#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 5.05 0.56 0.44 1.01 -1.26 -4.57 120.40 121.63 1lru s VAL 2 Ca 0.00 -0.05 -0.09 0.00 0.00 0.00 0.00 61.98 61.84 1lru s VAL 2 Cb 0.00 -3.47 -0.04 0.00 0.00 0.00 0.00 36.38 32.88 1lru s VAL 2 CO 0.00 0.18 0.93 -0.76 0.00 0.00 0.00 175.10 175.45 1lru s LEU 3 N 1.71 3.39 0.23 3.92 1.43 -1.26 -5.00 118.68 123.10 1lru s LEU 3 Ca 0.06 1.23 -0.27 0.00 -1.03 0.00 0.00 54.13 54.12 1lru s LEU 3 Cb -0.16 -4.24 -0.09 0.00 0.03 0.00 0.00 46.19 41.73 1lru s LEU 3 CO 0.09 -0.75 0.87 -1.58 0.23 0.00 0.00 176.35 175.21 1lru s GLN 4 N -4.99 4.67 -0.17 1.70 0.74 -1.26 -4.92 119.66 115.43 1lru s GLN 4 Ca 0.52 1.30 -0.07 0.00 0.05 0.00 0.00 55.36 57.16 1lru s GLN 4 Cb -0.11 -3.15 -0.04 0.00 1.10 0.00 0.00 33.01 30.81 1lru s GLN 4 CO 0.50 0.48 0.07 0.08 -0.55 0.00 0.00 175.29 175.88 1lru s VAL 5 N -1.28 4.90 0.40 1.34 1.01 -1.26 -4.37 120.40 121.14 1lru s VAL 5 Ca 0.41 0.00 -0.24 0.00 0.00 0.00 0.00 61.98 62.15 1lru s VAL 5 Cb -0.23 -3.19 -0.09 0.00 0.00 0.00 0.00 36.38 32.87 1lru s VAL 5 CO 0.28 0.49 1.05 -0.76 0.00 0.00 0.00 175.10 176.15 1lru s LEU 6 N 0.13 4.13 0.16 3.92 1.43 0.33 -4.99 118.68 123.79 1lru s LEU 6 Ca 0.06 2.03 0.10 0.00 -1.03 0.00 0.00 54.13 55.29 1lru s LEU 6 Cb -0.12 -4.20 -0.04 0.00 0.03 0.00 0.00 46.19 41.86 1lru s LEU 6 CO 0.00 -0.50 -0.23 -1.00 0.23 0.00 0.00 176.35 174.86 1lru s HIS 7 N -1.67 2.12 0.63 0.29 3.76 -1.26 -4.14 115.29 115.02 1lru s HIS 7 Ca 0.58 -0.39 -0.18 0.00 -0.15 0.00 0.00 55.06 54.92 1lru s HIS 7 Cb -0.22 -1.09 -0.02 0.00 1.11 0.00 0.00 32.58 32.37 1lru s HIS 7 CO 0.27 0.39 1.23 0.96 -0.85 0.00 0.00 174.74 176.74 1lru s ILE 8 N -1.56 2.42 -0.32 0.60 -4.36 0.49 -1.38 121.20 117.08 1lru s ILE 8 Ca 0.16 0.25 0.01 0.00 -0.26 0.00 0.00 60.65 60.81 1lru s ILE 8 Cb -0.08 -3.05 0.32 0.00 1.25 0.00 0.00 42.46 40.90 1lru s ILE 8 CO 0.08 -0.07 1.78 -0.81 0.24 0.00 0.00 174.94 176.16 1lru n PRO 9 N -1.87 1.85 -1.68 0.37 -0.05 -1.26 -4.94 135.00 127.42 1lru n PRO 9 Ca 0.14 -1.82 -0.43 0.00 -0.05 0.00 0.00 63.50 61.34 1lru n PRO 9 Cb 0.49 -1.71 -0.03 0.00 -0.05 0.00 0.00 33.50 32.20 1lru n PRO 9 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 175.50 171.98 1lru n ASP 10 N -0.17 4.02 0.00 3.54 2.03 -0.48 -4.85 116.55 120.64 1lru n ASP 10 Ca 0.36 0.96 0.10 0.00 0.52 0.00 0.00 54.79 56.73 1lru n ASP 10 Cb 0.88 -1.52 0.53 0.00 -0.72 0.00 0.00 41.12 40.29 1lru n ASP 10 CO 0.00 0.00 0.00 -1.84 -1.92 0.00 0.00 177.20 173.44 1lru n GLU 11 N 6.23 0.28 0.23 -0.67 0.00 -1.26 -2.42 120.64 123.03 1lru n GLU 11 Ca 0.19 0.09 0.15 0.00 0.00 0.00 0.00 57.16 57.59 1lru n GLU 11 Cb 0.38 -1.50 0.51 0.00 0.00 0.00 0.00 31.44 30.83 1lru n GLU 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1lru h ARG 12 N 0.00 0.00 0.00 3.44 3.08 -1.96 -2.74 114.38 116.20 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 0.21 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.26 1lru h ARG 12 CO 0.00 0.00 0.00 -0.07 -1.07 0.00 0.00 179.97 178.83 1lru h LEU 13 N 0.00 0.00 -2.47 3.04 3.38 -1.75 -3.06 115.31 114.46 1lru h LEU 13 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1lru h LEU 13 Cb 0.62 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.37 1lru h LEU 13 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 178.44 179.07 1lru n ARG 14 N -2.71 2.95 -3.19 1.13 5.12 -1.03 -4.11 116.66 114.82 1lru n ARG 14 Ca 0.03 -2.27 -0.36 0.00 -1.93 0.00 0.00 57.85 53.32 1lru n ARG 14 Cb 0.36 -1.67 -0.06 0.00 -1.16 0.00 0.00 32.46 29.93 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 -1.59 4.18 -0.31 5.56 1.02 -1.16 -4.28 119.74 123.15 1lru s LYS 15 Ca 0.41 0.76 -0.19 0.00 0.02 0.00 0.00 55.97 56.96 1lru s LYS 15 Cb 0.25 -2.94 -0.01 0.00 -0.52 0.00 0.00 37.83 34.61 1lru s LYS 15 CO 0.22 0.45 0.59 0.08 -0.92 0.00 0.00 175.35 175.77 1lru s VAL 16 N -1.46 4.97 0.77 3.17 1.01 -1.26 -3.67 120.40 123.93 1lru s VAL 16 Ca 0.40 0.74 -0.14 0.00 0.00 0.00 0.00 61.98 62.97 1lru s VAL 16 Cb -0.17 -3.97 0.06 0.00 0.00 0.00 0.00 36.38 32.30 1lru s VAL 16 CO 0.20 -0.14 1.22 0.00 0.00 0.00 0.00 175.10 176.39 1lru s ALA 17 N 2.53 1.95 0.13 5.51 0.00 -0.99 -4.96 121.76 125.94 1lru s ALA 17 Ca 0.23 0.91 0.04 0.00 0.00 0.00 0.00 51.96 53.14 1lru s ALA 17 Cb -0.15 -3.50 -0.04 0.00 0.00 0.00 0.00 23.12 19.43 1lru s ALA 17 CO 0.12 -2.14 0.11 0.15 0.00 0.00 0.00 175.76 174.00 1lru s LYS 18 N -4.00 2.87 0.51 0.00 1.02 0.39 -4.82 119.74 115.71 1lru s LYS 18 Ca 0.75 -0.81 -0.22 0.00 0.02 0.00 0.00 55.97 55.70 1lru s LYS 18 Cb -0.30 -2.66 -0.06 0.00 -0.52 0.00 0.00 37.83 34.29 1lru s LYS 18 CO 0.48 0.52 1.29 -2.14 -0.92 0.00 0.00 175.35 174.58 1lru s PRO 19 N -2.81 3.40 0.05 -1.68 0.02 -1.26 -0.90 135.00 131.82 1lru s PRO 19 Ca 0.30 2.08 -0.30 0.00 0.02 0.00 0.00 61.00 63.10 1lru s PRO 19 Cb -0.11 -2.34 -0.05 0.00 0.02 0.00 0.00 34.50 32.02 1lru s PRO 19 CO 0.23 -0.94 1.14 0.08 -0.33 0.00 0.00 177.00 177.18 1lru s VAL 20 N -1.38 4.21 -0.05 3.83 1.01 -1.26 -4.77 120.40 121.99 1lru s VAL 20 Ca 0.68 1.60 -0.22 0.00 0.00 0.00 0.00 61.98 64.04 1lru s VAL 20 Cb -0.36 -4.03 -0.31 0.00 0.00 0.00 0.00 36.38 31.67 1lru s VAL 20 CO 0.44 0.13 0.90 -0.08 0.00 0.00 0.00 175.10 176.48 1lru h GLU 21 N 6.70 0.30 -3.01 2.72 4.57 -2.00 -3.47 114.58 120.39 1lru h GLU 21 Ca -0.42 -0.52 -0.17 0.00 -1.18 0.00 0.00 59.36 57.08 1lru h GLU 21 Cb 1.22 0.19 -0.27 0.00 -0.16 0.00 0.00 28.75 29.72 1lru h GLU 21 CO 0.79 1.25 -0.43 -2.00 -1.18 0.00 0.00 179.01 177.44 1lru s GLU 22 N -2.43 0.27 -0.76 1.92 2.12 -1.26 -5.09 118.70 113.47 1lru s GLU 22 Ca -0.14 0.48 -0.24 0.00 0.36 0.00 0.00 54.97 55.44 1lru s GLU 22 Cb 0.01 0.02 0.06 0.00 0.26 0.00 0.00 34.13 34.47 1lru s GLU 22 CO 0.83 -0.10 1.16 0.08 -0.54 0.00 0.00 175.26 176.69 1lru s VAL 23 N 0.76 4.09 0.19 3.70 1.01 -1.26 -4.78 120.40 124.11 1lru s VAL 23 Ca -0.05 -0.26 0.01 0.00 0.00 0.00 0.00 61.98 61.67 1lru s VAL 23 Cb -0.06 -4.83 -0.00 0.00 0.00 0.00 0.00 36.38 31.49 1lru s VAL 23 CO -0.05 -1.67 0.02 -0.46 0.00 0.00 0.00 175.10 172.94 1lru n ASN 24 N 8.35 1.98 0.08 3.32 0.23 -1.26 -4.81 115.26 123.14 1lru n ASN 24 Ca 0.06 -1.89 0.11 0.00 -0.53 0.00 0.00 54.58 52.34 1lru n ASN 24 Cb 0.48 0.25 0.58 0.00 -2.08 0.00 0.00 39.78 39.01 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 1.17 2.06 -0.35 -2.53 0.00 -1.98 -1.30 119.26 116.32 1lru h ALA 25 Ca -0.15 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.66 1lru h ALA 25 Cb 0.50 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 1lru h ALA 25 CO 0.25 -0.12 -0.11 1.49 0.00 0.00 0.00 179.25 180.76 1lru h GLU 26 N 0.20 0.69 -0.31 0.00 4.81 -1.96 -2.46 114.58 115.56 1lru h GLU 26 Ca 0.15 -0.28 -0.03 0.00 -0.13 0.00 0.00 59.36 59.07 1lru h GLU 26 Cb 0.33 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.66 1lru h GLU 26 CO -0.02 0.87 0.08 0.82 -0.73 0.00 0.00 179.01 180.02 1lru h ILE 27 N 0.48 1.22 0.00 2.32 1.08 -1.65 -2.88 117.51 118.08 1lru h ILE 27 Ca 0.09 -0.72 -0.00 0.00 -0.39 0.00 0.00 64.86 63.83 1lru h ILE 27 Cb 0.63 1.11 -0.00 0.00 -3.07 0.00 0.00 36.82 35.48 1lru h ILE 27 CO 0.04 0.24 -0.02 1.56 -0.69 0.00 0.00 178.15 179.28 1lru h GLN 28 N 0.33 0.00 0.09 2.37 4.20 -1.22 -0.79 115.11 120.10 1lru h GLN 28 Ca 0.10 0.00 -0.26 0.00 0.06 0.00 0.00 58.65 58.54 1lru h GLN 28 Cb 0.29 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.06 1lru h GLN 28 CO 0.00 0.02 -1.22 -0.09 -0.67 0.00 0.00 178.83 176.88 1lru h ARG 29 N 0.00 0.20 -0.14 1.46 2.43 -1.23 -2.22 114.38 114.88 1lru h ARG 29 Ca -0.00 -0.34 -0.02 0.00 -0.81 0.00 0.00 59.98 58.81 1lru h ARG 29 Cb 0.07 0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.74 1lru h ARG 29 CO 0.00 1.15 0.03 0.82 -1.51 0.00 0.00 179.97 180.46 1lru h ILE 30 N 0.05 1.21 -0.22 1.20 2.04 -1.01 -1.51 117.51 119.27 1lru h ILE 30 Ca -0.12 -0.67 0.06 0.00 1.00 0.00 0.00 64.86 65.13 1lru h ILE 30 Cb 1.93 1.39 -0.06 0.00 -0.74 0.00 0.00 36.82 39.34 1lru h ILE 30 CO 0.18 0.20 -0.15 0.58 0.00 0.00 0.00 178.15 178.96 1lru h VAL 31 N 0.02 0.57 -0.40 1.67 2.07 -1.30 0.25 116.25 119.13 1lru h VAL 31 Ca 0.04 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.52 1lru h VAL 31 Cb 0.28 0.57 -0.02 0.00 -1.52 0.00 0.00 31.29 30.60 1lru h VAL 31 CO 0.00 0.00 0.05 0.44 0.02 0.00 0.00 177.57 178.08 1lru h ASP 32 N -0.14 0.57 0.36 0.57 3.32 -1.34 -1.04 116.42 118.71 1lru h ASP 32 Ca 0.13 -0.10 -0.14 0.00 0.02 0.00 0.00 57.03 56.94 1lru h ASP 32 Cb 0.33 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.72 1lru h ASP 32 CO -0.31 0.60 -0.57 0.44 -1.72 0.00 0.00 179.24 177.68 1lru h ASP 33 N 0.59 0.25 -0.35 6.45 3.32 -0.20 -1.87 116.42 124.62 1lru h ASP 33 Ca 0.13 -0.14 -0.09 0.00 0.02 0.00 0.00 57.03 56.95 1lru h ASP 33 Cb 0.30 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.76 1lru h ASP 33 CO 0.00 0.77 -0.14 0.24 -1.72 0.00 0.00 179.24 178.39 1lru h MET 34 N 0.17 0.72 -0.63 3.56 2.86 0.15 -0.56 114.93 121.20 1lru h MET 34 Ca -0.00 -0.30 -0.03 0.00 -2.06 0.00 0.00 59.70 57.30 1lru h MET 34 Cb 1.06 -0.03 -0.03 0.00 0.06 0.00 0.00 31.60 32.66 1lru h MET 34 CO 0.09 0.90 0.26 0.74 1.06 0.00 0.00 176.91 179.96 1lru h PHE 35 N 0.50 0.94 -0.60 -0.22 0.05 -1.16 0.40 116.94 116.86 1lru h PHE 35 Ca 0.08 -0.07 -0.04 0.00 3.82 0.00 0.00 57.97 61.77 1lru h PHE 35 Cb 0.67 -0.28 -0.03 0.00 2.00 0.00 0.00 35.95 38.31 1lru h PHE 35 CO 0.06 0.74 0.21 0.93 -0.18 0.00 0.00 178.31 180.07 1lru h GLU 36 N 0.87 0.88 -0.15 1.51 5.08 -1.23 0.28 114.58 121.83 1lru h GLU 36 Ca 0.21 -0.15 -0.15 0.00 -1.00 0.00 0.00 59.36 58.27 1lru h GLU 36 Cb 0.19 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.30 1lru h GLU 36 CO -0.02 0.74 -0.50 1.15 -1.00 0.00 0.00 179.01 179.39 1lru h THR 37 N 0.86 1.34 0.30 1.13 2.02 -0.57 -2.16 112.91 115.84 1lru h THR 37 Ca 0.20 -1.76 -0.01 0.00 0.77 0.00 0.00 66.41 65.60 1lru h THR 37 Cb 0.21 2.03 0.00 0.00 -1.74 0.00 0.00 68.15 68.66 1lru h THR 37 CO -0.01 0.54 -0.14 -0.03 0.37 0.00 0.00 175.52 176.24 1lru h MET 38 N 0.25 -0.39 -0.70 6.66 1.85 0.07 -0.90 114.93 121.77 1lru h MET 38 Ca -0.02 0.03 -0.06 0.00 -0.61 0.00 0.00 59.70 59.03 1lru h MET 38 Cb 1.12 0.09 -0.03 0.00 0.43 0.00 0.00 31.60 33.21 1lru h MET 38 CO 0.11 -0.21 0.19 1.88 -0.40 0.00 0.00 176.91 178.48 1lru h TYR 39 N -0.47 1.14 -0.09 1.39 0.99 -1.05 0.12 116.97 119.00 1lru h TYR 39 Ca -0.04 -0.12 -0.08 0.00 2.00 0.00 0.00 58.73 60.49 1lru h TYR 39 Cb 0.36 -0.33 -0.01 0.00 1.00 0.00 0.00 36.73 37.75 1lru h TYR 39 CO -0.04 0.92 -0.29 0.00 -0.00 0.00 0.00 178.16 178.75 1lru h ALA 40 N 1.16 1.35 -0.02 3.88 0.00 -1.33 -2.18 119.26 122.12 1lru h ALA 40 Ca 0.22 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.83 1lru h ALA 40 Cb 0.33 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1lru h ALA 40 CO -0.00 0.46 -0.02 -1.91 0.00 0.00 0.00 179.25 177.77 1lru n GLU 41 N -4.14 1.77 -3.77 0.00 4.07 -0.35 -4.98 120.64 113.24 1lru n GLU 41 Ca -0.01 -1.17 -0.25 0.00 -0.06 0.00 0.00 57.16 55.66 1lru n GLU 41 Cb 0.38 -1.48 0.04 0.00 -0.06 0.00 0.00 31.44 30.32 1lru n GLU 41 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46 1lru n GLU 42 N 0.40 -5.74 -3.21 5.31 1.02 0.25 -5.02 120.64 113.65 1lru n GLU 42 Ca 0.17 0.65 -0.20 0.00 -0.02 0.00 0.00 57.16 57.77 1lru n GLU 42 Cb 0.41 -5.47 0.02 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 -3.74 1.95 0.00 0.62 0.00 -0.31 -5.01 107.32 100.84 1lru s GLY 43 Ca 0.39 -1.84 0.11 0.00 0.00 0.00 0.00 44.72 43.38 1lru s GLY 43 CO 0.80 -1.65 0.84 0.29 0.00 0.00 0.00 173.10 173.39 1lru n ILE 44 N -1.93 0.00 -3.56 0.90 -5.35 -1.26 -4.62 119.36 103.54 1lru n ILE 44 Ca 0.09 -0.49 -0.09 0.00 -0.27 0.00 0.00 62.75 61.99 1lru n ILE 44 Cb 0.61 1.23 -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 -0.99 -0.44 -0.27 3.28 0.00 -1.26 -0.21 107.32 107.43 1lru s GLY 45 Ca 0.13 0.51 -0.23 0.00 0.00 0.00 0.00 44.72 45.13 1lru s GLY 45 CO 0.15 0.16 0.73 -2.27 0.00 0.00 0.00 173.10 171.88 1lru s LEU 46 N -2.71 -0.78 0.00 0.66 1.98 0.16 -4.95 118.68 113.04 1lru s LEU 46 Ca 0.05 1.43 0.05 0.00 -2.89 0.00 0.00 54.13 52.77 1lru s LEU 46 Cb -0.02 2.41 -0.03 0.00 0.66 0.00 0.00 46.19 49.22 1lru s LEU 46 CO -0.07 -0.24 -0.13 0.00 -1.89 0.00 0.00 176.35 174.02 1lru s ALA 47 N 0.68 2.75 0.24 5.97 0.00 -1.26 -0.45 121.76 129.69 1lru s ALA 47 Ca -0.02 -1.07 -0.08 0.00 0.00 0.00 0.00 51.96 50.78 1lru s ALA 47 Cb -0.05 -0.93 0.41 0.00 0.00 0.00 0.00 23.12 22.55 1lru s ALA 47 CO -0.04 0.58 1.62 0.00 0.00 0.00 0.00 175.76 177.92 1lru h ALA 48 N 4.77 0.72 -1.15 0.00 0.00 -1.55 -1.14 119.26 120.91 1lru h ALA 48 Ca -0.47 0.26 0.34 0.00 0.00 0.00 0.00 54.91 55.03 1lru h ALA 48 Cb 1.16 0.46 -0.11 0.00 0.00 0.00 0.00 17.79 19.30 1lru h ALA 48 CO 0.50 -0.43 0.74 1.15 0.00 0.00 0.00 179.25 181.22 1lru h THR 49 N 0.07 0.35 0.00 0.00 2.02 -1.64 0.85 112.91 114.56 1lru h THR 49 Ca 0.40 -0.09 -0.05 0.00 0.77 0.00 0.00 66.41 67.44 1lru h THR 49 Cb 0.70 0.07 -0.01 0.00 -1.74 0.00 0.00 68.15 67.17 1lru h THR 49 CO -0.70 0.05 -0.26 1.56 0.37 0.00 0.00 175.52 176.53 1lru h GLN 50 N 0.25 0.00 -0.43 6.66 4.20 -1.50 -3.00 115.11 121.30 1lru h GLN 50 Ca 0.69 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.40 1lru h GLN 50 Cb 1.97 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.75 1lru h GLN 50 CO -0.36 0.26 0.00 1.33 -0.67 0.00 0.00 178.83 179.40 1lru n VAL 51 N -3.52 2.44 -2.75 -0.54 0.24 0.25 -0.51 118.33 113.93 1lru n VAL 51 Ca -0.00 -1.61 -0.14 0.00 -2.04 0.00 0.00 64.34 60.55 1lru n VAL 51 Cb 0.42 -0.22 0.02 0.00 -1.47 0.00 0.00 33.84 32.59 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 0.12 -4.46 -3.99 -1.34 2.03 -1.13 -4.85 116.55 102.92 1lru n ASP 52 Ca 0.24 -0.18 -0.31 0.00 0.52 0.00 0.00 54.79 55.06 1lru n ASP 52 Cb 1.02 -3.33 -0.15 0.00 -0.72 0.00 0.00 41.12 37.93 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 -2.94 1.84 -1.18 5.18 1.01 -0.92 -5.00 121.20 119.19 1lru s ILE 53 Ca 0.19 -1.53 -0.05 0.00 0.00 0.00 0.00 60.65 59.27 1lru s ILE 53 Cb -0.09 -2.09 0.11 0.00 0.01 0.00 0.00 42.46 40.41 1lru s ILE 53 CO 0.24 -0.15 2.44 1.41 0.00 0.00 0.00 174.94 178.88 1lru n HIS 54 N 4.53 2.44 -4.26 3.97 8.25 -1.26 -1.99 115.22 126.91 1lru n HIS 54 Ca -0.11 -2.68 -0.19 0.00 -0.26 0.00 0.00 57.72 54.49 1lru n HIS 54 Cb 0.43 -1.75 -0.11 0.00 1.12 0.00 0.00 29.99 29.67 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 -1.30 1.06 -1.25 -0.41 -0.21 -1.26 -0.46 119.66 115.83 1lru s GLN 55 Ca 0.55 -1.25 -0.20 0.00 0.02 0.00 0.00 55.36 54.48 1lru s GLN 55 Cb 0.22 -0.99 0.00 0.00 1.00 0.00 0.00 33.01 33.24 1lru s GLN 55 CO -0.12 0.19 1.83 0.54 -2.12 0.00 0.00 175.29 175.62 1lru n ARG 56 N 0.54 2.53 -4.07 2.91 1.74 -0.08 -4.50 116.66 115.73 1lru n ARG 56 Ca -0.15 -2.92 -0.22 0.00 -0.77 0.00 0.00 57.85 53.79 1lru n ARG 56 Cb 0.57 -3.58 -0.17 0.00 -1.02 0.00 0.00 32.46 28.26 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 6.92 0.57 -0.03 0.55 1.01 -1.26 -0.88 121.20 128.08 1lru s ILE 57 Ca 0.60 -0.10 0.04 0.00 0.00 0.00 0.00 60.65 61.19 1lru s ILE 57 Cb 0.03 -0.62 -0.00 0.00 0.01 0.00 0.00 42.46 41.87 1lru s ILE 57 CO 0.10 0.25 -0.16 -0.63 0.00 0.00 0.00 174.94 174.51 1lru s ILE 58 N 1.22 1.30 -0.11 2.92 1.01 0.23 -1.68 121.20 126.09 1lru s ILE 58 Ca -0.06 -0.66 0.00 0.00 0.00 0.00 0.00 60.65 59.94 1lru s ILE 58 Cb -0.14 -1.11 -0.02 0.00 0.01 0.00 0.00 42.46 41.20 1lru s ILE 58 CO -0.02 0.38 -0.11 -0.69 0.00 0.00 0.00 174.94 174.50 1lru s VAL 59 N -0.02 3.25 -0.05 2.92 1.01 0.40 -1.15 120.40 126.76 1lru s VAL 59 Ca -0.02 -0.61 -0.04 0.00 0.00 0.00 0.00 61.98 61.31 1lru s VAL 59 Cb -0.10 -2.35 0.02 0.00 0.00 0.00 0.00 36.38 33.94 1lru s VAL 59 CO 0.01 0.54 0.12 -0.63 0.00 0.00 0.00 175.10 175.15 1lru s ILE 60 N 0.01 -0.01 -0.25 2.22 1.01 -0.06 0.37 121.20 124.50 1lru s ILE 60 Ca -0.03 0.02 -0.02 0.00 0.00 0.00 0.00 60.65 60.62 1lru s ILE 60 Cb -0.14 -0.18 0.13 0.00 0.01 0.00 0.00 42.46 42.27 1lru s ILE 60 CO 0.04 0.01 0.34 -0.62 0.00 0.00 0.00 174.94 174.71 1lru s ASP 61 N 0.21 0.73 -0.00 3.58 -1.08 0.71 -0.50 116.67 120.31 1lru s ASP 61 Ca -0.01 -0.12 0.20 0.00 -0.52 0.00 0.00 52.55 52.10 1lru s ASP 61 Cb -0.02 0.87 -0.23 0.00 -1.46 0.00 0.00 42.92 42.08 1lru s ASP 61 CO -0.01 -0.33 0.77 0.52 0.52 0.00 0.00 175.17 176.65 1lru n VAL 62 N 5.34 0.00 -1.74 1.11 0.31 -1.26 -4.42 118.33 117.67 1lru n VAL 62 Ca -0.03 -0.10 -0.39 0.00 -0.01 0.00 0.00 64.34 63.81 1lru n VAL 62 Cb 0.49 0.85 0.04 0.00 -0.91 0.00 0.00 33.84 34.31 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 -1.58 2.82 0.11 4.52 3.41 -1.26 -4.92 113.62 116.71 1lru n SER 63 Ca 0.03 1.02 -0.00 0.00 -0.26 0.00 0.00 58.87 59.65 1lru n SER 63 Cb 0.34 -1.58 0.28 0.00 -0.26 0.00 0.00 64.21 62.99 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 1.65 0.22 -0.00 4.33 4.39 -2.01 -1.78 114.58 121.38 1lru h GLU 64 Ca -0.51 -0.09 0.00 0.00 0.34 0.00 0.00 59.36 59.11 1lru h GLU 64 Cb 1.30 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.93 1lru h GLU 64 CO 0.58 0.53 -0.14 0.09 -1.16 0.00 0.00 179.01 178.91 1lru n ASN 65 N -4.10 0.22 -3.45 1.42 3.02 -1.26 -4.96 115.26 106.16 1lru n ASN 65 Ca -0.01 0.01 -0.21 0.00 -0.03 0.00 0.00 54.58 54.34 1lru n ASN 65 Cb 0.41 -0.21 0.06 0.00 -0.61 0.00 0.00 39.78 39.43 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 -1.35 -2.81 -1.09 3.52 1.74 -0.67 -4.95 116.66 111.05 1lru n ARG 66 Ca 0.09 0.72 0.00 0.00 -0.77 0.00 0.00 57.85 57.89 1lru n ARG 66 Cb 0.31 -5.28 -0.01 0.00 -1.02 0.00 0.00 32.46 26.46 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 -3.04 0.23 -3.79 0.55 5.68 -1.26 -5.01 116.55 109.90 1lru n ASP 67 Ca -0.13 -1.90 -0.30 0.00 -0.50 0.00 0.00 54.79 51.96 1lru n ASP 67 Cb 0.63 -0.11 -0.14 0.00 -1.14 0.00 0.00 41.12 40.36 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 0.00 1.41 0.19 0.11 2.02 -1.26 -5.10 118.70 116.07 1lru s GLU 68 Ca 0.16 -2.07 -0.30 0.00 0.02 0.00 0.00 54.97 52.78 1lru s GLU 68 Cb 0.18 -2.59 -0.08 0.00 0.10 0.00 0.00 34.13 31.75 1lru s GLU 68 CO -0.08 -1.12 1.07 1.03 0.02 0.00 0.00 175.26 176.18 1lru s ARG 69 N 0.34 4.64 -0.03 1.61 0.52 -1.26 -4.31 118.95 120.44 1lru s ARG 69 Ca 0.16 1.67 0.01 0.00 -0.52 0.00 0.00 55.73 57.06 1lru s ARG 69 Cb -0.24 -3.28 0.02 0.00 0.52 0.00 0.00 34.95 31.97 1lru s ARG 69 CO -0.02 0.15 -0.03 -1.17 0.02 0.00 0.00 175.30 174.24 1lru s LEU 70 N -0.52 1.38 -0.12 2.53 2.96 0.35 -5.01 118.68 120.24 1lru s LEU 70 Ca 0.48 -0.10 0.03 0.00 -0.22 0.00 0.00 54.13 54.32 1lru s LEU 70 Cb -0.29 -0.37 0.00 0.00 0.50 0.00 0.00 46.19 46.04 1lru s LEU 70 CO 0.35 -0.05 -0.23 -0.69 -1.32 0.00 0.00 176.35 174.41 1lru s VAL 71 N 0.80 2.06 -0.33 1.68 1.01 -1.26 -0.88 120.40 123.49 1lru s VAL 71 Ca -0.10 -1.00 0.01 0.00 0.00 0.00 0.00 61.98 60.89 1lru s VAL 71 Cb -0.13 -1.80 0.08 0.00 0.00 0.00 0.00 36.38 34.53 1lru s VAL 71 CO -0.00 0.55 0.03 -0.76 0.00 0.00 0.00 175.10 174.92 1lru s LEU 72 N 0.57 4.37 -0.20 3.92 1.43 -0.30 -4.43 118.68 124.04 1lru s LEU 72 Ca -0.13 -1.77 -0.05 0.00 -1.03 0.00 0.00 54.13 51.15 1lru s LEU 72 Cb -0.17 -1.67 -0.02 0.00 0.03 0.00 0.00 46.19 44.36 1lru s LEU 72 CO 0.04 -0.34 -0.01 -0.63 0.23 0.00 0.00 176.35 175.64 1lru s ILE 73 N 1.07 3.87 -1.33 -0.59 1.01 -0.57 -0.60 121.20 124.06 1lru s ILE 73 Ca 0.02 -0.34 -0.02 0.00 0.00 0.00 0.00 60.65 60.32 1lru s ILE 73 Cb -0.20 -2.75 0.01 0.00 0.01 0.00 0.00 42.46 39.53 1lru s ILE 73 CO -0.05 0.43 0.74 0.59 0.00 0.00 0.00 174.94 176.65 1lru n ASN 74 N 4.32 -1.68 -4.77 3.58 3.02 -0.06 -0.94 115.26 118.73 1lru n ASN 74 Ca -0.17 -0.81 -0.40 0.00 -0.03 0.00 0.00 54.58 53.17 1lru n ASN 74 Cb 0.52 -4.06 -0.01 0.00 -0.61 0.00 0.00 39.78 35.62 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 -6.05 4.06 -0.17 3.52 0.04 -1.26 -4.57 135.00 130.56 1lru s PRO 75 Ca 0.09 2.18 0.00 0.00 0.04 0.00 0.00 61.00 63.32 1lru s PRO 75 Cb -0.05 -2.83 0.04 0.00 0.04 0.00 0.00 34.50 31.70 1lru s PRO 75 CO 0.81 -0.42 -0.10 -2.00 0.04 0.00 0.00 177.00 175.33 1lru s GLU 76 N -2.14 1.96 -0.39 4.56 2.12 0.19 -4.95 118.70 120.05 1lru s GLU 76 Ca 0.55 -0.66 -0.28 0.00 0.36 0.00 0.00 54.97 54.94 1lru s GLU 76 Cb -0.39 -2.19 -0.02 0.00 0.26 0.00 0.00 34.13 31.79 1lru s GLU 76 CO 0.50 -0.36 1.83 -1.17 -0.54 0.00 0.00 175.26 175.52 1lru s LEU 77 N 1.49 3.46 -0.13 2.70 2.96 -1.26 -0.77 118.68 127.12 1lru s LEU 77 Ca 0.01 1.09 -0.11 0.00 -0.22 0.00 0.00 54.13 54.91 1lru s LEU 77 Cb -0.15 -3.27 -0.09 0.00 0.50 0.00 0.00 46.19 43.19 1lru s LEU 77 CO -0.09 -1.89 0.13 -0.07 -1.32 0.00 0.00 176.35 173.12 1lru h LEU 78 N 14.45 0.00 -8.70 -0.68 3.38 0.21 -3.49 115.31 120.48 1lru h LEU 78 Ca -0.32 -0.27 -0.44 0.00 0.09 0.00 0.00 57.88 56.95 1lru h LEU 78 Cb 1.17 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 41.75 1lru h LEU 78 CO 1.08 0.80 -0.76 -1.61 0.09 0.00 0.00 178.44 178.04 1lru s GLU 79 N -1.98 1.13 -0.14 1.13 2.02 -0.51 -4.97 118.70 115.39 1lru s GLU 79 Ca -0.12 -1.35 -0.11 0.00 0.02 0.00 0.00 54.97 53.41 1lru s GLU 79 Cb 0.01 -1.01 0.04 0.00 0.10 0.00 0.00 34.13 33.27 1lru s GLU 79 CO 0.27 0.19 0.35 0.21 0.02 0.00 0.00 175.26 176.30 1lru s LYS 80 N -2.96 0.38 0.01 1.61 2.20 -1.26 -0.66 119.74 119.07 1lru s LYS 80 Ca 0.13 0.55 -0.18 0.00 -0.36 0.00 0.00 55.97 56.11 1lru s LYS 80 Cb -0.04 0.12 0.03 0.00 -1.51 0.00 0.00 37.83 36.44 1lru s LYS 80 CO 0.04 -0.08 0.40 -1.12 -0.36 0.00 0.00 175.35 174.23 1lru s SER 81 N 0.55 -0.28 0.67 1.43 0.01 -0.63 -5.01 113.70 110.44 1lru s SER 81 Ca -0.03 0.10 0.00 0.00 1.31 0.00 0.00 55.95 57.33 1lru s SER 81 Cb -0.05 0.39 0.00 0.00 0.21 0.00 0.00 66.02 66.58 1lru s SER 81 CO -0.03 -0.58 0.00 0.61 0.41 0.00 0.00 173.24 173.65 1lru n GLY 82 N 0.83 -0.35 3.31 3.44 0.00 -1.26 -0.63 105.19 110.53 1lru n GLY 82 Ca -0.20 -1.04 -0.14 0.00 0.00 0.00 0.00 46.02 44.64 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 0.00 0.76 0.38 1.61 8.01 -1.26 -3.54 118.70 124.66 1lru s GLU 83 Ca 0.00 -0.06 -0.10 0.00 0.01 0.00 0.00 54.97 54.82 1lru s GLU 83 Cb 0.00 0.35 0.03 0.00 -4.31 0.00 0.00 34.13 30.20 1lru s GLU 83 CO 0.00 -0.22 0.66 0.95 0.01 0.00 0.00 175.26 176.67 1lru s THR 84 N -1.26 0.00 -0.30 3.63 -4.23 0.09 -4.42 115.64 109.15 1lru s THR 84 Ca -0.13 -1.25 -0.18 0.00 -1.18 0.00 0.00 61.69 58.95 1lru s THR 84 Cb -0.04 -2.82 0.19 0.00 1.34 0.00 0.00 72.50 71.17 1lru s THR 84 CO 0.06 0.00 1.22 -0.83 -0.54 0.00 0.00 174.62 174.52 1lru s GLY 85 N -3.15 0.39 0.11 3.99 0.00 -1.26 -1.81 107.32 105.58 1lru s GLY 85 Ca 0.22 3.55 0.03 0.00 0.00 0.00 0.00 44.72 48.53 1lru s GLY 85 CO 0.16 2.52 -0.09 -1.50 0.00 0.00 0.00 173.10 174.18 1lru s ILE 86 N 0.87 0.90 -0.22 0.90 1.10 -1.26 -4.92 121.20 118.57 1lru s ILE 86 Ca -0.05 -1.81 -0.29 0.00 -0.51 0.00 0.00 60.65 57.99 1lru s ILE 86 Cb -0.03 -1.55 -0.02 0.00 0.15 0.00 0.00 42.46 41.01 1lru s ILE 86 CO -0.12 -0.70 1.42 -0.70 -2.11 0.00 0.00 174.94 172.74 1lru s GLU 87 N -3.31 3.97 0.22 3.50 2.56 -1.26 -3.03 118.70 121.35 1lru s GLU 87 Ca 0.10 1.56 0.06 0.00 0.00 0.00 0.00 54.97 56.68 1lru s GLU 87 Cb 0.01 -3.91 -0.04 0.00 2.00 0.00 0.00 34.13 32.19 1lru s GLU 87 CO -0.01 -1.06 0.20 -1.21 -0.56 0.00 0.00 175.26 172.62 1lru s GLU 88 N 4.16 3.00 0.04 4.30 2.02 0.90 -4.85 118.70 128.27 1lru s GLU 88 Ca 0.62 -0.94 -0.04 0.00 0.02 0.00 0.00 54.97 54.63 1lru s GLU 88 Cb -0.22 -2.65 -0.02 0.00 0.10 0.00 0.00 34.13 31.35 1lru s GLU 88 CO 0.24 0.44 0.06 0.20 0.02 0.00 0.00 175.26 176.21 1lru s GLY 89 N -3.61 0.22 0.00 -1.39 0.00 -1.26 -1.24 107.32 100.04 1lru s GLY 89 Ca 0.32 -0.64 0.03 0.00 0.00 0.00 0.00 44.72 44.43 1lru s GLY 89 CO 0.25 -0.77 -0.10 0.00 0.00 0.00 0.00 173.10 172.49 1lru h LEU 91 N 5.74 0.00 -0.64 0.00 3.38 -1.96 -1.95 115.31 119.89 1lru h LEU 91 Ca -0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.65 1lru h LEU 91 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 1lru h LEU 91 CO 0.49 0.19 0.00 -1.20 0.09 0.00 0.00 178.44 178.01 1lru n SER 92 N -3.70 0.98 -3.53 -0.43 7.64 -1.26 -4.28 113.62 109.05 1lru n SER 92 Ca -0.01 -1.36 -0.28 0.00 1.01 0.00 0.00 58.87 58.23 1lru n SER 92 Cb 0.31 -0.01 -0.11 0.00 -1.01 0.00 0.00 64.21 63.39 1lru n SER 92 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1lru s ILE 93 N -1.98 0.85 -0.26 0.44 1.01 -0.73 -0.38 121.20 120.14 1lru s ILE 93 Ca 0.40 -2.75 -0.39 0.00 0.00 0.00 0.00 60.65 57.91 1lru s ILE 93 Cb 0.21 -1.59 -0.15 0.00 0.01 0.00 0.00 42.46 40.94 1lru s ILE 93 CO 0.34 -1.12 1.80 -2.65 0.00 0.00 0.00 174.94 173.31 1lru n PRO 94 N 2.98 1.28 -0.80 2.79 -0.02 -1.25 -3.03 135.00 136.95 1lru n PRO 94 Ca 0.23 0.46 0.00 0.00 -2.02 0.00 0.00 63.50 62.17 1lru n PRO 94 Cb 0.42 -2.20 0.00 0.00 -0.02 0.00 0.00 33.50 31.71 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 5.78 -0.68 -3.70 -0.52 1.02 -1.26 -4.69 120.64 116.59 1lru n GLU 95 Ca 0.27 0.17 -0.36 0.00 -0.02 0.00 0.00 57.16 57.23 1lru n GLU 95 Cb 0.16 -4.22 -0.08 0.00 -0.02 0.00 0.00 31.44 27.28 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 -1.09 4.11 0.02 3.49 1.11 -1.17 -5.10 119.66 121.03 1lru s GLN 96 Ca 0.00 -0.13 0.03 0.00 0.01 0.00 0.00 55.36 55.28 1lru s GLN 96 Cb 0.00 -3.39 -0.01 0.00 -1.01 0.00 0.00 33.01 28.60 1lru s GLN 96 CO 0.00 0.35 -0.10 1.03 0.01 0.00 0.00 175.29 176.58 1lru s ARG 97 N 0.19 0.75 0.04 2.91 0.52 -1.26 -4.05 118.95 118.04 1lru s ARG 97 Ca 0.11 -0.52 -0.23 0.00 -0.52 0.00 0.00 55.73 54.57 1lru s ARG 97 Cb -0.12 -0.70 0.05 0.00 0.52 0.00 0.00 34.95 34.71 1lru s ARG 97 CO 0.00 0.18 0.53 0.00 0.02 0.00 0.00 175.30 176.04 1lru s ALA 98 N -0.59 -1.37 0.30 2.13 0.00 -0.38 -4.90 121.76 116.96 1lru s ALA 98 Ca 0.01 0.67 -0.27 0.00 0.00 0.00 0.00 51.96 52.37 1lru s ALA 98 Cb -0.06 0.34 -0.10 0.00 0.00 0.00 0.00 23.12 23.31 1lru s ALA 98 CO 0.00 -0.49 0.95 -1.17 0.00 0.00 0.00 175.76 175.05 1lru s LEU 99 N -1.87 4.41 0.00 0.00 0.20 -1.26 -0.07 118.68 120.10 1lru s LEU 99 Ca -0.06 1.87 0.01 0.00 0.69 0.00 0.00 54.13 56.64 1lru s LEU 99 Cb -0.01 -3.92 -0.01 0.00 -0.43 0.00 0.00 46.19 41.83 1lru s LEU 99 CO -0.00 -0.02 -0.03 -0.69 -0.29 0.00 0.00 176.35 175.32 1lru s VAL 100 N -1.51 0.19 0.04 1.68 1.01 -1.17 -4.92 120.40 115.71 1lru s VAL 100 Ca 0.48 -0.26 -0.29 0.00 0.00 0.00 0.00 61.98 61.91 1lru s VAL 100 Cb -0.21 -0.19 -0.04 0.00 0.00 0.00 0.00 36.38 35.94 1lru s VAL 100 CO 0.26 -0.05 0.93 -2.16 0.00 0.00 0.00 175.10 174.08 1lru s PRO 101 N -0.33 4.59 0.24 2.72 0.04 -1.26 -4.00 135.00 137.00 1lru s PRO 101 Ca -0.02 1.35 0.01 0.00 0.04 0.00 0.00 61.00 62.38 1lru s PRO 101 Cb -0.03 -3.42 -0.05 0.00 0.04 0.00 0.00 34.50 31.04 1lru s PRO 101 CO -0.00 0.08 0.09 1.03 0.04 0.00 0.00 177.00 178.24 1lru s ARG 102 N 0.54 1.35 0.39 4.56 1.81 -0.75 -4.99 118.95 121.87 1lru s ARG 102 Ca 0.48 -1.72 -0.23 0.00 -1.72 0.00 0.00 55.73 52.53 1lru s ARG 102 Cb -0.21 -0.19 -0.10 0.00 -0.45 0.00 0.00 34.95 34.00 1lru s ARG 102 CO 0.27 -0.29 0.98 0.00 -0.68 0.00 0.00 175.30 175.58 1lru s ALA 103 N -3.80 3.09 0.05 2.13 0.00 -1.26 -0.73 121.76 121.23 1lru s ALA 103 Ca 0.37 0.52 -0.16 0.00 0.00 0.00 0.00 51.96 52.69 1lru s ALA 103 Cb 0.08 -3.20 -0.25 0.00 0.00 0.00 0.00 23.12 19.74 1lru s ALA 103 CO 0.12 0.03 1.13 1.49 0.00 0.00 0.00 175.76 178.54 1lru h GLU 104 N 2.41 0.61 -6.58 0.00 4.81 -0.92 -3.42 114.58 111.50 1lru h GLU 104 Ca -0.48 -0.71 -0.69 0.00 -0.13 0.00 0.00 59.36 57.35 1lru h GLU 104 Cb 1.19 0.22 -0.29 0.00 0.63 0.00 0.00 28.75 30.50 1lru h GLU 104 CO 0.62 1.30 -0.88 0.15 -0.73 0.00 0.00 179.01 179.47 1lru s LYS 105 N -3.16 1.99 -0.07 1.92 1.02 -0.54 -3.87 119.74 117.04 1lru s LYS 105 Ca -0.11 -0.96 -0.03 0.00 0.02 0.00 0.00 55.97 54.90 1lru s LYS 105 Cb 0.06 -1.98 0.04 0.00 -0.52 0.00 0.00 37.83 35.42 1lru s LYS 105 CO 0.90 0.54 0.15 0.54 -0.92 0.00 0.00 175.35 176.55 1lru s VAL 106 N -0.65 -0.05 -0.16 3.17 0.11 -0.20 -1.61 120.40 121.02 1lru s VAL 106 Ca 0.10 0.17 0.01 0.00 -2.93 0.00 0.00 61.98 59.33 1lru s VAL 106 Cb -0.10 -0.24 0.00 0.00 -1.53 0.00 0.00 36.38 34.52 1lru s VAL 106 CO -0.00 0.07 -0.17 -0.75 -3.33 0.00 0.00 175.10 170.92 1lru s LYS 107 N 1.13 3.14 0.38 1.54 2.20 0.17 -0.37 119.74 127.93 1lru s LYS 107 Ca -0.09 -0.78 0.05 0.00 -0.36 0.00 0.00 55.97 54.79 1lru s LYS 107 Cb -0.11 -2.60 -0.07 0.00 -1.51 0.00 0.00 37.83 33.54 1lru s LYS 107 CO -0.06 -0.05 0.03 0.96 -0.36 0.00 0.00 175.35 175.87 1lru s ILE 108 N 0.96 1.60 -0.02 5.43 -4.36 -0.60 0.91 121.20 125.13 1lru s ILE 108 Ca -0.03 -2.00 0.04 0.00 -0.26 0.00 0.00 60.65 58.40 1lru s ILE 108 Cb -0.15 -2.88 -0.00 0.00 1.25 0.00 0.00 42.46 40.68 1lru s ILE 108 CO -0.03 0.00 -0.13 -0.60 0.24 0.00 0.00 174.94 174.42 1lru s ARG 109 N -3.79 1.21 0.38 0.37 3.52 0.05 -1.50 118.95 119.18 1lru s ARG 109 Ca 0.35 -0.44 -0.14 0.00 -0.13 0.00 0.00 55.73 55.37 1lru s ARG 109 Cb 0.09 -1.11 0.05 0.00 -1.56 0.00 0.00 34.95 32.42 1lru s ARG 109 CO 0.16 0.21 0.75 0.00 -0.81 0.00 0.00 175.30 175.61 1lru s ALA 110 N -0.03 -0.50 -0.11 6.12 0.00 0.63 0.54 121.76 128.42 1lru s ALA 110 Ca -0.00 -0.88 0.00 0.00 0.00 0.00 0.00 51.96 51.08 1lru s ALA 110 Cb -0.08 0.74 -0.02 0.00 0.00 0.00 0.00 23.12 23.76 1lru s ALA 110 CO 0.01 -0.96 -0.12 -0.51 0.00 0.00 0.00 175.76 174.18 1lru s LEU 111 N -3.10 2.83 0.00 0.00 1.43 -0.12 -0.16 118.68 119.56 1lru s LEU 111 Ca 0.18 -0.24 -0.07 0.00 -1.03 0.00 0.00 54.13 52.97 1lru s LEU 111 Cb -0.04 -1.63 0.11 0.00 0.03 0.00 0.00 46.19 44.66 1lru s LEU 111 CO 0.13 0.23 0.66 -0.90 0.23 0.00 0.00 176.35 176.70 1lru n ASP 112 N 3.09 0.22 0.16 2.29 5.68 -0.56 -1.51 116.55 125.92 1lru n ASP 112 Ca -0.18 -1.34 0.18 0.00 -0.50 0.00 0.00 54.79 52.95 1lru n ASP 112 Cb 0.53 -0.49 0.79 0.00 -1.14 0.00 0.00 41.12 40.80 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 -0.31 0.11 2.43 -1.90 0.57 114.38 115.27 1lru h ARG 113 Ca -0.21 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.96 1lru h ARG 113 Cb 0.63 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.18 1lru h ARG 113 CO 0.17 0.00 0.00 -0.25 -1.51 0.00 0.00 179.97 178.38 1lru n ASP 114 N -3.90 3.01 -0.16 -3.80 8.00 -1.26 -4.84 116.55 113.60 1lru n ASP 114 Ca 0.04 -1.93 -0.02 0.00 0.71 0.00 0.00 54.79 53.59 1lru n ASP 114 Cb 0.41 -0.20 -0.01 0.00 -0.02 0.00 0.00 41.12 41.30 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 1.41 0.55 3.70 0.44 0.00 0.20 -4.98 105.19 106.51 1lru n GLY 115 Ca 0.18 -0.44 -0.39 0.00 0.00 0.00 0.00 46.02 45.37 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 -1.38 4.36 0.49 1.61 1.02 -1.26 -4.66 119.74 119.92 1lru s LYS 116 Ca 0.00 0.70 -0.24 0.00 0.02 0.00 0.00 55.97 56.45 1lru s LYS 116 Cb 0.00 -3.48 -0.07 0.00 -0.52 0.00 0.00 37.83 33.76 1lru s LYS 116 CO 0.00 0.01 1.40 -2.14 -0.92 0.00 0.00 175.35 173.70 1lru s PRO 117 N 1.03 3.47 0.03 -1.68 0.02 -1.26 -1.50 135.00 135.11 1lru s PRO 117 Ca 0.32 2.35 -0.22 0.00 0.02 0.00 0.00 61.00 63.47 1lru s PRO 117 Cb -0.16 -2.50 0.05 0.00 0.02 0.00 0.00 34.50 31.90 1lru s PRO 117 CO 0.14 -0.97 0.49 -0.59 -0.33 0.00 0.00 177.00 175.74 1lru s PHE 118 N -1.24 -0.39 -0.06 6.54 -0.12 0.77 -4.92 117.98 118.57 1lru s PHE 118 Ca 0.65 0.47 0.03 0.00 -0.05 0.00 0.00 56.93 58.03 1lru s PHE 118 Cb -0.42 0.30 -0.02 0.00 -0.63 0.00 0.00 43.02 42.24 1lru s PHE 118 CO 0.53 -0.60 -0.15 -1.21 -0.05 0.00 0.00 175.22 173.74 1lru s GLU 119 N -2.20 2.61 -0.02 1.99 2.02 -1.26 -0.27 118.70 121.57 1lru s GLU 119 Ca -0.07 -0.71 0.01 0.00 0.02 0.00 0.00 54.97 54.22 1lru s GLU 119 Cb -0.01 -2.39 0.02 0.00 0.10 0.00 0.00 34.13 31.84 1lru s GLU 119 CO 0.00 0.56 -0.01 -1.17 0.02 0.00 0.00 175.26 174.66 1lru s LEU 120 N -0.57 1.48 -0.32 1.80 2.96 -0.56 -5.00 118.68 118.48 1lru s LEU 120 Ca 0.08 -0.04 -0.08 0.00 -0.22 0.00 0.00 54.13 53.87 1lru s LEU 120 Cb -0.11 -0.20 0.02 0.00 0.50 0.00 0.00 46.19 46.39 1lru s LEU 120 CO 0.01 -0.05 0.11 -1.61 -1.32 0.00 0.00 176.35 173.50 1lru s GLU 121 N 0.61 3.00 0.03 1.98 2.02 -1.26 -1.56 118.70 123.52 1lru s GLU 121 Ca -0.06 -0.93 0.04 0.00 0.02 0.00 0.00 54.97 54.04 1lru s GLU 121 Cb -0.09 -3.47 -0.04 0.00 0.10 0.00 0.00 34.13 30.63 1lru s GLU 121 CO -0.01 -0.52 -0.08 0.00 0.02 0.00 0.00 175.26 174.67 1lru s ALA 122 N 1.51 2.99 0.28 5.21 0.00 0.50 -4.99 121.76 127.26 1lru s ALA 122 Ca 0.02 -1.08 0.02 0.00 0.00 0.00 0.00 51.96 50.92 1lru s ALA 122 Cb -0.18 -1.06 -0.04 0.00 0.00 0.00 0.00 23.12 21.84 1lru s ALA 122 CO 0.04 0.62 0.13 -0.51 0.00 0.00 0.00 175.76 176.04 1lru s ASP 123 N -1.63 1.36 0.74 0.00 1.01 -1.26 -1.03 116.67 115.86 1lru s ASP 123 Ca 0.18 -1.48 0.00 0.00 0.71 0.00 0.00 52.55 51.96 1lru s ASP 123 Cb -0.11 0.29 0.00 0.00 1.01 0.00 0.00 42.92 44.11 1lru s ASP 123 CO 0.09 -0.82 0.00 0.61 0.21 0.00 0.00 175.17 175.26 1lru n GLY 124 N -0.53 2.04 0.36 0.21 0.00 -1.25 -2.42 105.19 103.60 1lru n GLY 124 Ca 0.00 -0.43 0.07 0.00 0.00 0.00 0.00 46.02 45.67 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 0.75 0.32 0.99 5.85 -1.99 -2.10 115.31 119.13 1lru h LEU 125 Ca 0.00 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.72 1lru h LEU 125 Cb 0.00 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 40.89 1lru h LEU 125 CO 0.00 0.46 -0.16 0.25 -0.34 0.00 0.00 178.44 178.66 1lru h LEU 126 N 0.84 -0.37 -0.90 2.25 5.85 -1.94 0.13 115.31 121.17 1lru h LEU 126 Ca 0.37 -0.00 0.10 0.00 0.84 0.00 0.00 57.88 59.18 1lru h LEU 126 Cb 0.34 0.10 -0.07 0.00 0.37 0.00 0.00 40.66 41.39 1lru h LEU 126 CO -0.14 -0.24 0.54 0.00 -0.34 0.00 0.00 178.44 178.26 1lru h ALA 127 N 0.21 1.29 -0.29 1.25 0.00 -1.16 -1.08 119.26 119.48 1lru h ALA 127 Ca -0.04 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 1lru h ALA 127 Cb 0.35 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1lru h ALA 127 CO 0.07 0.19 0.02 0.82 0.00 0.00 0.00 179.25 180.35 1lru h ILE 128 N 0.90 1.24 -0.05 0.00 2.04 -0.96 -3.08 117.51 117.61 1lru h ILE 128 Ca 0.43 -0.86 0.00 0.00 1.00 0.00 0.00 64.86 65.43 1lru h ILE 128 Cb 0.36 1.25 -0.00 0.00 -0.74 0.00 0.00 36.82 37.69 1lru h ILE 128 CO -0.24 0.28 0.03 0.00 0.00 0.00 0.00 178.15 178.22 1lru h ILE 130 N 0.06 0.65 -0.68 0.00 2.04 -1.26 -1.78 117.51 116.53 1lru h ILE 130 Ca 0.02 -0.09 -0.03 0.00 1.00 0.00 0.00 64.86 65.76 1lru h ILE 130 Cb -0.00 0.37 -0.03 0.00 -0.74 0.00 0.00 36.82 36.42 1lru h ILE 130 CO -0.00 0.05 0.29 1.56 0.00 0.00 0.00 178.15 180.04 1lru h GLN 131 N 0.25 1.01 -0.93 2.37 4.20 -1.42 -0.43 115.11 120.16 1lru h GLN 131 Ca 0.31 -0.17 -0.01 0.00 0.06 0.00 0.00 58.65 58.84 1lru h GLN 131 Cb 0.45 -0.17 -0.04 0.00 0.30 0.00 0.00 27.48 28.02 1lru h GLN 131 CO -0.40 0.82 0.54 1.25 -0.67 0.00 0.00 178.83 180.38 1lru h HIS 132 N 0.96 1.24 -0.03 2.96 2.76 -1.03 -1.93 115.15 120.09 1lru h HIS 132 Ca 0.23 -0.01 -0.03 0.00 -2.20 0.00 0.00 60.37 58.35 1lru h HIS 132 Cb 0.18 -0.40 0.00 0.00 1.55 0.00 0.00 27.41 28.74 1lru h HIS 132 CO 0.01 0.83 -0.12 0.93 -1.30 0.00 0.00 177.93 178.29 1lru h GLU 133 N 1.28 0.13 -0.17 5.26 4.39 -1.10 -3.14 114.58 121.24 1lru h GLU 133 Ca 0.33 -0.10 0.05 0.00 0.34 0.00 0.00 59.36 59.98 1lru h GLU 133 Cb -0.03 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.63 1lru h GLU 133 CO -0.06 0.75 0.14 0.52 -1.16 0.00 0.00 179.01 179.19 1lru h MET 134 N -0.46 0.00 -0.41 2.33 2.86 -1.02 0.11 114.93 118.34 1lru h MET 134 Ca -0.01 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.52 1lru h MET 134 Cb 0.77 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.41 1lru h MET 134 CO 0.02 0.00 -0.20 -0.44 1.06 0.00 0.00 176.91 177.36 1lru h ASP 135 N 0.00 0.81 -0.90 1.22 5.19 -1.36 -3.18 116.42 118.19 1lru h ASP 135 Ca 0.08 -0.28 0.06 0.00 -0.62 0.00 0.00 57.03 56.27 1lru h ASP 135 Cb 0.35 -0.22 -0.06 0.00 0.18 0.00 0.00 39.33 39.58 1lru h ASP 135 CO -0.00 0.99 0.57 0.45 -3.12 0.00 0.00 179.24 178.13 1lru h HIS 136 N 0.70 1.06 0.00 4.55 3.86 -0.88 -0.51 115.15 123.93 1lru h HIS 136 Ca 0.10 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.34 1lru h HIS 136 Cb 0.71 -0.34 0.00 0.00 1.06 0.00 0.00 27.41 28.83 1lru h HIS 136 CO 0.04 0.54 0.00 1.28 0.86 0.00 0.00 177.93 180.65 1lru n LEU 137 N -4.58 0.00 -0.48 2.43 4.77 -1.18 -2.41 117.00 115.55 1lru n LEU 137 Ca 0.13 0.00 0.03 0.00 -0.03 0.00 0.00 56.01 56.14 1lru n LEU 137 Cb 0.17 0.00 0.04 0.00 -2.33 0.00 0.00 43.42 41.31 1lru n LEU 137 CO 0.31 0.00 0.31 1.33 -1.33 0.00 0.00 177.39 178.02 1lru n VAL 138 N -0.79 0.51 -1.06 4.08 0.24 -0.76 -2.34 118.33 118.21 1lru n VAL 138 Ca 0.06 -0.72 -0.02 0.00 -2.04 0.00 0.00 64.34 61.62 1lru n VAL 138 Cb 0.03 0.34 -0.01 0.00 -1.47 0.00 0.00 33.84 32.73 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 -0.33 0.54 3.55 7.63 0.00 -1.01 -4.79 105.19 110.77 1lru n GLY 139 Ca 0.05 -0.34 -0.36 0.00 0.00 0.00 0.00 46.02 45.37 1lru n GLY 139 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lru s LYS 140 N -1.28 3.84 0.19 1.61 1.02 -0.27 -4.58 119.74 120.26 1lru s LYS 140 Ca 0.00 -0.39 0.06 0.00 0.02 0.00 0.00 55.97 55.66 1lru s LYS 140 Cb 0.00 -3.35 -0.04 0.00 -0.52 0.00 0.00 37.83 33.92 1lru s LYS 140 CO 0.00 -0.01 0.12 -0.51 -0.92 0.00 0.00 175.35 174.04 1lru s LEU 141 N 1.16 3.70 0.34 3.17 1.43 -1.26 -3.03 118.68 124.18 1lru s LEU 141 Ca 0.05 -0.23 0.02 0.00 -1.03 0.00 0.00 54.13 52.95 1lru s LEU 141 Cb -0.14 -2.29 0.60 0.00 0.03 0.00 0.00 46.19 44.39 1lru s LEU 141 CO 0.04 0.04 1.95 2.19 0.23 0.00 0.00 176.35 180.80 1lru h PHE 142 N 2.18 0.73 0.00 0.29 -5.15 -1.98 -2.41 116.94 110.60 1lru h PHE 142 Ca -0.48 -0.02 0.00 0.00 -0.20 0.00 0.00 57.97 57.28 1lru h PHE 142 Cb 1.21 -0.23 0.00 0.00 0.22 0.00 0.00 35.95 37.15 1lru h PHE 142 CO 0.59 0.54 0.00 0.00 -2.00 0.00 0.00 178.31 177.43 1lru n MET 143 N -4.38 0.15 0.00 6.09 0.00 -1.26 -1.85 117.12 115.87 1lru n MET 143 Ca 0.04 0.63 0.10 0.00 0.00 0.00 0.00 57.70 58.47 1lru n MET 143 Cb 0.12 -1.97 0.49 0.00 0.00 0.00 0.00 33.22 31.87 1lru n MET 143 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 1lru n ASP 144 N -2.28 0.00 0.02 3.17 8.00 -0.91 -2.87 116.55 121.69 1lru n ASP 144 Ca -0.01 0.21 0.12 0.00 0.71 0.00 0.00 54.79 55.81 1lru n ASP 144 Cb 0.05 -0.38 0.14 0.00 -0.02 0.00 0.00 41.12 40.92 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 -1.38 0.23 -2.60 1.24 4.02 -0.77 -4.94 117.16 112.96 1lru n TYR 145 Ca 0.08 0.07 -0.26 0.00 -0.01 0.00 0.00 57.90 57.78 1lru n TYR 145 Cb 0.20 -0.40 0.02 0.00 -0.02 0.00 0.00 39.34 39.14 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 -3.60 3.43 0.83 7.72 1.43 -1.14 -5.02 118.68 122.34 1lru s LEU 146 Ca 0.07 0.67 -0.11 0.00 -1.03 0.00 0.00 54.13 53.74 1lru s LEU 146 Cb 0.15 -3.54 0.10 0.00 0.03 0.00 0.00 46.19 42.93 1lru s LEU 146 CO 0.74 -0.85 1.14 -0.94 0.23 0.00 0.00 176.35 176.67 1lru s SER 147 N -4.23 3.66 0.28 2.29 1.04 -1.26 -4.70 113.70 110.77 1lru s SER 147 Ca 0.51 2.10 -0.00 0.00 0.48 0.00 0.00 55.95 59.04 1lru s SER 147 Cb -0.10 -2.56 0.51 0.00 0.10 0.00 0.00 66.02 63.97 1lru s SER 147 CO 0.43 -2.61 1.84 -0.65 0.98 0.00 0.00 173.24 173.24 1lru h PRO 148 N -1.34 0.98 -0.71 4.02 0.11 -1.97 -0.48 132.00 132.61 1lru h PRO 148 Ca -0.44 -0.06 -0.03 0.00 0.11 0.00 0.00 66.00 65.58 1lru h PRO 148 Cb 1.26 -0.22 -0.03 0.00 0.11 0.00 0.00 31.00 32.12 1lru h PRO 148 CO 0.46 0.65 0.33 1.25 -0.21 0.00 0.00 178.00 180.48 1lru h LEU 149 N 1.01 0.95 -0.10 2.35 6.46 -2.00 -1.84 115.31 122.14 1lru h LEU 149 Ca 0.48 -0.14 -0.01 0.00 -0.12 0.00 0.00 57.88 58.08 1lru h LEU 149 Cb 0.41 -0.24 -0.00 0.00 -0.73 0.00 0.00 40.66 40.09 1lru h LEU 149 CO -0.25 0.83 0.01 0.11 -0.62 0.00 0.00 178.44 178.52 1lru h LYS 150 N 1.00 0.17 -0.95 1.25 6.56 -1.61 -2.89 116.57 120.10 1lru h LYS 150 Ca 0.24 -0.05 0.13 0.00 -1.06 0.00 0.00 60.65 59.91 1lru h LYS 150 Cb 0.14 -0.02 -0.08 0.00 -0.57 0.00 0.00 32.23 31.71 1lru h LYS 150 CO -0.03 0.39 0.60 1.96 -2.06 0.00 0.00 179.45 180.31 1lru h GLN 151 N -0.08 0.84 -0.46 3.15 4.20 -0.94 -2.14 115.11 119.69 1lru h GLN 151 Ca 0.03 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 58.66 1lru h GLN 151 Cb 0.30 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 27.87 1lru h GLN 151 CO 0.00 0.55 0.18 1.96 -0.67 0.00 0.00 178.83 180.86 1lru h GLN 152 N 0.86 0.69 -0.42 1.46 4.20 -1.20 -1.88 115.11 118.82 1lru h GLN 152 Ca 0.47 -0.12 -0.01 0.00 0.06 0.00 0.00 58.65 59.05 1lru h GLN 152 Cb 0.57 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.22 1lru h GLN 152 CO -0.23 0.62 0.24 0.00 -0.67 0.00 0.00 178.83 178.79 1lru h ARG 153 N 0.60 0.57 -0.04 1.46 3.08 -1.20 -1.86 114.38 116.99 1lru h ARG 153 Ca 0.15 -0.06 0.03 0.00 0.07 0.00 0.00 59.98 60.17 1lru h ARG 153 Cb 0.19 -0.12 -0.04 0.00 0.08 0.00 0.00 29.97 30.09 1lru h ARG 153 CO -0.01 0.44 -0.16 0.82 -1.07 0.00 0.00 179.97 179.99 1lru h ILE 154 N 0.54 0.59 -0.58 2.04 2.04 -1.20 0.91 117.51 121.86 1lru h ILE 154 Ca 0.15 0.00 0.10 0.00 1.00 0.00 0.00 64.86 66.11 1lru h ILE 154 Cb 0.03 0.59 -0.08 0.00 -0.74 0.00 0.00 36.82 36.62 1lru h ILE 154 CO -0.03 0.00 0.16 0.03 0.00 0.00 0.00 178.15 178.31 1lru h ARG 155 N -0.25 0.30 -0.63 2.37 3.08 -1.10 -0.01 114.38 118.14 1lru h ARG 155 Ca 0.07 -0.02 -0.06 0.00 0.07 0.00 0.00 59.98 60.04 1lru h ARG 155 Cb 0.34 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.30 1lru h ARG 155 CO -0.19 0.20 0.15 1.96 -1.07 0.00 0.00 179.97 181.02 1lru h GLN 156 N 0.31 1.00 -0.26 0.04 4.20 -0.67 0.57 115.11 120.31 1lru h GLN 156 Ca 0.29 -0.24 -0.05 0.00 0.06 0.00 0.00 58.65 58.71 1lru h GLN 156 Cb 0.40 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.04 1lru h GLN 156 CO -0.34 0.91 -0.04 0.87 -0.67 0.00 0.00 178.83 179.56 1lru h LYS 157 N 0.92 0.49 -0.54 1.46 1.57 -0.08 -3.04 116.57 117.35 1lru h LYS 157 Ca 0.20 -0.18 -0.09 0.00 -1.87 0.00 0.00 60.65 58.71 1lru h LYS 157 Cb 0.36 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.61 1lru h LYS 157 CO 0.00 0.69 -0.02 0.28 -0.57 0.00 0.00 179.45 179.83 1lru h VAL 158 N 0.25 1.26 0.00 0.50 2.07 -0.99 -3.01 116.25 116.33 1lru h VAL 158 Ca 0.07 -1.12 0.00 0.00 0.82 0.00 0.00 66.70 66.47 1lru h VAL 158 Cb 0.49 0.86 0.00 0.00 -1.52 0.00 0.00 31.29 31.12 1lru h VAL 158 CO 0.02 0.40 0.00 -0.62 0.02 0.00 0.00 177.57 177.39 1lru n GLU 159 N -4.18 0.50 0.00 1.57 4.71 0.19 -2.04 120.64 121.39 1lru n GLU 159 Ca 0.03 0.00 0.01 0.00 -0.01 0.00 0.00 57.16 57.19 1lru n GLU 159 Cb 0.34 -1.04 0.00 0.00 -1.01 0.00 0.00 31.44 29.73 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 -0.38 1.82 0.00 3.49 2.85 -1.14 -5.02 118.16 119.78 1lru n LYS 160 Ca 0.00 -0.41 0.12 0.00 -1.05 0.00 0.00 58.31 56.98 1lru n LYS 160 Cb 0.02 -0.88 0.20 0.00 -0.65 0.00 0.00 35.03 33.72 1lru n LYS 160 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63