#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 5.04 0.07 -3.33 1.01 -1.26 -4.52 120.40 117.41 1lru s VAL 2 Ca 0.00 1.25 0.02 0.00 0.00 0.00 0.00 61.98 63.25 1lru s VAL 2 Cb 0.00 -3.97 -0.04 0.00 0.00 0.00 0.00 36.38 32.37 1lru s VAL 2 CO 0.00 0.17 0.14 -0.76 0.00 0.00 0.00 175.10 174.65 1lru s LEU 3 N 1.47 4.07 -0.18 3.92 1.43 -1.26 -5.04 118.68 123.09 1lru s LEU 3 Ca 0.31 0.12 -0.29 0.00 -1.03 0.00 0.00 54.13 53.24 1lru s LEU 3 Cb -0.16 -2.71 -0.01 0.00 0.03 0.00 0.00 46.19 43.34 1lru s LEU 3 CO 0.12 0.17 1.29 -1.58 0.23 0.00 0.00 176.35 176.59 1lru s GLN 4 N -2.46 4.17 -0.03 1.70 0.74 -1.26 -4.93 119.66 117.59 1lru s GLN 4 Ca 0.32 1.62 -0.29 0.00 0.05 0.00 0.00 55.36 57.06 1lru s GLN 4 Cb -0.13 -3.80 -0.03 0.00 1.10 0.00 0.00 33.01 30.16 1lru s GLN 4 CO 0.25 -0.79 0.94 0.08 -0.55 0.00 0.00 175.29 175.22 1lru s VAL 5 N 3.70 4.88 0.34 1.34 1.01 -1.26 -4.40 120.40 126.01 1lru s VAL 5 Ca 0.56 1.96 -0.25 0.00 0.00 0.00 0.00 61.98 64.25 1lru s VAL 5 Cb -0.21 -4.27 -0.10 0.00 0.00 0.00 0.00 36.38 31.79 1lru s VAL 5 CO 0.17 0.14 0.96 -0.76 0.00 0.00 0.00 175.10 175.61 1lru s LEU 6 N 1.18 4.28 0.18 3.92 1.43 0.85 -4.99 118.68 125.52 1lru s LEU 6 Ca 0.49 1.85 0.09 0.00 -1.03 0.00 0.00 54.13 55.53 1lru s LEU 6 Cb -0.20 -4.09 -0.04 0.00 0.03 0.00 0.00 46.19 41.89 1lru s LEU 6 CO 0.25 -0.15 -0.18 -1.00 0.23 0.00 0.00 176.35 175.49 1lru s HIS 7 N -1.68 1.86 0.57 0.29 3.76 -1.26 -4.26 115.29 114.57 1lru s HIS 7 Ca 0.52 -0.47 -0.20 0.00 -0.15 0.00 0.00 55.06 54.76 1lru s HIS 7 Cb -0.18 -0.91 -0.05 0.00 1.11 0.00 0.00 32.58 32.55 1lru s HIS 7 CO 0.23 0.37 1.19 0.44 -0.85 0.00 0.00 174.74 176.12 1lru n ILE 8 N 0.14 3.83 -0.99 0.60 -5.35 -0.78 -1.15 119.36 115.66 1lru n ILE 8 Ca -0.12 -0.50 -0.23 0.00 -0.27 0.00 0.00 62.75 61.63 1lru n ILE 8 Cb 0.58 -1.43 0.12 0.00 -1.74 0.00 0.00 39.64 37.17 1lru n ILE 8 CO 0.00 0.00 0.00 -0.81 -1.76 0.00 0.00 176.55 173.98 1lru n PRO 9 N -1.03 2.18 -1.52 6.28 -0.04 -1.26 -5.02 135.00 134.58 1lru n PRO 9 Ca 0.12 -2.62 -0.50 0.00 -0.04 0.00 0.00 63.50 60.46 1lru n PRO 9 Cb 0.45 -2.03 -0.06 0.00 -0.04 0.00 0.00 33.50 31.82 1lru n PRO 9 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1lru n ASP 10 N -0.78 2.49 0.31 3.54 4.64 -0.30 -4.82 116.55 121.63 1lru n ASP 10 Ca 0.52 0.54 0.20 0.00 -1.38 0.00 0.00 54.79 54.66 1lru n ASP 10 Cb 1.22 -1.30 1.07 0.00 -1.04 0.00 0.00 41.12 41.07 1lru n ASP 10 CO 0.00 0.00 0.00 -0.33 -0.82 0.00 0.00 177.20 176.05 1lru h GLU 11 N 11.68 0.00 0.00 -0.67 5.08 -1.99 -1.51 114.58 127.17 1lru h GLU 11 Ca -0.34 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.02 1lru h GLU 11 Cb 1.30 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.55 1lru h GLU 11 CO 1.00 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 179.01 1lru h ARG 12 N 0.00 0.00 0.00 2.33 3.08 -1.97 -0.66 114.38 117.16 1lru h ARG 12 Ca 0.01 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.06 1lru h ARG 12 Cb 0.09 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.14 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 -3.05 0.27 -1.23 3.04 4.77 -0.57 -2.64 117.00 117.59 1lru n LEU 13 Ca -0.01 0.54 0.11 0.00 -0.03 0.00 0.00 56.01 56.62 1lru n LEU 13 Cb 0.20 -0.48 0.29 0.00 -2.33 0.00 0.00 43.42 41.10 1lru n LEU 13 CO 0.24 -0.21 0.75 0.54 -1.33 0.00 0.00 177.39 177.38 1lru n ARG 14 N -1.77 2.54 -3.02 3.23 5.12 -0.25 -4.31 116.66 118.19 1lru n ARG 14 Ca 0.05 -2.40 -0.40 0.00 -1.93 0.00 0.00 57.85 53.17 1lru n ARG 14 Cb 0.29 -1.52 -0.05 0.00 -1.16 0.00 0.00 32.46 30.02 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 -1.12 4.38 -0.01 5.56 1.02 -1.08 -4.51 119.74 123.98 1lru s LYS 15 Ca 0.45 0.88 -0.30 0.00 0.02 0.00 0.00 55.97 57.01 1lru s LYS 15 Cb 0.23 -3.49 -0.03 0.00 -0.52 0.00 0.00 37.83 34.02 1lru s LYS 15 CO 0.30 -0.05 1.02 0.08 -0.92 0.00 0.00 175.35 175.78 1lru s VAL 16 N 1.21 4.72 0.29 3.17 1.01 -1.26 -3.80 120.40 125.74 1lru s VAL 16 Ca 0.37 1.96 -0.23 0.00 0.00 0.00 0.00 61.98 64.07 1lru s VAL 16 Cb -0.17 -4.26 -0.09 0.00 0.00 0.00 0.00 36.38 31.86 1lru s VAL 16 CO 0.16 0.12 0.85 0.00 0.00 0.00 0.00 175.10 176.24 1lru s ALA 17 N 1.22 3.29 0.20 5.51 0.00 0.04 -4.97 121.76 127.04 1lru s ALA 17 Ca 0.52 0.37 -0.03 0.00 0.00 0.00 0.00 51.96 52.82 1lru s ALA 17 Cb -0.22 -3.03 -0.05 0.00 0.00 0.00 0.00 23.12 19.82 1lru s ALA 17 CO 0.26 0.24 0.42 -1.59 0.00 0.00 0.00 175.76 175.09 1lru s LYS 18 N -2.08 3.59 0.80 0.00 0.00 -0.99 -4.73 119.74 116.33 1lru s LYS 18 Ca 0.48 -0.16 -0.14 0.00 0.00 0.00 0.00 55.97 56.14 1lru s LYS 18 Cb -0.17 -2.80 0.04 0.00 0.00 0.00 0.00 37.83 34.90 1lru s LYS 18 CO 0.22 0.38 0.90 -2.30 0.00 0.00 0.00 175.35 174.55 1lru n PRO 19 N -0.44 0.17 -2.89 1.78 -0.02 -1.26 -2.21 135.00 130.12 1lru n PRO 19 Ca -0.03 0.12 -0.41 0.00 -2.02 0.00 0.00 63.50 61.16 1lru n PRO 19 Cb 0.53 -2.19 -0.04 0.00 -0.02 0.00 0.00 33.50 31.78 1lru n PRO 19 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1lru s VAL 20 N -2.08 4.86 0.01 -1.45 1.01 -1.26 -4.74 120.40 116.75 1lru s VAL 20 Ca 0.69 1.74 -0.25 0.00 0.00 0.00 0.00 61.98 64.16 1lru s VAL 20 Cb -0.30 -4.17 -0.15 0.00 0.00 0.00 0.00 36.38 31.76 1lru s VAL 20 CO 0.55 0.26 1.11 -0.33 0.00 0.00 0.00 175.10 176.69 1lru h GLU 21 N 6.40 -0.74 -2.90 2.72 4.39 -2.02 -3.46 114.58 118.96 1lru h GLU 21 Ca -0.42 0.05 -0.14 0.00 0.34 0.00 0.00 59.36 59.19 1lru h GLU 21 Cb 1.21 0.17 -0.26 0.00 -0.10 0.00 0.00 28.75 29.77 1lru h GLU 21 CO 0.74 -0.44 -0.34 -1.21 -1.16 0.00 0.00 179.01 176.60 1lru s GLU 22 N -4.59 0.37 -0.59 2.33 0.41 -1.26 -5.10 118.70 110.27 1lru s GLU 22 Ca -0.14 0.51 -0.27 0.00 -0.41 0.00 0.00 54.97 54.67 1lru s GLU 22 Cb 0.02 0.13 -0.01 0.00 -1.78 0.00 0.00 34.13 32.48 1lru s GLU 22 CO 0.45 -0.07 1.74 0.08 -0.49 0.00 0.00 175.26 176.96 1lru s VAL 23 N 0.45 3.46 0.32 2.63 1.01 -1.26 -4.89 120.40 122.12 1lru s VAL 23 Ca -0.02 0.31 0.01 0.00 0.00 0.00 0.00 61.98 62.27 1lru s VAL 23 Cb -0.04 -4.08 0.01 0.00 0.00 0.00 0.00 36.38 32.27 1lru s VAL 23 CO -0.02 -1.00 0.05 -0.46 0.00 0.00 0.00 175.10 173.68 1lru n ASN 24 N 11.79 2.70 0.23 3.32 0.23 -1.26 -4.79 115.26 127.47 1lru n ASN 24 Ca 0.18 -2.33 0.14 0.00 -0.53 0.00 0.00 54.58 52.04 1lru n ASN 24 Cb 0.51 0.17 0.79 0.00 -2.08 0.00 0.00 39.78 39.16 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 1.06 1.85 0.07 -2.53 0.00 -1.98 -0.54 119.26 117.19 1lru h ALA 25 Ca -0.25 -0.00 -0.28 0.00 0.00 0.00 0.00 54.91 54.37 1lru h ALA 25 Cb 0.79 0.01 0.03 0.00 0.00 0.00 0.00 17.79 18.61 1lru h ALA 25 CO 0.41 -0.16 -1.15 1.49 0.00 0.00 0.00 179.25 179.84 1lru h GLU 26 N 0.00 0.66 -0.45 0.00 4.22 -1.96 -2.52 114.58 114.53 1lru h GLU 26 Ca 0.05 -0.80 -0.04 0.00 0.08 0.00 0.00 59.36 58.66 1lru h GLU 26 Cb 0.26 0.25 -0.02 0.00 0.50 0.00 0.00 28.75 29.74 1lru h GLU 26 CO -0.00 1.36 0.14 0.82 -2.18 0.00 0.00 179.01 179.15 1lru h ILE 27 N 0.31 1.22 0.00 2.32 1.08 -1.65 -1.84 117.51 118.96 1lru h ILE 27 Ca -0.16 -0.74 -0.03 0.00 -0.39 0.00 0.00 64.86 63.54 1lru h ILE 27 Cb 1.81 0.85 -0.00 0.00 -3.07 0.00 0.00 36.82 36.41 1lru h ILE 27 CO 0.22 0.27 -0.15 1.56 -0.69 0.00 0.00 178.15 179.36 1lru h GLN 28 N 0.59 0.00 0.02 2.37 4.20 -1.20 -1.13 115.11 119.97 1lru h GLN 28 Ca 0.15 0.00 -0.21 0.00 0.06 0.00 0.00 58.65 58.65 1lru h GLN 28 Cb 0.26 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.03 1lru h GLN 28 CO -0.00 0.15 -0.97 0.00 -0.67 0.00 0.00 178.83 177.34 1lru h ARG 29 N 0.00 0.12 -0.20 1.46 2.47 -0.93 -2.92 114.38 114.39 1lru h ARG 29 Ca -0.00 -0.16 -0.13 0.00 -1.26 0.00 0.00 59.98 58.42 1lru h ARG 29 Cb 0.36 0.05 -0.01 0.00 -1.65 0.00 0.00 29.97 28.73 1lru h ARG 29 CO 0.02 0.99 -0.44 0.82 0.56 0.00 0.00 179.97 181.92 1lru h ILE 30 N 0.05 1.31 -0.46 2.04 2.04 -0.51 -2.61 117.51 119.38 1lru h ILE 30 Ca -0.04 -1.63 -0.05 0.00 1.00 0.00 0.00 64.86 64.13 1lru h ILE 30 Cb 1.65 1.64 -0.02 0.00 -0.74 0.00 0.00 36.82 39.35 1lru h ILE 30 CO 0.14 0.51 0.08 0.58 0.00 0.00 0.00 178.15 179.45 1lru h VAL 31 N 0.40 1.21 -0.05 1.67 2.07 -1.14 -1.75 116.25 118.66 1lru h VAL 31 Ca 0.03 -0.80 -0.05 0.00 0.82 0.00 0.00 66.70 66.70 1lru h VAL 31 Cb 0.94 0.78 0.00 0.00 -1.52 0.00 0.00 31.29 31.49 1lru h VAL 31 CO 0.08 0.29 -0.16 0.44 0.02 0.00 0.00 177.57 178.24 1lru h ASP 32 N 0.68 0.23 -0.89 0.57 3.32 -1.35 -1.87 116.42 117.12 1lru h ASP 32 Ca 0.15 -0.61 0.04 0.00 0.02 0.00 0.00 57.03 56.62 1lru h ASP 32 Cb 0.31 -0.07 -0.05 0.00 0.22 0.00 0.00 39.33 39.74 1lru h ASP 32 CO 0.00 0.80 0.58 0.44 -1.72 0.00 0.00 179.24 179.35 1lru h ASP 33 N -0.33 0.94 -0.11 6.45 5.19 -1.38 -0.01 116.42 127.16 1lru h ASP 33 Ca -0.01 -0.01 -0.01 0.00 -0.62 0.00 0.00 57.03 56.39 1lru h ASP 33 Cb 0.78 -0.21 -0.00 0.00 0.18 0.00 0.00 39.33 40.07 1lru h ASP 33 CO 0.03 0.64 0.04 0.24 -3.12 0.00 0.00 179.24 177.08 1lru h MET 34 N 1.09 0.17 -0.43 3.56 2.86 -1.29 -0.05 114.93 120.84 1lru h MET 34 Ca 0.36 -0.04 -0.00 0.00 -2.06 0.00 0.00 59.70 57.96 1lru h MET 34 Cb 0.05 -0.03 -0.02 0.00 0.06 0.00 0.00 31.60 31.66 1lru h MET 34 CO -0.11 0.30 0.26 0.74 1.06 0.00 0.00 176.91 179.16 1lru h PHE 35 N 0.01 0.56 -0.82 -0.22 0.05 -0.94 0.08 116.94 115.67 1lru h PHE 35 Ca 0.04 -0.00 0.02 0.00 3.82 0.00 0.00 57.97 61.85 1lru h PHE 35 Cb 0.20 -0.18 -0.04 0.00 2.00 0.00 0.00 35.95 37.92 1lru h PHE 35 CO -0.01 0.40 0.54 1.49 -0.18 0.00 0.00 178.31 180.55 1lru h GLU 36 N 0.57 1.03 -0.01 1.51 4.81 -0.90 0.11 114.58 121.69 1lru h GLU 36 Ca 0.15 -0.06 -0.24 0.00 -0.13 0.00 0.00 59.36 59.09 1lru h GLU 36 Cb -0.00 -0.23 0.01 0.00 0.63 0.00 0.00 28.75 29.15 1lru h GLU 36 CO -0.03 0.68 -0.95 1.15 -0.73 0.00 0.00 179.01 179.13 1lru h THR 37 N 1.06 1.36 0.01 0.32 2.02 -0.75 -2.19 112.91 114.74 1lru h THR 37 Ca 0.31 -2.34 -0.00 0.00 0.77 0.00 0.00 66.41 65.15 1lru h THR 37 Cb -0.04 2.36 0.00 0.00 -1.74 0.00 0.00 68.15 68.73 1lru h THR 37 CO -0.08 0.71 -0.01 -0.03 0.37 0.00 0.00 175.52 176.48 1lru h MET 38 N 0.30 -0.02 -0.57 6.66 1.85 -0.11 -1.16 114.93 121.88 1lru h MET 38 Ca -0.09 0.00 -0.09 0.00 -0.61 0.00 0.00 59.70 58.92 1lru h MET 38 Cb 1.59 0.00 -0.02 0.00 0.43 0.00 0.00 31.60 33.60 1lru h MET 38 CO 0.17 0.10 0.01 1.88 -0.40 0.00 0.00 176.91 178.67 1lru h TYR 39 N -0.13 1.05 -0.77 1.39 0.99 -0.90 0.51 116.97 119.11 1lru h TYR 39 Ca -0.00 -0.16 -0.05 0.00 2.00 0.00 0.00 58.73 60.52 1lru h TYR 39 Cb 0.13 -0.28 -0.03 0.00 1.00 0.00 0.00 36.73 37.54 1lru h TYR 39 CO -0.04 0.93 0.30 0.00 -0.00 0.00 0.00 178.16 179.35 1lru h ALA 40 N 1.11 1.07 -0.31 3.88 0.00 -1.19 -2.46 119.26 121.37 1lru h ALA 40 Ca 0.17 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1lru h ALA 40 Cb 0.51 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1lru h ALA 40 CO 0.02 0.65 0.00 0.39 0.00 0.00 0.00 179.25 180.32 1lru n GLU 41 N -4.28 1.82 -3.25 0.00 -0.58 -0.46 -4.92 120.64 108.98 1lru n GLU 41 Ca 0.07 -1.27 -0.23 0.00 -0.42 0.00 0.00 57.16 55.31 1lru n GLU 41 Cb 0.19 -1.32 0.05 0.00 -0.57 0.00 0.00 31.44 29.79 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 0.51 -6.18 -3.83 3.49 1.02 -0.93 -5.00 120.64 109.74 1lru n GLU 42 Ca 0.14 0.88 -0.27 0.00 -0.02 0.00 0.00 57.16 57.89 1lru n GLU 42 Cb 0.32 -5.83 -0.03 0.00 -0.02 0.00 0.00 31.44 25.88 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 -2.95 1.78 0.01 0.62 0.00 0.13 -5.01 107.32 101.89 1lru s GLY 43 Ca 0.42 -0.92 0.22 0.00 0.00 0.00 0.00 44.72 44.44 1lru s GLY 43 CO 0.52 -0.90 1.03 1.39 0.00 0.00 0.00 173.10 175.13 1lru n ILE 44 N -0.54 0.03 -3.82 0.90 -0.00 -1.26 -4.49 119.36 110.18 1lru n ILE 44 Ca -0.06 -0.07 -0.09 0.00 -0.00 0.00 0.00 62.75 62.53 1lru n ILE 44 Cb 0.54 0.63 -0.04 0.00 -0.00 0.00 0.00 39.64 40.76 1lru n ILE 44 CO 0.00 0.00 0.00 -0.83 -0.00 0.00 0.00 176.55 175.72 1lru s GLY 45 N -3.19 0.09 -0.25 7.39 0.00 -1.26 -0.61 107.32 109.48 1lru s GLY 45 Ca 0.07 -0.43 -0.26 0.00 0.00 0.00 0.00 44.72 44.11 1lru s GLY 45 CO 0.82 -0.40 0.72 -2.27 0.00 0.00 0.00 173.10 171.96 1lru s LEU 46 N -2.91 -0.74 -0.05 0.66 2.96 0.60 -4.95 118.68 114.25 1lru s LEU 46 Ca 0.12 1.37 0.05 0.00 -0.22 0.00 0.00 54.13 55.46 1lru s LEU 46 Cb -0.00 2.48 -0.02 0.00 0.50 0.00 0.00 46.19 49.14 1lru s LEU 46 CO -0.00 -0.29 -0.21 0.00 -1.32 0.00 0.00 176.35 174.52 1lru s ALA 47 N 0.20 2.34 0.37 5.97 0.00 -1.26 -0.67 121.76 128.71 1lru s ALA 47 Ca -0.01 -1.04 0.17 0.00 0.00 0.00 0.00 51.96 51.08 1lru s ALA 47 Cb -0.04 -0.76 1.09 0.00 0.00 0.00 0.00 23.12 23.40 1lru s ALA 47 CO 0.02 0.48 1.72 0.00 0.00 0.00 0.00 175.76 177.98 1lru h ALA 48 N 5.73 2.14 -0.99 0.00 0.00 -1.48 -2.18 119.26 122.47 1lru h ALA 48 Ca -0.39 0.11 0.23 0.00 0.00 0.00 0.00 54.91 54.86 1lru h ALA 48 Cb 1.15 0.07 -0.09 0.00 0.00 0.00 0.00 17.79 18.92 1lru h ALA 48 CO 0.49 -0.62 0.64 1.15 0.00 0.00 0.00 179.25 180.90 1lru h THR 49 N 0.39 0.60 0.00 0.00 2.02 -1.76 -0.42 112.91 113.75 1lru h THR 49 Ca 0.66 -0.16 -0.02 0.00 0.77 0.00 0.00 66.41 67.66 1lru h THR 49 Cb 1.60 0.08 -0.00 0.00 -1.74 0.00 0.00 68.15 68.09 1lru h THR 49 CO -0.41 0.09 -0.10 1.56 0.37 0.00 0.00 175.52 177.03 1lru h GLN 50 N 0.48 0.00 -0.03 6.66 4.20 -1.71 -2.11 115.11 122.60 1lru h GLN 50 Ca 0.56 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.27 1lru h GLN 50 Cb 1.28 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.06 1lru h GLN 50 CO -0.28 0.10 0.00 0.28 -0.67 0.00 0.00 178.83 178.25 1lru n VAL 51 N -3.33 0.01 -1.33 -0.54 0.31 -0.22 -0.10 118.33 113.13 1lru n VAL 51 Ca -0.01 -0.44 0.00 0.00 -0.01 0.00 0.00 64.34 63.89 1lru n VAL 51 Cb 0.29 1.22 0.00 0.00 -0.91 0.00 0.00 33.84 34.44 1lru n VAL 51 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 1lru n ASP 52 N 1.03 -1.73 -4.11 4.52 2.03 -0.79 -4.76 116.55 112.73 1lru n ASP 52 Ca 0.15 0.00 -0.34 0.00 0.52 0.00 0.00 54.79 55.12 1lru n ASP 52 Cb 0.53 -0.44 -0.13 0.00 -0.72 0.00 0.00 41.12 40.36 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 -2.00 2.88 -1.36 5.18 1.01 -0.89 -5.00 121.20 121.02 1lru s ILE 53 Ca 0.00 -1.86 -0.09 0.00 0.00 0.00 0.00 60.65 58.70 1lru s ILE 53 Cb 0.00 -2.87 0.11 0.00 0.01 0.00 0.00 42.46 39.71 1lru s ILE 53 CO 0.00 -0.42 2.17 1.41 0.00 0.00 0.00 174.94 178.11 1lru n HIS 54 N 4.52 2.89 -4.08 3.97 8.25 -1.26 -2.60 115.22 126.90 1lru n HIS 54 Ca -0.06 -2.86 -0.11 0.00 -0.26 0.00 0.00 57.72 54.44 1lru n HIS 54 Cb 0.42 -2.07 -0.11 0.00 1.12 0.00 0.00 29.99 29.35 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 0.64 0.58 -1.10 -0.41 -0.21 -1.26 -2.36 119.66 115.54 1lru s GLN 55 Ca 0.47 -0.95 -0.18 0.00 0.02 0.00 0.00 55.36 54.72 1lru s GLN 55 Cb 0.13 -0.13 -0.06 0.00 1.00 0.00 0.00 33.01 33.95 1lru s GLN 55 CO -0.04 -0.01 2.08 0.54 -2.12 0.00 0.00 175.29 175.74 1lru n ARG 56 N 0.89 2.16 -5.16 2.91 1.74 -0.94 -4.57 116.66 113.69 1lru n ARG 56 Ca -0.19 -2.19 -0.30 0.00 -0.77 0.00 0.00 57.85 54.40 1lru n ARG 56 Cb 0.57 -3.08 -0.16 0.00 -1.02 0.00 0.00 32.46 28.77 1lru n ARG 56 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1lru s ILE 57 N 4.11 1.90 -0.02 0.55 1.01 -1.26 -1.24 121.20 126.25 1lru s ILE 57 Ca 0.52 -0.98 0.00 0.00 0.00 0.00 0.00 60.65 60.20 1lru s ILE 57 Cb 0.14 -1.61 0.02 0.00 0.01 0.00 0.00 42.46 41.02 1lru s ILE 57 CO 0.02 0.53 0.01 -0.63 0.00 0.00 0.00 174.94 174.87 1lru s ILE 58 N -0.13 0.05 -0.02 2.92 1.01 -0.08 -1.44 121.20 123.50 1lru s ILE 58 Ca -0.03 0.09 0.07 0.00 0.00 0.00 0.00 60.65 60.78 1lru s ILE 58 Cb -0.13 -0.13 -0.02 0.00 0.01 0.00 0.00 42.46 42.19 1lru s ILE 58 CO 0.03 0.08 -0.24 0.68 0.00 0.00 0.00 174.94 175.49 1lru s VAL 59 N 0.67 2.24 -0.03 2.92 -7.23 0.15 -0.42 120.40 118.69 1lru s VAL 59 Ca -0.06 -1.05 -0.01 0.00 -1.81 0.00 0.00 61.98 59.05 1lru s VAL 59 Cb -0.09 -1.79 0.02 0.00 0.56 0.00 0.00 36.38 35.08 1lru s VAL 59 CO -0.02 0.58 0.07 -0.63 -0.31 0.00 0.00 175.10 174.79 1lru s ILE 60 N -0.64 -0.04 -0.20 -0.62 1.01 -0.08 -0.29 121.20 120.34 1lru s ILE 60 Ca 0.10 0.13 -0.04 0.00 0.00 0.00 0.00 60.65 60.84 1lru s ILE 60 Cb -0.10 -0.12 0.10 0.00 0.01 0.00 0.00 42.46 42.34 1lru s ILE 60 CO -0.01 0.05 0.28 -0.62 0.00 0.00 0.00 174.94 174.65 1lru s ASP 61 N 0.72 0.78 -0.01 3.58 2.15 0.22 -0.87 116.67 123.24 1lru s ASP 61 Ca -0.06 0.11 0.20 0.00 0.43 0.00 0.00 52.55 53.22 1lru s ASP 61 Cb -0.08 0.70 -0.24 0.00 -0.30 0.00 0.00 42.92 43.00 1lru s ASP 61 CO -0.03 -0.30 0.72 0.52 -0.17 0.00 0.00 175.17 175.92 1lru n VAL 62 N 5.34 0.00 -2.00 1.11 0.31 -1.26 -4.60 118.33 117.24 1lru n VAL 62 Ca -0.05 -0.16 -0.41 0.00 -0.01 0.00 0.00 64.34 63.71 1lru n VAL 62 Cb 0.50 0.73 -0.02 0.00 -0.91 0.00 0.00 33.84 34.14 1lru n VAL 62 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1lru s SER 63 N -3.26 6.63 0.29 4.52 1.04 -1.26 -4.91 113.70 116.74 1lru s SER 63 Ca 0.03 2.73 -0.00 0.00 0.48 0.00 0.00 55.95 59.19 1lru s SER 63 Cb 0.14 -2.63 0.49 0.00 0.10 0.00 0.00 66.02 64.11 1lru s SER 63 CO 0.81 -0.70 1.90 -0.08 0.98 0.00 0.00 173.24 176.16 1lru h GLU 64 N 4.42 1.05 -0.03 4.02 4.81 -2.00 -1.60 114.58 125.25 1lru h GLU 64 Ca -0.47 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 58.69 1lru h GLU 64 Cb 1.22 -0.24 0.00 0.00 0.63 0.00 0.00 28.75 30.36 1lru h GLU 64 CO 0.74 0.70 0.00 0.27 -0.73 0.00 0.00 179.01 179.98 1lru n ASN 65 N -4.49 0.53 -3.76 1.04 6.94 -1.26 -4.95 115.26 109.31 1lru n ASN 65 Ca 0.14 -1.34 -0.24 0.00 -0.02 0.00 0.00 54.58 53.12 1lru n ASN 65 Cb 0.19 -0.02 0.03 0.00 -2.36 0.00 0.00 39.78 37.62 1lru n ASN 65 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 1lru n ARG 66 N -0.51 -4.99 -2.48 -3.83 1.74 -0.60 -4.94 116.66 101.05 1lru n ARG 66 Ca 0.18 0.60 0.00 0.00 -0.77 0.00 0.00 57.85 57.87 1lru n ARG 66 Cb 0.17 -5.22 0.05 0.00 -1.02 0.00 0.00 32.46 26.44 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 -3.00 1.08 -3.20 0.55 5.68 -1.26 -4.92 116.55 111.48 1lru n ASP 67 Ca -0.22 -2.03 -0.22 0.00 -0.50 0.00 0.00 54.79 51.81 1lru n ASP 67 Cb 0.64 -0.31 -0.07 0.00 -1.14 0.00 0.00 41.12 40.25 1lru n ASP 67 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1lru n GLU 68 N -0.44 0.47 -2.65 0.11 1.02 -1.26 -5.06 120.64 112.83 1lru n GLU 68 Ca 0.03 -2.98 -0.40 0.00 -0.02 0.00 0.00 57.16 53.80 1lru n GLU 68 Cb 0.88 -1.45 -0.05 0.00 -0.02 0.00 0.00 31.44 30.79 1lru n GLU 68 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1lru s ARG 69 N -0.31 4.77 -0.09 3.49 0.52 -1.26 -4.30 118.95 121.77 1lru s ARG 69 Ca 0.33 1.60 0.01 0.00 -0.52 0.00 0.00 55.73 57.15 1lru s ARG 69 Cb 0.10 -3.25 0.02 0.00 0.52 0.00 0.00 34.95 32.34 1lru s ARG 69 CO -0.16 0.39 -0.08 -1.17 0.02 0.00 0.00 175.30 174.30 1lru s LEU 70 N -1.19 1.31 -0.16 2.53 2.96 -0.05 -5.02 118.68 119.07 1lru s LEU 70 Ca 0.43 -0.27 0.00 0.00 -0.22 0.00 0.00 54.13 54.06 1lru s LEU 70 Cb -0.28 -0.78 -0.00 0.00 0.50 0.00 0.00 46.19 45.63 1lru s LEU 70 CO 0.35 -0.07 -0.15 -0.69 -1.32 0.00 0.00 176.35 174.48 1lru s VAL 71 N 1.32 2.72 -0.32 1.68 1.01 -1.26 -0.90 120.40 124.64 1lru s VAL 71 Ca -0.03 -0.75 0.03 0.00 0.00 0.00 0.00 61.98 61.23 1lru s VAL 71 Cb -0.14 -2.15 0.09 0.00 0.00 0.00 0.00 36.38 34.18 1lru s VAL 71 CO -0.04 0.51 0.02 -0.76 0.00 0.00 0.00 175.10 174.84 1lru s LEU 72 N 0.82 4.20 -0.15 3.92 1.43 0.44 -4.48 118.68 124.86 1lru s LEU 72 Ca -0.05 -1.94 -0.04 0.00 -1.03 0.00 0.00 54.13 51.07 1lru s LEU 72 Cb -0.15 -1.52 -0.03 0.00 0.03 0.00 0.00 46.19 44.52 1lru s LEU 72 CO -0.00 -0.35 -0.01 -0.63 0.23 0.00 0.00 176.35 175.59 1lru s ILE 73 N 1.03 4.16 -1.16 -0.59 1.01 -0.83 -0.90 121.20 123.91 1lru s ILE 73 Ca 0.07 -0.27 -0.20 0.00 0.00 0.00 0.00 60.65 60.25 1lru s ILE 73 Cb -0.19 -2.82 -0.01 0.00 0.01 0.00 0.00 42.46 39.46 1lru s ILE 73 CO -0.09 0.51 0.76 0.59 0.00 0.00 0.00 174.94 176.71 1lru n ASN 74 N 3.25 -4.81 -4.82 3.58 3.02 -0.37 -1.17 115.26 113.94 1lru n ASN 74 Ca -0.17 -1.03 -0.33 0.00 -0.03 0.00 0.00 54.58 53.02 1lru n ASN 74 Cb 0.53 -3.27 -0.04 0.00 -0.61 0.00 0.00 39.78 36.39 1lru n ASN 74 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1lru s PRO 75 N -6.11 3.92 -0.02 3.52 0.04 -1.26 -4.36 135.00 130.73 1lru s PRO 75 Ca 0.43 1.14 -0.00 0.00 0.04 0.00 0.00 61.00 62.62 1lru s PRO 75 Cb -0.16 -2.13 0.03 0.00 0.04 0.00 0.00 34.50 32.28 1lru s PRO 75 CO 0.87 -0.31 0.04 -2.00 0.04 0.00 0.00 177.00 175.64 1lru s GLU 76 N -3.57 -0.02 -0.23 4.56 2.12 -0.16 -4.98 118.70 116.42 1lru s GLU 76 Ca 0.63 0.17 -0.26 0.00 0.36 0.00 0.00 54.97 55.87 1lru s GLU 76 Cb -0.12 -0.19 -0.00 0.00 0.26 0.00 0.00 34.13 34.07 1lru s GLU 76 CO 0.23 -0.14 0.90 -1.17 -0.54 0.00 0.00 175.26 174.55 1lru s LEU 77 N 0.88 4.10 -0.12 2.70 2.96 -1.26 -1.34 118.68 126.60 1lru s LEU 77 Ca -0.07 1.17 -0.11 0.00 -0.22 0.00 0.00 54.13 54.89 1lru s LEU 77 Cb -0.10 -3.31 -0.26 0.00 0.50 0.00 0.00 46.19 43.01 1lru s LEU 77 CO -0.03 -0.55 0.43 -0.07 -1.32 0.00 0.00 176.35 174.81 1lru h LEU 78 N 9.18 0.39 -7.50 -0.68 3.38 -0.31 -3.49 115.31 116.28 1lru h LEU 78 Ca -0.22 -0.88 -0.02 0.00 0.09 0.00 0.00 57.88 56.85 1lru h LEU 78 Cb 1.09 -0.13 -0.10 0.00 0.09 0.00 0.00 40.66 41.60 1lru h LEU 78 CO 0.90 1.76 0.08 -1.83 0.09 0.00 0.00 178.44 179.45 1lru s GLU 79 N -2.52 1.35 0.06 1.13 -1.05 -1.06 -4.99 118.70 111.63 1lru s GLU 79 Ca -0.22 -0.76 -0.18 0.00 -0.15 0.00 0.00 54.97 53.66 1lru s GLU 79 Cb 0.06 0.54 0.04 0.00 -0.44 0.00 0.00 34.13 34.33 1lru s GLU 79 CO 0.76 -0.58 0.41 -1.59 0.95 0.00 0.00 175.26 175.21 1lru s LYS 80 N -3.84 0.96 -0.02 -4.83 -2.85 -1.26 -1.04 119.74 106.86 1lru s LYS 80 Ca 0.07 -0.43 -0.26 0.00 -1.00 0.00 0.00 55.97 54.35 1lru s LYS 80 Cb -0.01 0.43 0.06 0.00 -2.06 0.00 0.00 37.83 36.24 1lru s LYS 80 CO -0.06 -0.34 0.57 -1.54 0.10 0.00 0.00 175.35 174.08 1lru s SER 81 N -2.17 -0.51 0.22 0.03 1.04 -0.06 -4.98 113.70 107.26 1lru s SER 81 Ca -0.04 0.47 0.00 0.00 0.48 0.00 0.00 55.95 56.87 1lru s SER 81 Cb -0.00 0.48 0.00 0.00 0.10 0.00 0.00 66.02 66.60 1lru s SER 81 CO -0.04 -0.59 0.00 0.61 0.98 0.00 0.00 173.24 174.19 1lru n GLY 82 N 0.90 -1.91 3.29 7.32 0.00 -1.26 -0.79 105.19 112.74 1lru n GLY 82 Ca -0.19 -1.30 -0.19 0.00 0.00 0.00 0.00 46.02 44.33 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 -2.10 1.16 0.10 1.61 8.01 -1.26 -2.16 118.70 124.06 1lru s GLU 83 Ca 0.00 -1.37 -0.11 0.00 0.01 0.00 0.00 54.97 53.50 1lru s GLU 83 Cb 0.00 -1.06 0.04 0.00 -4.31 0.00 0.00 34.13 28.80 1lru s GLU 83 CO 0.00 0.20 0.55 -2.37 0.01 0.00 0.00 175.26 173.65 1lru n THR 84 N 0.26 0.00 0.00 3.63 5.66 -0.02 -4.52 114.28 119.29 1lru n THR 84 Ca -0.13 -0.31 0.00 0.00 -3.05 0.00 0.00 64.05 60.56 1lru n THR 84 Cb 0.58 0.42 0.00 0.00 -1.55 0.00 0.00 70.33 69.78 1lru n THR 84 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1lru n GLY 85 N -0.38 2.26 3.52 1.09 0.00 -1.26 -1.47 105.19 108.95 1lru n GLY 85 Ca -0.01 0.12 -0.24 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.29 1.12 -0.27 -0.61 -4.36 -1.26 -4.90 121.20 110.63 1lru s ILE 86 Ca 0.00 -2.00 -0.26 0.00 -0.26 0.00 0.00 60.65 58.13 1lru s ILE 86 Cb 0.00 -2.64 0.00 0.00 1.25 0.00 0.00 42.46 41.08 1lru s ILE 86 CO 0.00 0.00 0.92 -1.61 0.24 0.00 0.00 174.94 174.49 1lru s GLU 87 N -3.83 4.11 0.00 0.37 2.02 -1.26 -3.00 118.70 117.12 1lru s GLU 87 Ca 0.30 0.97 0.02 0.00 0.02 0.00 0.00 54.97 56.28 1lru s GLU 87 Cb 0.07 -3.69 -0.03 0.00 0.10 0.00 0.00 34.13 30.57 1lru s GLU 87 CO 0.14 -0.67 -0.03 -1.21 0.02 0.00 0.00 175.26 173.51 1lru s GLU 88 N 3.14 2.68 0.28 1.61 2.02 0.12 -4.77 118.70 123.77 1lru s GLU 88 Ca 0.39 -0.66 0.11 0.00 0.02 0.00 0.00 54.97 54.83 1lru s GLU 88 Cb -0.14 -2.59 -0.05 0.00 0.10 0.00 0.00 34.13 31.45 1lru s GLU 88 CO 0.10 0.61 -0.19 0.20 0.02 0.00 0.00 175.26 176.01 1lru s GLY 89 N -1.49 1.89 -0.01 -1.39 0.00 -1.26 -1.40 107.32 103.67 1lru s GLY 89 Ca 0.18 -1.89 0.02 0.00 0.00 0.00 0.00 44.72 43.03 1lru s GLY 89 CO 0.09 -1.96 -0.06 0.00 0.00 0.00 0.00 173.10 171.17 1lru h LEU 91 N 6.19 0.02 -0.15 0.00 3.38 -1.96 -1.65 115.31 121.14 1lru h LEU 91 Ca -0.30 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.67 1lru h LEU 91 Cb 1.18 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.93 1lru h LEU 91 CO 0.50 0.07 0.00 -1.20 0.09 0.00 0.00 178.44 177.90 1lru n SER 92 N -4.47 0.69 -3.10 -0.43 7.64 -1.26 -3.15 113.62 109.54 1lru n SER 92 Ca -0.03 0.59 -0.27 0.00 1.01 0.00 0.00 58.87 60.18 1lru n SER 92 Cb 0.14 -0.76 -0.05 0.00 -1.01 0.00 0.00 64.21 62.52 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 -2.17 2.65 0.00 0.44 5.41 -0.62 -1.88 119.36 123.19 1lru n ILE 93 Ca 0.05 -5.41 0.00 0.00 1.00 0.00 0.00 62.75 58.39 1lru n ILE 93 Cb 0.37 -1.56 0.00 0.00 -0.71 0.00 0.00 39.64 37.74 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 0.12 0.00 -2.94 0.38 -0.02 -1.19 -2.31 135.00 129.05 1lru n PRO 94 Ca 0.30 0.00 -0.14 0.00 -2.02 0.00 0.00 63.50 61.65 1lru n PRO 94 Cb 0.41 0.00 0.01 0.00 -0.02 0.00 0.00 33.50 33.90 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 0.00 1.05 -4.21 -0.52 1.02 -1.26 -4.76 120.64 111.96 1lru n GLU 95 Ca 0.00 -3.18 -0.19 0.00 -0.02 0.00 0.00 57.16 53.77 1lru n GLU 95 Cb 0.00 -1.42 -0.12 0.00 -0.02 0.00 0.00 31.44 29.88 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 -2.43 0.91 0.02 3.49 1.11 -0.98 -5.06 119.66 116.72 1lru s GLN 96 Ca 0.33 -1.06 0.01 0.00 0.01 0.00 0.00 55.36 54.65 1lru s GLN 96 Cb 0.39 -0.93 -0.01 0.00 -1.01 0.00 0.00 33.01 31.45 1lru s GLN 96 CO -0.03 0.20 -0.03 1.03 0.01 0.00 0.00 175.29 176.47 1lru s ARG 97 N -2.00 0.28 -0.02 2.91 0.52 -1.26 -3.99 118.95 115.39 1lru s ARG 97 Ca 0.02 -0.42 -0.29 0.00 -0.52 0.00 0.00 55.73 54.51 1lru s ARG 97 Cb -0.09 -0.05 0.07 0.00 0.52 0.00 0.00 34.95 35.41 1lru s ARG 97 CO 0.03 -0.00 0.69 0.00 0.02 0.00 0.00 175.30 176.04 1lru s ALA 98 N -0.90 -1.75 0.01 2.13 0.00 -0.49 -4.88 121.76 115.88 1lru s ALA 98 Ca -0.09 1.17 -0.30 0.00 0.00 0.00 0.00 51.96 52.74 1lru s ALA 98 Cb -0.06 0.13 -0.04 0.00 0.00 0.00 0.00 23.12 23.15 1lru s ALA 98 CO -0.00 -0.45 1.07 -1.17 0.00 0.00 0.00 175.76 175.21 1lru s LEU 99 N -1.52 4.36 -0.06 0.00 0.20 -1.26 0.13 118.68 120.54 1lru s LEU 99 Ca -0.08 1.79 0.03 0.00 0.69 0.00 0.00 54.13 56.56 1lru s LEU 99 Cb -0.00 -3.57 0.01 0.00 -0.43 0.00 0.00 46.19 42.19 1lru s LEU 99 CO 0.04 -0.36 -0.13 -0.69 -0.29 0.00 0.00 176.35 174.92 1lru s VAL 100 N 1.15 1.19 0.16 1.68 1.01 -1.16 -4.96 120.40 119.47 1lru s VAL 100 Ca 0.54 -0.53 -0.30 0.00 0.00 0.00 0.00 61.98 61.69 1lru s VAL 100 Cb -0.24 -1.07 -0.08 0.00 0.00 0.00 0.00 36.38 34.99 1lru s VAL 100 CO 0.28 0.36 1.30 -2.16 0.00 0.00 0.00 175.10 174.87 1lru s PRO 101 N 0.48 4.39 0.05 2.72 0.04 -1.26 -4.23 135.00 137.20 1lru s PRO 101 Ca -0.12 2.00 -0.02 0.00 0.04 0.00 0.00 61.00 62.90 1lru s PRO 101 Cb -0.14 -3.23 -0.03 0.00 0.04 0.00 0.00 34.50 31.13 1lru s PRO 101 CO 0.03 -0.27 0.01 1.03 0.04 0.00 0.00 177.00 177.85 1lru s ARG 102 N 0.27 0.62 0.39 4.56 0.52 -0.54 -4.98 118.95 119.79 1lru s ARG 102 Ca 0.58 -1.11 -0.25 0.00 -0.52 0.00 0.00 55.73 54.42 1lru s ARG 102 Cb -0.35 0.22 -0.09 0.00 0.52 0.00 0.00 34.95 35.26 1lru s ARG 102 CO 0.35 -0.13 1.16 0.00 0.02 0.00 0.00 175.30 176.70 1lru s ALA 103 N -3.67 3.17 0.04 2.13 0.00 -1.26 -0.84 121.76 121.34 1lru s ALA 103 Ca 0.04 0.95 -0.18 0.00 0.00 0.00 0.00 51.96 52.78 1lru s ALA 103 Cb 0.06 -3.37 -0.17 0.00 0.00 0.00 0.00 23.12 19.63 1lru s ALA 103 CO -0.09 -0.49 1.24 1.49 0.00 0.00 0.00 175.76 177.91 1lru h GLU 104 N 2.71 0.51 -6.09 0.00 4.81 -0.71 -3.43 114.58 112.39 1lru h GLU 104 Ca -0.49 -0.40 -0.60 0.00 -0.13 0.00 0.00 59.36 57.74 1lru h GLU 104 Cb 1.23 0.08 -0.28 0.00 0.63 0.00 0.00 28.75 30.41 1lru h GLU 104 CO 0.63 1.03 -0.85 0.15 -0.73 0.00 0.00 179.01 179.23 1lru s LYS 105 N -3.73 1.61 0.01 1.92 1.02 0.03 -3.84 119.74 116.76 1lru s LYS 105 Ca -0.13 -0.82 0.00 0.00 0.02 0.00 0.00 55.97 55.04 1lru s LYS 105 Cb 0.06 -1.62 -0.01 0.00 -0.52 0.00 0.00 37.83 35.74 1lru s LYS 105 CO 0.82 0.43 -0.02 0.14 -0.92 0.00 0.00 175.35 175.81 1lru s VAL 106 N -0.59 0.08 -0.18 3.17 -7.23 -0.80 -0.88 120.40 113.96 1lru s VAL 106 Ca 0.08 -0.42 0.00 0.00 -1.81 0.00 0.00 61.98 59.83 1lru s VAL 106 Cb -0.08 -0.15 0.02 0.00 0.56 0.00 0.00 36.38 36.72 1lru s VAL 106 CO 0.00 -0.21 -0.18 -0.75 -0.31 0.00 0.00 175.10 173.64 1lru s LYS 107 N -0.66 3.04 0.40 4.82 2.20 -0.20 -0.36 119.74 128.97 1lru s LYS 107 Ca -0.07 -0.81 0.05 0.00 -0.36 0.00 0.00 55.97 54.79 1lru s LYS 107 Cb -0.05 -2.62 -0.06 0.00 -1.51 0.00 0.00 37.83 33.59 1lru s LYS 107 CO -0.00 -0.21 0.03 0.96 -0.36 0.00 0.00 175.35 175.77 1lru s ILE 108 N 1.31 1.60 0.00 5.43 -4.36 0.25 0.48 121.20 125.90 1lru s ILE 108 Ca 0.05 -2.00 0.03 0.00 -0.26 0.00 0.00 60.65 58.47 1lru s ILE 108 Cb -0.13 -2.79 -0.01 0.00 1.25 0.00 0.00 42.46 40.78 1lru s ILE 108 CO -0.12 0.00 -0.11 -0.60 0.24 0.00 0.00 174.94 174.36 1lru s ARG 109 N -3.78 0.82 0.36 0.37 3.52 -0.45 -0.92 118.95 118.87 1lru s ARG 109 Ca 0.30 -0.45 -0.16 0.00 -0.13 0.00 0.00 55.73 55.29 1lru s ARG 109 Cb 0.08 -0.79 0.04 0.00 -1.56 0.00 0.00 34.95 32.73 1lru s ARG 109 CO 0.15 0.21 0.76 0.00 -0.81 0.00 0.00 175.30 175.61 1lru s ALA 110 N -0.40 -0.78 -0.10 6.12 0.00 0.63 -0.99 121.76 126.25 1lru s ALA 110 Ca 0.03 -0.69 -0.01 0.00 0.00 0.00 0.00 51.96 51.29 1lru s ALA 110 Cb -0.05 0.74 -0.03 0.00 0.00 0.00 0.00 23.12 23.78 1lru s ALA 110 CO -0.00 -0.99 -0.03 -0.51 0.00 0.00 0.00 175.76 174.23 1lru s LEU 111 N -3.04 3.34 0.00 0.00 1.43 -0.31 0.35 118.68 120.45 1lru s LEU 111 Ca 0.15 0.02 0.00 0.00 -1.03 0.00 0.00 54.13 53.27 1lru s LEU 111 Cb -0.05 -1.76 0.00 0.00 0.03 0.00 0.00 46.19 44.41 1lru s LEU 111 CO 0.11 0.32 0.00 -0.90 0.23 0.00 0.00 176.35 176.11 1lru n ASP 112 N 2.51 0.00 0.28 2.29 5.68 0.16 -1.97 116.55 125.49 1lru n ASP 112 Ca -0.18 -0.85 0.12 0.00 -0.50 0.00 0.00 54.79 53.38 1lru n ASP 112 Cb 0.53 0.00 0.78 0.00 -1.14 0.00 0.00 41.12 41.29 1lru n ASP 112 CO 0.00 0.00 0.00 -0.09 -1.33 0.00 0.00 177.20 175.78 1lru h ARG 113 N 0.00 0.00 -0.61 0.11 2.43 -1.88 -0.40 114.38 114.03 1lru h ARG 113 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1lru h ARG 113 Cb 0.00 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 1lru h ARG 113 CO 0.00 0.03 0.00 -0.25 -1.51 0.00 0.00 179.97 178.24 1lru n ASP 114 N -4.08 3.61 0.00 -3.80 8.00 -1.26 -4.88 116.55 114.14 1lru n ASP 114 Ca -0.03 -2.21 0.00 0.00 0.71 0.00 0.00 54.79 53.26 1lru n ASP 114 Cb 0.11 -0.47 0.00 0.00 -0.02 0.00 0.00 41.12 40.74 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 1.17 1.34 3.69 0.44 0.00 -0.16 -4.98 105.19 106.69 1lru n GLY 115 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.07 4.39 0.50 1.61 1.02 -1.26 -4.54 119.74 121.40 1lru s LYS 116 Ca 0.00 1.58 -0.22 0.00 0.02 0.00 0.00 55.97 57.35 1lru s LYS 116 Cb 0.00 -3.53 -0.06 0.00 -0.52 0.00 0.00 37.83 33.72 1lru s LYS 116 CO 0.00 -0.37 1.22 -2.14 -0.92 0.00 0.00 175.35 173.14 1lru s PRO 117 N 1.99 3.51 -0.02 -1.68 0.02 -1.26 0.38 135.00 137.95 1lru s PRO 117 Ca 0.53 1.88 -0.24 0.00 0.02 0.00 0.00 61.00 63.20 1lru s PRO 117 Cb -0.23 -2.30 0.05 0.00 0.02 0.00 0.00 34.50 32.04 1lru s PRO 117 CO 0.22 -0.79 0.53 -0.59 -0.33 0.00 0.00 177.00 176.04 1lru s PHE 118 N -1.50 -0.46 0.05 6.54 -0.12 0.16 -4.88 117.98 117.76 1lru s PHE 118 Ca 0.67 0.72 0.03 0.00 -0.05 0.00 0.00 56.93 58.31 1lru s PHE 118 Cb -0.31 0.30 -0.04 0.00 -0.63 0.00 0.00 43.02 42.34 1lru s PHE 118 CO 0.37 -0.55 -0.00 -1.21 -0.05 0.00 0.00 175.22 173.78 1lru s GLU 119 N -1.52 2.64 -0.04 1.99 2.02 -1.26 -0.27 118.70 122.26 1lru s GLU 119 Ca -0.10 -0.74 -0.02 0.00 0.02 0.00 0.00 54.97 54.12 1lru s GLU 119 Cb -0.02 -2.59 0.02 0.00 0.10 0.00 0.00 34.13 31.64 1lru s GLU 119 CO 0.06 0.58 0.09 -1.17 0.02 0.00 0.00 175.26 174.83 1lru s LEU 120 N -1.96 1.37 -0.22 1.80 2.96 -0.10 -4.99 118.68 117.54 1lru s LEU 120 Ca 0.23 0.17 -0.05 0.00 -0.22 0.00 0.00 54.13 54.26 1lru s LEU 120 Cb -0.12 0.23 -0.02 0.00 0.50 0.00 0.00 46.19 46.79 1lru s LEU 120 CO 0.15 -0.07 -0.01 -1.61 -1.32 0.00 0.00 176.35 173.48 1lru s GLU 121 N 0.47 3.47 0.15 1.98 2.02 -1.26 -0.59 118.70 124.95 1lru s GLU 121 Ca -0.04 -0.58 0.11 0.00 0.02 0.00 0.00 54.97 54.49 1lru s GLU 121 Cb -0.05 -3.09 -0.04 0.00 0.10 0.00 0.00 34.13 31.05 1lru s GLU 121 CO -0.02 -0.17 -0.25 0.00 0.02 0.00 0.00 175.26 174.85 1lru s ALA 122 N 1.44 2.48 0.20 5.21 0.00 0.51 -5.01 121.76 126.60 1lru s ALA 122 Ca 0.05 -1.53 -0.05 0.00 0.00 0.00 0.00 51.96 50.43 1lru s ALA 122 Cb -0.14 -0.39 -0.03 0.00 0.00 0.00 0.00 23.12 22.56 1lru s ALA 122 CO -0.01 0.50 0.23 0.34 0.00 0.00 0.00 175.76 176.82 1lru s ASP 123 N -2.32 0.09 1.33 0.00 2.15 -1.26 -1.91 116.67 114.75 1lru s ASP 123 Ca 0.17 -1.19 0.00 0.00 0.43 0.00 0.00 52.55 51.96 1lru s ASP 123 Cb -0.09 0.43 0.00 0.00 -0.30 0.00 0.00 42.92 42.96 1lru s ASP 123 CO 0.08 -0.91 0.00 0.61 -0.17 0.00 0.00 175.17 174.78 1lru n GLY 124 N -0.27 3.22 0.23 2.66 0.00 -1.25 -2.97 105.19 106.80 1lru n GLY 124 Ca -0.01 -0.27 -0.03 0.00 0.00 0.00 0.00 46.02 45.71 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 0.42 -0.09 0.99 5.85 -1.99 -2.93 115.31 117.56 1lru h LEU 125 Ca 0.00 -0.15 -0.00 0.00 0.84 0.00 0.00 57.88 58.57 1lru h LEU 125 Cb 0.00 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 40.91 1lru h LEU 125 CO 0.00 0.69 0.05 0.25 -0.34 0.00 0.00 178.44 179.09 1lru h LEU 126 N 0.36 0.11 -1.02 2.25 5.85 -1.95 -0.47 115.31 120.45 1lru h LEU 126 Ca 0.05 -0.09 0.11 0.00 0.84 0.00 0.00 57.88 58.78 1lru h LEU 126 Cb 0.69 -0.03 -0.08 0.00 0.37 0.00 0.00 40.66 41.61 1lru h LEU 126 CO 0.05 0.17 0.64 0.00 -0.34 0.00 0.00 178.44 178.96 1lru h ALA 127 N 0.94 1.50 -0.13 1.25 0.00 -1.42 0.16 119.26 121.57 1lru h ALA 127 Ca 0.03 0.01 -0.23 0.00 0.00 0.00 0.00 54.91 54.72 1lru h ALA 127 Cb 0.09 -0.23 0.01 0.00 0.00 0.00 0.00 17.79 17.66 1lru h ALA 127 CO -0.00 0.28 -0.80 0.82 0.00 0.00 0.00 179.25 179.54 1lru h ILE 128 N 1.04 1.28 -0.06 0.00 2.04 -1.42 -2.88 117.51 117.51 1lru h ILE 128 Ca 0.48 -2.00 -0.01 0.00 1.00 0.00 0.00 64.86 64.33 1lru h ILE 128 Cb 0.41 2.06 -0.00 0.00 -0.74 0.00 0.00 36.82 38.55 1lru h ILE 128 CO -0.24 0.63 0.01 0.00 0.00 0.00 0.00 178.15 178.55 1lru h ILE 130 N -0.15 0.71 -0.53 0.00 2.04 -1.08 0.10 117.51 118.60 1lru h ILE 130 Ca 0.02 -0.02 0.00 0.00 1.00 0.00 0.00 64.86 65.86 1lru h ILE 130 Cb 0.27 0.65 -0.03 0.00 -0.74 0.00 0.00 36.82 36.97 1lru h ILE 130 CO 0.00 0.01 0.34 1.56 0.00 0.00 0.00 178.15 180.06 1lru h GLN 131 N 0.05 0.70 -0.00 2.37 4.20 -1.44 -0.38 115.11 120.61 1lru h GLN 131 Ca 0.17 -0.05 -0.23 0.00 0.06 0.00 0.00 58.65 58.60 1lru h GLN 131 Cb 0.24 -0.16 0.01 0.00 0.30 0.00 0.00 27.48 27.87 1lru h GLN 131 CO -0.31 0.47 -0.96 1.25 -0.67 0.00 0.00 178.83 178.61 1lru h HIS 132 N 0.72 0.71 -0.03 2.96 2.76 -0.31 -2.41 115.15 119.55 1lru h HIS 132 Ca 0.19 -0.39 -0.02 0.00 -2.20 0.00 0.00 60.37 57.96 1lru h HIS 132 Cb -0.07 -0.08 0.00 0.00 1.55 0.00 0.00 27.41 28.81 1lru h HIS 132 CO 0.00 1.21 -0.06 0.93 -1.30 0.00 0.00 177.93 178.71 1lru h GLU 133 N 0.27 0.09 -0.92 5.26 4.39 -0.54 -3.05 114.58 120.08 1lru h GLU 133 Ca -0.09 -0.06 0.15 0.00 0.34 0.00 0.00 59.36 59.70 1lru h GLU 133 Cb 1.60 0.01 -0.08 0.00 -0.10 0.00 0.00 28.75 30.18 1lru h GLU 133 CO 0.17 0.64 0.59 0.52 -1.16 0.00 0.00 179.01 179.77 1lru h MET 134 N -0.44 0.71 -0.49 2.33 2.86 -1.16 0.36 114.93 119.10 1lru h MET 134 Ca 0.00 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.60 1lru h MET 134 Cb 0.63 -0.16 -0.02 0.00 0.06 0.00 0.00 31.60 32.11 1lru h MET 134 CO 0.01 0.47 0.31 -0.44 1.06 0.00 0.00 176.91 178.33 1lru h ASP 135 N 0.74 0.58 -0.54 1.22 5.19 -1.41 -2.25 116.42 119.94 1lru h ASP 135 Ca 0.47 -0.02 -0.01 0.00 -0.62 0.00 0.00 57.03 56.85 1lru h ASP 135 Cb 0.73 -0.14 -0.03 0.00 0.18 0.00 0.00 39.33 40.07 1lru h ASP 135 CO -0.23 0.43 0.29 0.45 -3.12 0.00 0.00 179.24 177.06 1lru h HIS 136 N 0.67 0.75 0.00 4.55 3.86 -0.18 0.02 115.15 124.83 1lru h HIS 136 Ca 0.18 -0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.37 1lru h HIS 136 Cb -0.05 -0.24 0.00 0.00 1.06 0.00 0.00 27.41 28.18 1lru h HIS 136 CO 0.00 0.55 0.00 -0.07 0.86 0.00 0.00 177.93 179.28 1lru h LEU 137 N 0.73 0.00 -3.33 2.43 3.38 -1.22 -0.41 115.31 116.89 1lru h LEU 137 Ca 0.19 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.08 1lru h LEU 137 Cb 0.05 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 40.75 1lru h LEU 137 CO -0.03 0.00 0.01 1.33 0.09 0.00 0.00 178.44 179.84 1lru n VAL 138 N -2.51 2.43 -2.10 1.22 0.24 -1.00 -0.78 118.33 115.83 1lru n VAL 138 Ca -0.01 -2.17 -0.16 0.00 -2.04 0.00 0.00 64.34 59.96 1lru n VAL 138 Cb 0.09 -0.29 -0.02 0.00 -1.47 0.00 0.00 33.84 32.14 1lru n VAL 138 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1lru n GLY 139 N -0.74 0.19 3.52 7.63 0.00 -0.16 -4.71 105.19 110.93 1lru n GLY 139 Ca 0.27 -0.21 -0.33 0.00 0.00 0.00 0.00 46.02 45.75 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 -4.45 2.57 0.12 1.61 2.20 -0.04 -4.50 119.74 117.26 1lru s LYS 140 Ca 0.00 -0.66 0.09 0.00 -0.36 0.00 0.00 55.97 55.04 1lru s LYS 140 Cb 0.00 -2.45 -0.04 0.00 -1.51 0.00 0.00 37.83 33.83 1lru s LYS 140 CO 0.00 0.63 -0.23 -0.51 -0.36 0.00 0.00 175.35 174.88 1lru s LEU 141 N -0.86 2.33 0.46 5.43 1.43 -1.26 -3.35 118.68 122.85 1lru s LEU 141 Ca 0.13 -0.73 0.21 0.00 -1.03 0.00 0.00 54.13 52.70 1lru s LEU 141 Cb -0.11 -1.03 1.20 0.00 0.03 0.00 0.00 46.19 46.28 1lru s LEU 141 CO 0.02 0.10 1.90 2.19 0.23 0.00 0.00 176.35 180.79 1lru h PHE 142 N 3.89 0.34 0.00 0.29 -5.15 -1.98 -1.32 116.94 113.01 1lru h PHE 142 Ca -0.48 0.01 0.00 0.00 -0.20 0.00 0.00 57.97 57.30 1lru h PHE 142 Cb 1.18 -0.11 0.00 0.00 0.22 0.00 0.00 35.95 37.24 1lru h PHE 142 CO 0.62 0.11 0.00 0.00 -2.00 0.00 0.00 178.31 177.03 1lru h MET 143 N 0.27 0.00 0.00 6.09 -0.00 -1.98 -2.18 114.93 117.14 1lru h MET 143 Ca 0.40 0.00 -0.00 0.00 -0.00 0.00 0.00 59.70 60.10 1lru h MET 143 Cb 1.15 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 32.75 1lru h MET 143 CO -0.10 0.00 -0.01 -0.44 -0.00 0.00 0.00 176.91 176.36 1lru h ASP 144 N 0.00 0.00 1.60 -0.10 3.32 -1.66 -0.68 116.42 118.90 1lru h ASP 144 Ca 0.00 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.01 1lru h ASP 144 Cb 0.31 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.86 1lru h ASP 144 CO 0.00 0.01 -0.20 1.88 -1.72 0.00 0.00 179.24 179.21 1lru h TYR 145 N 0.00 0.00 -4.48 4.55 -1.99 -1.57 -3.47 116.97 110.02 1lru h TYR 145 Ca -0.00 0.00 -0.48 0.00 2.00 0.00 0.00 58.73 60.25 1lru h TYR 145 Cb 0.29 0.00 0.08 0.00 2.00 0.00 0.00 36.73 39.10 1lru h TYR 145 CO 0.00 0.20 0.40 -0.51 -0.00 0.00 0.00 178.16 178.25 1lru s LEU 146 N -6.37 2.80 0.81 3.88 1.43 -0.26 -5.02 118.68 115.95 1lru s LEU 146 Ca 0.05 1.00 -0.11 0.00 -1.03 0.00 0.00 54.13 54.04 1lru s LEU 146 Cb 0.07 -3.71 0.08 0.00 0.03 0.00 0.00 46.19 42.65 1lru s LEU 146 CO 0.68 -1.50 1.09 -0.94 0.23 0.00 0.00 176.35 175.91 1lru s SER 147 N -4.42 4.23 0.24 2.29 1.04 -1.26 -4.77 113.70 111.05 1lru s SER 147 Ca 0.59 1.62 -0.05 0.00 0.48 0.00 0.00 55.95 58.59 1lru s SER 147 Cb -0.11 -2.34 0.35 0.00 0.10 0.00 0.00 66.02 64.03 1lru s SER 147 CO 0.51 -2.18 1.83 -0.65 0.98 0.00 0.00 173.24 173.73 1lru h PRO 148 N -1.23 0.85 -0.52 4.02 0.11 -1.97 0.10 132.00 133.36 1lru h PRO 148 Ca -0.46 -0.05 -0.08 0.00 0.11 0.00 0.00 66.00 65.52 1lru h PRO 148 Cb 1.25 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 32.15 1lru h PRO 148 CO 0.54 0.56 0.03 -0.07 -0.21 0.00 0.00 178.00 178.85 1lru h LEU 149 N 0.88 0.88 -0.31 2.35 4.07 -1.98 0.18 115.31 121.37 1lru h LEU 149 Ca 0.38 -0.29 -0.15 0.00 0.08 0.00 0.00 57.88 57.90 1lru h LEU 149 Cb 0.25 -0.23 -0.00 0.00 1.08 0.00 0.00 40.66 41.75 1lru h LEU 149 CO -0.20 0.95 -0.39 0.50 -1.08 0.00 0.00 178.44 178.22 1lru h LYS 150 N 0.77 0.82 -0.98 1.13 1.63 -1.77 -0.51 116.57 117.67 1lru h LYS 150 Ca 0.15 -0.46 0.02 0.00 -0.85 0.00 0.00 60.65 59.51 1lru h LYS 150 Cb 0.48 0.03 -0.05 0.00 -0.60 0.00 0.00 32.23 32.09 1lru h LYS 150 CO 0.02 1.09 0.65 1.96 -3.45 0.00 0.00 179.45 179.73 1lru h GLN 151 N 0.59 1.27 -0.30 1.90 4.20 -0.68 0.69 115.11 122.78 1lru h GLN 151 Ca 0.04 -0.08 -0.01 0.00 0.06 0.00 0.00 58.65 58.66 1lru h GLN 151 Cb 0.98 -0.29 -0.01 0.00 0.30 0.00 0.00 27.48 28.46 1lru h GLN 151 CO 0.09 0.84 0.14 0.37 -0.67 0.00 0.00 178.83 179.60 1lru h GLN 152 N 1.31 0.44 -0.57 1.46 4.15 -0.25 -1.37 115.11 120.26 1lru h GLN 152 Ca 0.37 -0.07 -0.06 0.00 0.77 0.00 0.00 58.65 59.66 1lru h GLN 152 Cb -0.11 -0.08 -0.03 0.00 0.21 0.00 0.00 27.48 27.48 1lru h GLN 152 CO -0.09 0.42 0.11 0.00 -1.93 0.00 0.00 178.83 177.34 1lru h ARG 153 N 0.35 0.91 -0.15 1.69 3.08 -0.48 -1.20 114.38 118.57 1lru h ARG 153 Ca 0.10 -0.21 -0.01 0.00 0.07 0.00 0.00 59.98 59.93 1lru h ARG 153 Cb 0.13 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 1lru h ARG 153 CO -0.01 0.83 0.05 0.82 -1.07 0.00 0.00 179.97 180.59 1lru h ILE 154 N 0.86 1.18 -0.47 2.04 2.04 -0.69 -1.28 117.51 121.19 1lru h ILE 154 Ca 0.18 -0.57 0.04 0.00 1.00 0.00 0.00 64.86 65.51 1lru h ILE 154 Cb 0.35 1.27 -0.04 0.00 -0.74 0.00 0.00 36.82 37.67 1lru h ILE 154 CO 0.00 0.17 0.25 0.03 0.00 0.00 0.00 178.15 178.60 1lru h ARG 155 N 0.07 0.47 0.00 2.37 3.08 -1.06 -0.72 114.38 118.59 1lru h ARG 155 Ca 0.05 -0.03 -0.10 0.00 0.07 0.00 0.00 59.98 59.97 1lru h ARG 155 Cb 0.22 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 30.15 1lru h ARG 155 CO -0.00 0.31 -0.49 1.96 -1.07 0.00 0.00 179.97 180.69 1lru h GLN 156 N 0.49 0.00 0.10 0.04 4.20 -1.13 -1.84 115.11 116.96 1lru h GLN 156 Ca 0.20 0.00 -0.27 0.00 0.06 0.00 0.00 58.65 58.64 1lru h GLN 156 Cb 0.10 0.00 0.02 0.00 0.30 0.00 0.00 27.48 27.89 1lru h GLN 156 CO -0.14 0.49 -1.18 0.87 -0.67 0.00 0.00 178.83 178.20 1lru h LYS 157 N 0.00 0.46 -0.30 1.46 1.57 -0.94 -3.24 116.57 115.58 1lru h LYS 157 Ca -0.00 -0.63 -0.05 0.00 -1.87 0.00 0.00 60.65 58.10 1lru h LYS 157 Cb 0.88 0.21 -0.01 0.00 0.08 0.00 0.00 32.23 33.39 1lru h LYS 157 CO 0.06 1.26 0.01 0.28 -0.57 0.00 0.00 179.45 180.50 1lru h VAL 158 N 0.20 1.25 0.00 0.50 2.07 -1.09 -3.01 116.25 116.16 1lru h VAL 158 Ca -0.15 -0.91 0.00 0.00 0.82 0.00 0.00 66.70 66.46 1lru h VAL 158 Cb 1.85 1.25 0.00 0.00 -1.52 0.00 0.00 31.29 32.88 1lru h VAL 158 CO 0.21 0.30 0.01 -0.62 0.02 0.00 0.00 177.57 177.48 1lru n GLU 159 N -4.58 0.00 0.04 1.57 4.71 -0.70 -0.73 120.64 120.95 1lru n GLU 159 Ca -0.03 0.17 0.10 0.00 -0.01 0.00 0.00 57.16 57.39 1lru n GLU 159 Cb 0.25 -1.51 -0.09 0.00 -1.01 0.00 0.00 31.44 29.08 1lru n GLU 159 CO 0.00 0.00 0.00 0.36 0.09 0.00 0.00 177.13 177.58 1lru n LYS 160 N -1.16 0.64 0.00 3.49 2.85 -1.14 -4.94 118.16 117.89 1lru n LYS 160 Ca 0.00 -0.03 0.00 0.00 -1.05 0.00 0.00 58.31 57.23 1lru n LYS 160 Cb 0.01 -1.67 0.00 0.00 -0.65 0.00 0.00 35.03 32.72 1lru n LYS 160 CO 0.00 0.00 0.00 1.47 -0.05 0.00 0.00 177.40 178.82 1lru n LEU 161 N -2.50 0.00 0.00 -5.58 -0.00 0.10 -4.75 117.00 104.26 1lru n LEU 161 Ca -0.04 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 55.97 1lru n LEU 161 Cb 0.60 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 44.02 1lru n LEU 161 CO 0.43 0.00 0.00 0.47 -0.00 0.00 0.00 177.39 178.29 1lru n ASP 162 N 0.00 0.00 0.00 1.45 8.00 -1.26 -4.68 116.55 120.05 1lru n ASP 162 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 1lru n ASP 162 Cb 0.00 -0.83 0.00 0.00 -0.02 0.00 0.00 41.12 40.27 1lru n ASP 162 CO 0.00 0.00 0.00 -2.11 -0.39 0.00 0.00 177.20 174.70 1lru n ARG 163 N -1.69 0.00 -0.48 -1.24 1.85 -1.26 -5.23 116.66 108.61 1lru n ARG 163 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 1lru n ARG 163 Cb 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.41 1lru n ARG 163 CO 0.00 0.00 0.00 -0.11 -0.01 0.00 0.00 177.63 177.51