cb -0.20 -1.85 0.03 0.00 0.04 0.00 0.00 34.50 32.51 1lru s PRO 75 CO 0.82 -1.57 0.04 -2.00 0.04 0.00 0.00 177.00 174.33 1lru s GLU 76 N -3.39 0.05 -0.45 4.56 2.12 0.26 -4.94 118.70 116.91 1lru s GLU 76 Ca 0.82 0.27 -0.29 0.00 0.36 0.00 0.00 54.97 56.14 1lru s GLU 76 Cb -0.37 -0.51 0.01 0.00 0.26 0.00 0.00 34.13 33.53 1lru s GLU 76 CO 0.39 -0.27 1.36 -1.17 -0.54 0.00 0.00 175.26 175.03 1lru s LEU 77 N 1.79 3.56 -0.09 2.70 2.96 -1.26 -0.42 118.68 127.91 1lru s LEU 77 Ca 0.00 0.65 -0.26 0.00 -0.22 0.00 0.00 54.13 54.31 1lru s LEU 77 Cb -0.12 -3.45 -0.28 0.00 0.50 0.00 0.00 46.19 42.84 1lru s LEU 77 CO -0.03 -1.46 0.86 -0.07 -1.32 0.00 0.00 176.35 174.33 1lru h LEU 78 N 12.21 0.21 -7.92 -0.68 3.38 -0.47 -3.49 115.31 118.55 1lru h LEU 78 Ca -0.27 -0.95 -0.01 0.00 0.09 0.00 0.00 57.88 56.74 1lru h LEU 78 Cb 1.09 -0.07 -0.09 0.00 0.09 0.00 0.00 40.66 41.69 1lru h LEU 78 CO 1.11 1.14 0.02 -1.61 0.09 0.00 0.00 178.44 179.20 1lru s GLU 79 N -2.44 1.52 0.19 1.13 2.02 -0.81 -4.97 118.70 115.34 1lru s GLU 79 Ca -0.16 -1.01 -0.19 0.00 0.02 0.00 0.00 54.97 53.62 1lru s GLU 79 Cb -0.01 0.52 0.04 0.00 0.10 0.00 0.00 34.13 34.78 1lru s GLU 79 CO 0.75 -0.65 0.54 -1.59 0.02 0.00 0.00 175.26 174.33 1lru s LYS 80 N -3.93 1.36 -0.03 1.61 -2.85 -1.26 0.17 119.74 114.81 1lru s LYS 80 Ca 0.14 -0.77 -0.29 0.00 -1.00 0.00 0.00 55.97 54.05 1lru s LYS 80 Cb -0.02 0.54 0.10 0.00 -2.06 0.00 0.00 37.83 36.39 1lru s LYS 80 CO 0.03 -0.58 0.87 -1.54 0.10 0.00 0.00 175.35 174.23 1lru s SER 81 N -2.84 -0.41 0.13 0.03 1.04 -0.24 -4.96 113.70 106.45 1lru s SER 81 Ca 0.07 0.17 0.00 0.00 0.48 0.00 0.00 55.95 56.67 1lru s SER 81 Cb -0.01 0.40 0.00 0.00 0.10 0.00 0.00 66.02 66.51 1lru s SER 81 CO -0.05 -0.58 0.00 0.61 0.98 0.00 0.00 173.24 174.20 1lru n GLY 82 N 0.10 -2.09 3.20 7.32 0.00 -1.26 -1.21 105.19 111.24 1lru n GLY 82 Ca -0.11 -1.41 -0.13 0.00 0.00 0.00 0.00 46.02 44.37 1lru n GLY 82 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1lru s GLU 83 N -1.06 0.39 0.00 1.61 8.01 -1.26 -3.08 118.70 123.31 1lru s GLU 83 Ca 0.00 0.36 0.00 0.00 0.01 0.00 0.00 54.97 55.34 1lru s GLU 83 Cb 0.00 0.19 0.00 0.00 -4.31 0.00 0.00 34.13 30.01 1lru s GLU 83 CO 0.00 -0.06 0.00 0.25 0.01 0.00 0.00 175.26 175.46 1lru n THR 84 N 2.75 0.00 0.00 3.63 -2.24 0.12 -4.53 114.28 114.01 1lru n THR 84 Ca -0.14 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 1lru n THR 84 Cb 0.58 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.81 1lru n THR 84 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1lru n GLY 85 N 0.00 1.91 3.23 3.38 0.00 -1.26 -0.87 105.19 111.57 1lru n GLY 85 Ca 0.00 0.15 -0.13 0.00 0.00 0.00 0.00 46.02 46.04 1lru n GLY 85 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1lru s ILE 86 N -0.36 0.70 -0.66 -0.61 -4.36 -1.26 -4.94 121.20 109.72 1lru s ILE 86 Ca 0.00 -1.97 -0.27 0.00 -0.26 0.00 0.00 60.65 58.15 1lru s ILE 86 Cb 0.00 -2.01 0.00 0.00 1.25 0.00 0.00 42.46 41.70 1lru s ILE 86 CO 0.00 -0.57 1.61 -1.61 0.24 0.00 0.00 174.94 174.61 1lru s GLU 87 N -3.89 2.88 0.18 0.37 2.02 -1.26 -3.36 118.70 115.64 1lru s GLU 87 Ca 0.21 0.27 0.02 0.00 0.02 0.00 0.00 54.97 55.49 1lru s GLU 87 Cb 0.06 -4.29 -0.04 0.00 0.10 0.00 0.00 34.13 29.96 1lru s GLU 87 CO 0.02 -2.47 0.33 -1.83 0.02 0.00 0.00 175.26 171.33 1lru s GLU 88 N 6.46 3.46 0.39 1.61 -1.05 -0.13 -4.63 118.70 124.81 1lru s GLU 88 Ca 0.54 -0.56 0.08 0.00 -0.15 0.00 0.00 54.97 54.88 1lru s GLU 88 Cb -0.11 -2.91 -0.06 0.00 -0.44 0.00 0.00 34.13 30.61 1lru s GLU 88 CO 0.19 0.47 0.09 0.20 0.95 0.00 0.00 175.26 177.15 1lru s GLY 89 N -3.37 2.32 -0.04 -3.83 0.00 -1.26 -1.82 107.32 99.31 1lru s GLY 89 Ca 0.35 -2.13 -0.03 0.00 0.00 0.00 0.00 44.72 42.91 1lru s GLY 89 CO 0.29 -1.97 0.10 0.00 0.00 0.00 0.00 173.10 171.53 1lru h LEU 91 N 6.61 0.85 0.00 0.00 3.38 -1.96 -1.48 115.31 122.71 1lru h LEU 91 Ca -0.34 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.55 1lru h LEU 91 Cb 1.17 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 41.70 1lru h LEU 91 CO 0.44 0.72 0.00 -1.20 0.09 0.00 0.00 178.44 178.49 1lru n SER 92 N -4.34 0.00 -3.22 -0.43 7.64 -1.26 -3.67 113.62 108.34 1lru n SER 92 Ca 0.06 0.02 -0.24 0.00 1.01 0.00 0.00 58.87 59.72 1lru n SER 92 Cb 0.13 -0.29 -0.06 0.00 -1.01 0.00 0.00 64.21 62.97 1lru n SER 92 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 1lru n ILE 93 N -1.29 0.89 -0.53 0.44 5.41 -0.56 -2.07 119.36 121.65 1lru n ILE 93 Ca 0.09 -4.73 -0.25 0.00 1.00 0.00 0.00 62.75 58.86 1lru n ILE 93 Cb 0.16 -1.57 -0.05 0.00 -0.71 0.00 0.00 39.64 37.47 1lru n ILE 93 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 1lru n PRO 94 N 0.75 0.00 -1.02 0.38 -0.02 -1.24 -2.39 135.00 131.46 1lru n PRO 94 Ca 0.26 0.00 -0.01 0.00 -2.02 0.00 0.00 63.50 61.73 1lru n PRO 94 Cb 0.50 -0.63 -0.00 0.00 -0.02 0.00 0.00 33.50 33.35 1lru n PRO 94 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1lru n GLU 95 N 3.08 -1.82 -3.98 -0.52 1.02 -1.26 -4.73 120.64 112.44 1lru n GLU 95 Ca 0.23 0.49 -0.37 0.00 -0.02 0.00 0.00 57.16 57.49 1lru n GLU 95 Cb -0.02 -4.86 -0.07 0.00 -0.02 0.00 0.00 31.44 26.47 1lru n GLU 95 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 1lru s GLN 96 N -1.90 3.37 0.02 3.49 -1.52 -1.00 -5.11 119.66 117.00 1lru s GLN 96 Ca 0.00 -0.19 0.02 0.00 -1.95 0.00 0.00 55.36 53.24 1lru s GLN 96 Cb 0.00 -3.11 -0.01 0.00 -0.22 0.00 0.00 33.01 29.66 1lru s GLN 96 CO 0.00 0.75 -0.06 1.03 -0.25 0.00 0.00 175.29 176.76 1lru s ARG 97 N -0.96 0.44 -0.10 2.91 0.52 -1.26 -4.14 118.95 116.37 1lru s ARG 97 Ca 0.14 -0.45 -0.30 0.00 -0.52 0.00 0.00 55.73 54.60 1lru s ARG 97 Cb -0.12 -0.32 0.09 0.00 0.52 0.00 0.00 34.95 35.12 1lru s ARG 97 CO 0.03 0.07 0.77 0.00 0.02 0.00 0.00 175.30 176.20 1lru s ALA 98 N -0.73 -1.82 0.22 2.13 0.00 -0.76 -4.88 121.76 115.93 1lru s ALA 98 Ca -0.04 1.44 -0.30 0.00 0.00 0.00 0.00 51.96 53.06 1lru s ALA 98 Cb -0.06 -0.28 -0.08 0.00 0.00 0.00 0.00 23.12 22.70 1lru s ALA 98 CO 0.00 -0.35 1.04 -1.17 0.00 0.00 0.00 175.76 175.28 1lru s LEU 99 N -1.04 4.55 -0.02 0.00 0.20 -1.24 -0.96 118.68 120.16 1lru s LEU 99 Ca -0.08 2.07 0.01 0.00 0.69 0.00 0.00 54.13 56.82 1lru s LEU 99 Cb -0.01 -3.61 0.01 0.00 -0.43 0.00 0.00 46.19 42.16 1lru s LEU 99 CO 0.07 -0.08 -0.04 -0.69 -0.29 0.00 0.00 176.35 175.32 1lru s VAL 100 N -0.73 0.44 0.10 1.68 1.01 -1.21 -4.95 120.40 116.73 1lru s VAL 100 Ca 0.45 -0.14 -0.31 0.00 0.00 0.00 0.00 61.98 61.99 1lru s VAL 100 Cb -0.28 -0.43 -0.09 0.00 0.00 0.00 0.00 36.38 35.58 1lru s VAL 100 CO 0.35 0.17 1.59 -2.16 0.00 0.00 0.00 175.10 175.05 1lru s PRO 101 N 0.48 4.22 0.25 2.72 0.04 -1.26 -4.25 135.00 137.20 1lru s PRO 101 Ca -0.06 2.30 0.04 0.00 0.04 0.00 0.00 61.00 63.32 1lru s PRO 101 Cb -0.09 -3.42 -0.05 0.00 0.04 0.00 0.00 34.50 30.97 1lru s PRO 101 CO -0.00 -0.66 0.00 1.03 0.04 0.00 0.00 177.00 177.41 1lru s ARG 102 N 2.01 1.41 0.29 4.56 1.81 -0.05 -4.98 118.95 123.99 1lru s ARG 102 Ca 0.71 -1.73 -0.24 0.00 -1.72 0.00 0.00 55.73 52.76 1lru s ARG 102 Cb -0.40 -0.70 -0.09 0.00 -0.45 0.00 0.00 34.95 33.31 1lru s ARG 102 CO 0.31 -0.10 0.86 0.00 -0.68 0.00 0.00 175.30 175.69 1lru s ALA 103 N -3.37 3.29 0.12 2.13 0.00 -1.26 0.16 121.76 122.82 1lru s ALA 103 Ca 0.30 0.39 -0.03 0.00 0.00 0.00 0.00 51.96 52.62 1lru s ALA 103 Cb 0.06 -3.04 -0.13 0.00 0.00 0.00 0.00 23.12 20.00 1lru s ALA 103 CO 0.10 0.23 1.27 1.49 0.00 0.00 0.00 175.76 178.86 1lru h GLU 104 N 3.26 0.33 -4.67 0.00 4.81 -1.20 -3.41 114.58 113.70 1lru h GLU 104 Ca -0.47 -0.41 -0.33 0.00 -0.13 0.00 0.00 59.36 58.02 1lru h GLU 104 Cb 1.19 0.13 -0.24 0.00 0.63 0.00 0.00 28.75 30.46 1lru h GLU 104 CO 0.65 1.11 -0.75 0.15 -0.73 0.00 0.00 179.01 179.44 1lru s LYS 105 N -3.09 0.59 0.03 1.92 1.02 -0.35 -3.81 119.74 116.06 1lru s LYS 105 Ca -0.05 -0.60 -0.04 0.00 0.02 0.00 0.00 55.97 55.30 1lru s LYS 105 Cb 0.09 -0.48 -0.01 0.00 -0.52 0.00 0.00 37.83 36.90 1lru s LYS 105 CO 0.86 0.11 0.06 0.14 -0.92 0.00 0.00 175.35 175.61 1lru s VAL 106 N -0.92 0.14 -0.07 3.17 -7.23 -0.40 -1.07 120.40 114.02 1lru s VAL 106 Ca -0.04 -1.12 0.01 0.00 -1.81 0.00 0.00 61.98 59.03 1lru s VAL 106 Cb -0.07 -0.83 0.02 0.00 0.56 0.00 0.00 36.38 36.06 1lru s VAL 106 CO 0.00 -0.62 -0.09 -0.75 -0.31 0.00 0.00 175.10 173.34 1lru s LYS 107 N -2.48 1.44 0.18 4.82 2.20 0.13 -0.46 119.74 125.57 1lru s LYS 107 Ca -0.06 -0.29 0.03 0.00 -0.36 0.00 0.00 55.97 55.29 1lru s LYS 107 Cb -0.02 -1.32 -0.05 0.00 -1.51 0.00 0.00 37.83 34.94 1lru s LYS 107 CO -0.04 -0.08 -0.04 0.96 -0.36 0.00 0.00 175.35 175.79 1lru s ILE 108 N 1.01 0.98 -0.02 5.43 -4.36 0.17 0.32 121.20 124.73 1lru s ILE 108 Ca -0.09 -2.03 0.06 0.00 -0.26 0.00 0.00 60.65 58.34 1lru s ILE 108 Cb -0.15 -2.07 -0.02 0.00 1.25 0.00 0.00 42.46 41.47 1lru s ILE 108 CO -0.00 -0.55 -0.21 -0.60 0.24 0.00 0.00 174.94 173.82 1lru s ARG 109 N -3.83 2.23 0.20 0.37 3.52 0.43 -1.56 118.95 120.31 1lru s ARG 109 Ca 0.22 -0.86 -0.07 0.00 -0.13 0.00 0.00 55.73 54.88 1lru s ARG 109 Cb 0.05 -2.17 0.03 0.00 -1.56 0.00 0.00 34.95 31.29 1lru s ARG 109 CO 0.04 0.58 0.39 0.00 -0.81 0.00 0.00 175.30 175.50 1lru n ALA 110 N 2.26 -0.88 -2.41 6.12 0.00 -1.00 0.93 120.51 125.52 1lru n ALA 110 Ca -0.16 -0.64 -0.30 0.00 0.00 0.00 0.00 53.44 52.34 1lru n ALA 110 Cb 0.52 0.51 -0.13 0.00 0.00 0.00 0.00 19.45 20.34 1lru n ALA 110 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1lru s LEU 111 N 0.00 2.43 0.00 0.00 1.43 -0.60 -2.11 118.68 119.82 1lru s LEU 111 Ca 0.08 -0.53 0.03 0.00 -1.03 0.00 0.00 54.13 52.67 1lru s LEU 111 Cb -0.02 -1.41 0.09 0.00 0.03 0.00 0.00 46.19 44.88 1lru s LEU 111 CO 0.06 0.24 0.66 -0.90 0.23 0.00 0.00 176.35 176.64 1lru n ASP 112 N 1.47 1.17 -0.30 2.29 5.75 -0.50 -2.20 116.55 124.23 1lru n ASP 112 Ca -0.17 -1.92 0.26 0.00 -0.01 0.00 0.00 54.79 52.95 1lru n ASP 112 Cb 0.52 -0.40 0.58 0.00 -1.03 0.00 0.00 41.12 40.79 1lru n ASP 112 CO 0.00 0.00 0.00 -0.09 -0.11 0.00 0.00 177.20 177.00 1lru h ARG 113 N 0.00 0.26 -0.15 0.11 2.43 -1.90 0.25 114.38 115.38 1lru h ARG 113 Ca -0.22 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.93 1lru h ARG 113 Cb 0.88 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.37 1lru h ARG 113 CO 0.26 0.17 0.00 -0.25 -1.51 0.00 0.00 179.97 178.65 1lru n ASP 114 N -4.48 1.58 -0.01 -3.80 8.00 -1.26 -4.84 116.55 111.74 1lru n ASP 114 Ca 0.24 -1.69 -0.00 0.00 0.71 0.00 0.00 54.79 54.05 1lru n ASP 114 Cb 0.95 -0.10 -0.00 0.00 -0.02 0.00 0.00 41.12 41.95 1lru n ASP 114 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1lru n GLY 115 N 1.11 0.43 3.71 0.44 0.00 0.87 -5.03 105.19 106.73 1lru n GLY 115 Ca 0.16 -0.68 -0.37 0.00 0.00 0.00 0.00 46.02 45.13 1lru n GLY 115 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lru s LYS 116 N -1.26 4.24 0.53 1.61 1.02 -1.26 -4.77 119.74 119.85 1lru s LYS 116 Ca 0.00 0.11 -0.21 0.00 0.02 0.00 0.00 55.97 55.89 1lru s LYS 116 Cb 0.00 -3.46 -0.05 0.00 -0.52 0.00 0.00 37.83 33.80 1lru s LYS 116 CO 0.00 0.16 1.24 -2.14 -0.92 0.00 0.00 175.35 173.70 1lru s PRO 117 N 0.70 3.31 0.17 -1.68 0.02 -1.26 -1.41 135.00 134.83 1lru s PRO 117 Ca 0.17 1.94 -0.21 0.00 0.02 0.00 0.00 61.00 62.92 1lru s PRO 117 Cb -0.13 -2.21 0.06 0.00 0.02 0.00 0.00 34.50 32.24 1lru s PRO 117 CO 0.05 -0.97 0.57 -0.59 -0.33 0.00 0.00 177.00 175.73 1lru s PHE 118 N -1.48 -0.42 0.04 6.54 -0.12 -0.90 -4.92 117.98 116.72 1lru s PHE 118 Ca 0.71 0.16 0.09 0.00 -0.05 0.00 0.00 56.93 57.83 1lru s PHE 118 Cb -0.33 0.50 -0.03 0.00 -0.63 0.00 0.00 43.02 42.54 1lru s PHE 118 CO 0.38 -0.86 -0.25 -1.21 -0.05 0.00 0.00 175.22 173.23 1lru s GLU 119 N -3.78 1.77 -0.00 1.99 2.02 -1.26 -2.38 118.70 117.05 1lru s GLU 119 Ca 0.03 -1.06 0.01 0.00 0.02 0.00 0.00 54.97 53.97 1lru s GLU 119 Cb -0.01 -1.91 -0.00 0.00 0.10 0.00 0.00 34.13 32.31 1lru s GLU 119 CO -0.10 0.50 -0.02 -1.17 0.02 0.00 0.00 175.26 174.48 1lru s LEU 120 N -1.14 1.99 -0.15 1.80 2.96 -0.60 -4.99 118.68 118.56 1lru s LEU 120 Ca 0.11 -0.04 0.02 0.00 -0.22 0.00 0.00 54.13 54.00 1lru s LEU 120 Cb -0.10 -0.10 0.01 0.00 0.50 0.00 0.00 46.19 46.50 1lru s LEU 120 CO 0.02 0.02 -0.20 -0.70 -1.32 0.00 0.00 176.35 174.17 1lru s GLU 121 N -0.03 2.89 0.15 1.98 -6.30 -1.26 -0.65 118.70 115.47 1lru s GLU 121 Ca 0.01 -0.80 0.05 0.00 -2.50 0.00 0.00 54.97 51.73 1lru s GLU 121 Cb -0.01 -2.39 -0.04 0.00 0.00 0.00 0.00 34.13 31.68 1lru s GLU 121 CO -0.00 -0.08 -0.11 0.00 0.02 0.00 0.00 175.26 175.09 1lru s ALA 122 N 0.99 1.54 0.11 6.30 0.00 0.40 -4.98 121.76 126.11 1lru s ALA 122 Ca -0.03 -1.49 -0.01 0.00 0.00 0.00 0.00 51.96 50.42 1lru s ALA 122 Cb -0.15 0.01 0.01 0.00 0.00 0.00 0.00 23.12 22.99 1lru s ALA 122 CO -0.05 -0.05 0.17 -0.40 0.00 0.00 0.00 175.76 175.43 1lru n ASP 123 N -0.14 -0.48 0.00 0.00 5.75 -1.26 -1.27 116.55 119.15 1lru n ASP 123 Ca -0.10 -1.58 0.00 0.00 -0.01 0.00 0.00 54.79 53.10 1lru n ASP 123 Cb 0.60 0.87 0.00 0.00 -1.03 0.00 0.00 41.12 41.56 1lru n ASP 123 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1lru n GLY 124 N -0.18 2.78 0.07 6.12 0.00 -1.25 -2.98 105.19 109.75 1lru n GLY 124 Ca -0.00 -0.40 -0.13 0.00 0.00 0.00 0.00 46.02 45.49 1lru n GLY 124 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1lru h LEU 125 N 0.00 -0.03 -0.97 0.99 5.85 -1.99 -3.10 115.31 116.06 1lru h LEU 125 Ca 0.00 -0.40 0.29 0.00 0.84 0.00 0.00 57.88 58.61 1lru h LEU 125 Cb 0.00 0.01 -0.14 0.00 0.37 0.00 0.00 40.66 40.90 1lru h LEU 125 CO 0.00 0.38 0.48 0.25 -0.34 0.00 0.00 178.44 179.22 1lru h LEU 126 N -0.46 0.41 -0.32 2.25 5.85 -1.98 0.27 115.31 121.33 1lru h LEU 126 Ca -0.00 0.18 -0.08 0.00 0.84 0.00 0.00 57.88 58.82 1lru h LEU 126 Cb 0.43 0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.60 1lru h LEU 126 CO 0.01 -0.10 -0.11 0.00 -0.34 0.00 0.00 178.44 177.90 1lru h ALA 127 N 1.81 0.45 -0.32 1.25 0.00 -1.53 -1.13 119.26 119.78 1lru h ALA 127 Ca 0.67 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 55.25 1lru h ALA 127 Cb 1.45 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.11 1lru h ALA 127 CO -0.60 0.31 0.15 0.82 0.00 0.00 0.00 179.25 179.94 1lru h ILE 128 N 0.41 1.16 -0.66 0.00 2.04 -0.73 -2.85 117.51 116.89 1lru h ILE 128 Ca 0.08 -0.48 -0.01 0.00 1.00 0.00 0.00 64.86 65.45 1lru h ILE 128 Cb 0.62 0.88 -0.03 0.00 -0.74 0.00 0.00 36.82 37.55 1lru h ILE 128 CO 0.04 0.17 0.39 0.00 0.00 0.00 0.00 178.15 178.75 1lru h ILE 130 N 0.90 1.15 -0.14 0.00 2.04 -1.13 -2.16 117.51 118.16 1lru h ILE 130 Ca 0.24 -0.36 -0.21 0.00 1.00 0.00 0.00 64.86 65.53 1lru h ILE 130 Cb -0.02 0.01 0.00 0.00 -0.74 0.00 0.00 36.82 36.08 1lru h ILE 130 CO -0.04 0.19 -0.74 1.56 0.00 0.00 0.00 178.15 179.12 1lru h GLN 131 N 1.04 0.66 -0.12 2.37 4.20 -1.24 -2.38 115.11 119.65 1lru h GLN 131 Ca 0.32 -0.53 0.03 0.00 0.06 0.00 0.00 58.65 58.54 1lru h GLN 131 Cb 0.01 0.10 -0.03 0.00 0.30 0.00 0.00 27.48 27.86 1lru h GLN 131 CO -0.09 1.14 -0.07 1.25 -0.67 0.00 0.00 178.83 180.40 1lru h HIS 132 N 0.46 -0.15 0.00 2.96 2.76 -1.10 0.28 115.15 120.36 1lru h HIS 132 Ca -0.04 0.01 -0.09 0.00 -2.20 0.00 0.00 60.37 58.05 1lru h HIS 132 Cb 1.34 0.09 -0.01 0.00 1.55 0.00 0.00 27.41 30.38 1lru h HIS 132 CO 0.07 -0.10 -0.45 0.93 -1.30 0.00 0.00 177.93 177.08 1lru h GLU 133 N -0.06 0.00 0.00 5.26 4.39 -1.44 -2.74 114.58 119.99 1lru h GLU 133 Ca 0.07 0.00 -0.14 0.00 0.34 0.00 0.00 59.36 59.63 1lru h GLU 133 Cb 0.16 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 28.79 1lru h GLU 133 CO -0.16 0.45 -0.67 0.52 -1.16 0.00 0.00 179.01 177.99 1lru h MET 134 N 0.00 0.00 -0.06 2.33 2.86 -0.97 -3.12 114.93 115.97 1lru h MET 134 Ca -0.00 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1lru h MET 134 Cb 0.87 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.53 1lru h MET 134 CO 0.06 0.67 0.02 -0.44 1.06 0.00 0.00 176.91 178.28 1lru h ASP 135 N 0.00 0.08 -0.69 1.22 3.32 -0.66 -3.20 116.42 116.49 1lru h ASP 135 Ca -0.01 -0.16 0.13 0.00 0.02 0.00 0.00 57.03 57.02 1lru h ASP 135 Cb 1.47 -0.02 -0.13 0.00 0.22 0.00 0.00 39.33 40.87 1lru h ASP 135 CO 0.09 0.21 -0.24 0.45 -1.72 0.00 0.00 179.24 178.03 1lru h HIS 136 N -0.06 -0.58 0.00 4.55 3.86 -1.32 0.16 115.15 121.76 1lru h HIS 136 Ca 0.02 0.07 0.00 0.00 -1.16 0.00 0.00 60.37 59.30 1lru h HIS 136 Cb 0.16 0.36 0.00 0.00 1.06 0.00 0.00 27.41 28.99 1lru h HIS 136 CO -0.02 -0.34 0.02 1.28 0.86 0.00 0.00 177.93 179.73 1lru n LEU 137 N -5.47 0.37 -0.47 2.43 4.77 -1.21 -0.03 117.00 117.39 1lru n LEU 137 Ca 0.08 0.66 0.06 0.00 -0.03 0.00 0.00 56.01 56.78 1lru n LEU 137 Cb 0.37 -0.70 0.14 0.00 -2.33 0.00 0.00 43.42 40.90 1lru n LEU 137 CO 0.00 -0.79 0.61 0.55 -1.33 0.00 0.00 177.39 176.43 1lru n VAL 138 N -2.00 1.48 -2.32 4.08 3.14 0.52 -0.58 118.33 122.64 1lru n VAL 138 Ca -0.01 -1.43 -0.10 0.00 -2.96 0.00 0.00 64.34 59.84 1lru n VAL 138 Cb 0.05 0.19 0.00 0.00 -1.06 0.00 0.00 33.84 33.01 1lru n VAL 138 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1lru n GLY 139 N -0.29 0.01 3.38 7.55 0.00 0.96 -4.76 105.19 112.03 1lru n GLY 139 Ca 0.12 -0.44 -0.32 0.00 0.00 0.00 0.00 46.02 45.38 1lru n GLY 139 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1lru s LYS 140 N -4.67 2.56 0.29 1.61 2.20 -0.88 -4.51 119.74 116.33 1lru s LYS 140 Ca 0.04 -0.79 0.12 0.00 -0.36 0.00 0.00 55.97 54.98 1lru s LYS 140 Cb -0.02 -2.30 -0.05 0.00 -1.51 0.00 0.00 37.83 33.95 1lru s LYS 140 CO 0.05 0.49 -0.18 -0.51 -0.36 0.00 0.00 175.35 174.84 1lru s LEU 141 N -0.42 2.62 0.55 5.43 1.43 -1.26 -2.70 118.68 124.34 1lru s LEU 141 Ca 0.04 -1.03 0.31 0.00 -1.03 0.00 0.00 54.13 52.42 1lru s LEU 141 Cb -0.12 -1.11 1.63 0.00 0.03 0.00 0.00 46.19 46.62 1lru s LEU 141 CO 0.02 0.02 2.13 2.19 0.23 0.00 0.00 176.35 180.94 1lru h PHE 142 N 2.24 0.00 0.00 0.29 -5.15 -1.98 -1.78 116.94 110.55 1lru h PHE 142 Ca -0.40 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.37 1lru h PHE 142 Cb 1.26 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.43 1lru h PHE 142 CO 0.80 0.08 0.00 0.00 -2.00 0.00 0.00 178.31 177.19 1lru h MET 143 N 0.00 0.00 0.00 6.09 -0.00 -1.97 -2.89 114.93 116.16 1lru h MET 143 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 1lru h MET 143 Cb 0.26 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.86 1lru h MET 143 CO 0.01 0.00 0.00 -0.25 -0.00 0.00 0.00 176.91 176.67 1lru n ASP 144 N -3.06 0.63 -0.02 -0.10 8.00 -0.67 -1.45 116.55 119.87 1lru n ASP 144 Ca 0.01 0.72 0.13 0.00 0.71 0.00 0.00 54.79 56.36 1lru n ASP 144 Cb 0.35 -0.83 0.39 0.00 -0.02 0.00 0.00 41.12 41.01 1lru n ASP 144 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1lru n TYR 145 N -2.26 0.00 -2.95 1.24 4.02 -1.09 -4.94 117.16 111.19 1lru n TYR 145 Ca 0.00 0.00 -0.19 0.00 -0.01 0.00 0.00 57.90 57.70 1lru n TYR 145 Cb 0.14 -0.31 0.05 0.00 -0.02 0.00 0.00 39.34 39.19 1lru n TYR 145 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 1lru s LEU 146 N -2.93 3.31 0.69 7.72 1.43 -0.53 -5.02 118.68 123.35 1lru s LEU 146 Ca 0.14 -0.58 -0.12 0.00 -1.03 0.00 0.00 54.13 52.54 1lru s LEU 146 Cb 0.18 -2.14 0.01 0.00 0.03 0.00 0.00 46.19 44.27 1lru s LEU 146 CO 0.62 -1.17 1.07 -0.94 0.23 0.00 0.00 176.35 176.17 1lru s SER 147 N -4.54 5.26 0.24 2.29 1.04 -1.26 -4.82 113.70 111.90 1lru s SER 147 Ca 0.59 1.74 -0.05 0.00 0.48 0.00 0.00 55.95 58.71 1lru s SER 147 Cb -0.08 -2.51 0.37 0.00 0.10 0.00 0.00 66.02 63.90 1lru s SER 147 CO 0.37 -1.53 1.80 -0.65 0.98 0.00 0.00 173.24 174.22 1lru h PRO 148 N -0.49 0.71 -0.33 4.02 0.11 -1.99 0.30 132.00 134.34 1lru h PRO 148 Ca -0.45 -0.04 0.04 0.00 0.11 0.00 0.00 66.00 65.66 1lru h PRO 148 Cb 1.22 -0.16 -0.04 0.00 0.11 0.00 0.00 31.00 32.13 1lru h PRO 148 CO 0.55 0.47 0.12 1.25 -0.21 0.00 0.00 178.00 180.19 1lru h LEU 149 N 0.73 0.14 -0.54 2.35 6.46 -1.99 -0.10 115.31 122.36 1lru h LEU 149 Ca 0.38 0.03 -0.08 0.00 -0.12 0.00 0.00 57.88 58.09 1lru h LEU 149 Cb 0.35 0.02 -0.02 0.00 -0.73 0.00 0.00 40.66 40.27 1lru h LEU 149 CO -0.25 0.12 0.02 0.11 -0.62 0.00 0.00 178.44 177.82 1lru h LYS 150 N 0.27 0.94 -0.35 1.25 1.79 -1.74 -2.01 116.57 116.72 1lru h LYS 150 Ca 0.15 -0.29 -0.00 0.00 -2.18 0.00 0.00 60.65 58.33 1lru h LYS 150 Cb 0.11 -0.09 -0.02 0.00 -1.58 0.00 0.00 32.23 30.66 1lru h LYS 150 CO -0.15 0.94 0.22 1.96 -1.08 0.00 0.00 179.45 181.34 1lru h GLN 151 N 0.82 0.47 -0.44 3.15 4.20 -0.70 -1.85 115.11 120.76 1lru h GLN 151 Ca 0.15 -0.04 -0.04 0.00 0.06 0.00 0.00 58.65 58.79 1lru h GLN 151 Cb 0.51 -0.10 -0.02 0.00 0.30 0.00 0.00 27.48 28.17 1lru h GLN 151 CO 0.02 0.35 0.13 0.37 -0.67 0.00 0.00 178.83 179.03 1lru h GLN 152 N 0.46 0.70 -0.69 1.46 5.75 -0.96 -0.43 115.11 121.39 1lru h GLN 152 Ca 0.13 -0.16 0.00 0.00 -0.15 0.00 0.00 58.65 58.47 1lru h GLN 152 Cb -0.01 -0.10 -0.03 0.00 1.07 0.00 0.00 27.48 28.41 1lru h GLN 152 CO -0.02 0.68 0.45 0.00 -2.65 0.00 0.00 178.83 177.29 1lru h ARG 153 N 0.58 0.92 -0.08 1.69 3.08 -1.30 -1.74 114.38 117.53 1lru h ARG 153 Ca 0.14 -0.06 -0.02 0.00 0.07 0.00 0.00 59.98 60.11 1lru h ARG 153 Cb 0.29 -0.20 -0.00 0.00 0.08 0.00 0.00 29.97 30.13 1lru h ARG 153 CO -0.00 0.62 -0.04 0.82 -1.07 0.00 0.00 179.97 180.29 1lru h ILE 154 N 0.94 1.33 -0.42 2.04 2.04 -0.91 -2.99 117.51 119.55 1lru h ILE 154 Ca 0.25 -1.06 0.08 0.00 1.00 0.00 0.00 64.86 65.13 1lru h ILE 154 Cb -0.09 1.87 -0.07 0.00 -0.74 0.00 0.00 36.82 37.79 1lru h ILE 154 CO -0.05 0.29 -0.01 -0.09 0.00 0.00 0.00 178.15 178.29 1lru h ARG 155 N -0.22 0.09 0.23 2.37 2.43 -0.79 -2.26 114.38 116.24 1lru h ARG 155 Ca 0.02 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 1lru h ARG 155 Cb 0.49 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.99 1lru h ARG 155 CO 0.01 0.06 -0.40 1.96 -1.51 0.00 0.00 179.97 180.09 1lru h GLN 156 N 0.10 -0.64 -0.46 0.20 4.20 -1.31 -0.34 115.11 116.86 1lru h GLN 156 Ca 0.21 0.04 0.13 0.00 0.06 0.00 0.00 58.65 59.09 1lru h GLN 156 Cb 0.30 0.15 -0.02 0.00 0.30 0.00 0.00 27.48 28.20 1lru h GLN 156 CO -0.35 -0.43 0.43 0.87 -0.67 0.00 0.00 178.83 178.68 1lru h LYS 157 N -0.67 0.00 0.24 1.46 1.57 -1.36 0.27 116.57 118.08 1lru h LYS 157 Ca -0.02 0.00 -0.33 0.00 -1.87 0.00 0.00 60.65 58.42 1lru h LYS 157 Cb 0.62 0.00 0.04 0.00 0.08 0.00 0.00 32.23 32.97 1lru h LYS 157 CO -0.14 0.00 -1.45 0.28 -0.57 0.00 0.00 179.45 177.56 1lru h VAL 158 N 0.00 1.31 -0.12 0.50 2.07 -0.81 -2.68 116.25 116.52 1lru h VAL 158 Ca 0.22 -2.73 -0.02 0.00 0.82 0.00 0.00 66.70 64.99 1lru h VAL 158 Cb 1.07 3.03 -0.00 0.00 -1.52 0.00 0.00 31.29 33.86 1lru h VAL 158 CO -0.00 0.82 0.01 -0.33 0.02 0.00 0.00 177.57 178.09 1lru h GLU 159 N 0.15 0.20 -0.92 1.57 5.08 0.11 -1.20 114.58 119.57 1lru h GLU 159 Ca -0.24 -0.06 0.06 0.00 -1.00 0.00 0.00 59.36 58.11 1lru h GLU 159 Cb 2.15 -0.02 -0.06 0.00 0.50 0.00 0.00 28.75 31.32 1lru h GLU 159 CO 0.27 0.42 0.60 -0.22 -1.00 0.00 0.00 179.01 179.08 1lru h LYS 160 N -0.04 1.05 -0.35 2.33 3.64 -0.85 -0.59 116.57 121.75 1lru h LYS 160 Ca 0.04 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.33 1lru h LYS 160 Cb 0.33 -0.24 -0.02 0.00 -0.41 0.00 0.00 32.23 31.89 1lru h LYS 160 CO 0.00 0.69 0.14 -0.07 -2.27 0.00 0.00 179.45 177.95 1lru h LEU 161 N 1.08 0.48 -0.18 5.20 3.38 -1.11 -2.73 115.31 121.44 1lru h LEU 161 Ca 0.39 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.19 1lru h LEU 161 Cb 0.14 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.77 1lru h LEU 161 CO -0.14 0.52 0.00 0.44 0.09 0.00 0.00 178.44 179.35 1lru h ASP 162 N 0.42 0.00 -0.37 -0.43 3.32 -0.89 -3.01 116.42 115.46 1lru h ASP 162 Ca 0.12 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.17 1lru h ASP 162 Cb 0.18 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.73 1lru h ASP 162 CO -0.01 0.00 0.00 -1.14 -1.72 0.00 0.00 179.24 176.37 1lru n ARG 163 N -2.49 2.39 0.00 3.56 0.63 -0.26 -5.10 116.66 115.40 1lru n ARG 163 Ca 0.04 -1.55 0.00 0.00 -0.92 0.00 0.00 57.85 55.42 1lru n ARG 163 Cb 0.42 -1.55 0.00 0.00 0.45 0.00 0.00 32.46 31.78 1lru n ARG 163 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40