#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rlw s SER 17 N 0.00 0.68 0.05 4.04 0.15 -1.26 -4.33 113.70 113.02 1rlw s SER 17 Ca 0.00 -0.07 0.06 0.00 0.70 0.00 0.00 55.95 56.65 1rlw s SER 17 Cb 0.00 -0.32 -0.03 0.00 -1.71 0.00 0.00 66.02 63.96 1rlw s SER 17 CO 0.00 -0.09 -0.15 -1.00 1.20 0.00 0.00 173.24 173.21 1rlw s HIS 18 N 1.02 2.65 -0.40 3.44 4.02 0.53 -4.25 115.29 122.30 1rlw s HIS 18 Ca -0.10 -0.20 -0.18 0.00 1.02 0.00 0.00 55.06 55.60 1rlw s HIS 18 Cb -0.14 -1.48 0.01 0.00 -1.02 0.00 0.00 32.58 29.95 1rlw s HIS 18 CO -0.01 0.31 0.52 0.21 1.02 0.00 0.00 174.74 176.78 1rlw s LYS 19 N -1.57 3.36 -0.36 1.40 2.20 0.16 -0.36 119.74 124.57 1rlw s LYS 19 Ca 0.16 -0.41 -0.11 0.00 -0.36 0.00 0.00 55.97 55.25 1rlw s LYS 19 Cb -0.11 -3.90 0.02 0.00 -1.51 0.00 0.00 37.83 32.33 1rlw s LYS 19 CO 0.07 -0.80 0.20 0.12 -0.36 0.00 0.00 175.35 174.58 1rlw s PHE 20 N 2.42 3.23 -0.19 4.03 5.36 0.67 -1.07 117.98 132.42 1rlw s PHE 20 Ca 0.17 -0.79 -0.09 0.00 -0.96 0.00 0.00 56.93 55.27 1rlw s PHE 20 Cb -0.16 -2.43 -0.05 0.00 -0.34 0.00 0.00 43.02 40.04 1rlw s PHE 20 CO 0.15 -0.58 0.10 0.99 -1.46 0.00 0.00 175.22 174.42 1rlw s THR 21 N 1.59 5.17 -0.18 0.12 2.01 0.11 -0.91 115.64 123.54 1rlw s THR 21 Ca 0.03 0.10 0.01 0.00 0.31 0.00 0.00 61.69 62.14 1rlw s THR 21 Cb -0.18 -3.35 0.02 0.00 0.01 0.00 0.00 72.50 69.00 1rlw s THR 21 CO 0.07 0.45 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.57 1rlw s VAL 22 N 0.35 2.01 -0.35 3.82 1.01 0.88 -0.41 120.40 127.71 1rlw s VAL 22 Ca 0.06 -0.93 -0.12 0.00 0.00 0.00 0.00 61.98 61.00 1rlw s VAL 22 Cb -0.12 -1.83 0.01 0.00 0.00 0.00 0.00 36.38 34.44 1rlw s VAL 22 CO -0.01 0.52 0.21 -0.69 0.00 0.00 0.00 175.10 175.13 1rlw s VAL 23 N 1.30 4.81 -0.61 2.92 1.01 0.48 -0.06 120.40 130.26 1rlw s VAL 23 Ca 0.05 -0.58 -0.25 0.00 0.00 0.00 0.00 61.98 61.19 1rlw s VAL 23 Cb -0.13 -3.58 0.04 0.00 0.00 0.00 0.00 36.38 32.71 1rlw s VAL 23 CO -0.13 -0.12 1.07 -0.69 0.00 0.00 0.00 175.10 175.24 1rlw s VAL 24 N 1.62 4.15 -0.02 2.92 1.01 0.91 -1.28 120.40 129.71 1rlw s VAL 24 Ca 0.04 0.35 -0.00 0.00 0.00 0.00 0.00 61.98 62.37 1rlw s VAL 24 Cb -0.18 -4.69 -0.00 0.00 0.00 0.00 0.00 36.38 31.51 1rlw s VAL 24 CO 0.08 -1.38 -0.01 -0.07 0.00 0.00 0.00 175.10 173.72 1rlw h LEU 25 N 11.68 0.00 -7.96 3.92 3.38 -1.64 0.44 115.31 125.12 1rlw h LEU 25 Ca -0.27 0.00 0.05 0.00 0.09 0.00 0.00 57.88 57.76 1rlw h LEU 25 Cb 1.06 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 41.76 1rlw h LEU 25 CO 1.17 0.10 0.20 0.00 0.09 0.00 0.00 178.44 180.00 1rlw s ARG 26 N -1.13 1.74 0.05 1.13 3.03 -1.18 0.61 118.95 123.20 1rlw s ARG 26 Ca -0.01 -0.98 0.01 0.00 2.03 0.00 0.00 55.73 56.78 1rlw s ARG 26 Cb 0.00 0.60 -0.03 0.00 -1.03 0.00 0.00 34.95 34.49 1rlw s ARG 26 CO 0.01 -0.79 -0.05 0.00 -1.13 0.00 0.00 175.30 173.34 1rlw s ALA 27 N -3.92 0.51 0.01 7.88 0.00 0.25 0.17 121.76 126.66 1rlw s ALA 27 Ca 0.11 -0.91 0.03 0.00 0.00 0.00 0.00 51.96 51.19 1rlw s ALA 27 Cb -0.05 0.14 -0.01 0.00 0.00 0.00 0.00 23.12 23.19 1rlw s ALA 27 CO 0.06 -0.16 -0.09 0.95 0.00 0.00 0.00 175.76 176.52 1rlw s THR 28 N -2.29 0.68 -1.26 0.00 -4.23 0.14 -2.94 115.64 105.74 1rlw s THR 28 Ca -0.04 -0.54 -0.02 0.00 -1.18 0.00 0.00 61.69 59.91 1rlw s THR 28 Cb -0.04 -0.61 0.01 0.00 1.34 0.00 0.00 72.50 73.20 1rlw s THR 28 CO -0.03 0.07 0.96 0.29 -0.54 0.00 0.00 174.62 175.38 1rlw n LYS 29 N 2.54 -6.43 -2.07 3.99 4.76 -0.46 -1.37 118.16 119.13 1rlw n LYS 29 Ca -0.15 0.79 -0.42 0.00 -2.87 0.00 0.00 58.31 55.65 1rlw n LYS 29 Cb 0.57 -5.71 -0.03 0.00 -1.84 0.00 0.00 35.03 28.02 1rlw n LYS 29 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 1rlw s VAL 30 N -3.42 3.08 0.00 -0.18 1.01 0.21 -4.04 120.40 117.07 1rlw s VAL 30 Ca 0.12 0.74 -0.14 0.00 0.00 0.00 0.00 61.98 62.70 1rlw s VAL 30 Cb -0.06 -3.47 0.02 0.00 0.00 0.00 0.00 36.38 32.87 1rlw s VAL 30 CO 0.75 0.05 0.30 0.28 0.00 0.00 0.00 175.10 176.48 1rlw s THR 31 N 1.40 0.07 -2.63 3.92 -1.32 -1.26 -4.73 115.64 111.09 1rlw s THR 31 Ca 0.67 -0.55 0.21 0.00 -1.21 0.00 0.00 61.69 60.81 1rlw s THR 31 Cb -0.39 -0.70 0.16 0.00 -1.51 0.00 0.00 72.50 70.06 1rlw s THR 31 CO 0.30 -0.30 1.17 0.29 -2.21 0.00 0.00 174.62 173.87 1rlw n LYS 32 N 1.08 1.92 0.00 7.08 4.01 -1.26 -5.01 118.16 125.97 1rlw n LYS 32 Ca -0.21 -1.75 0.00 0.00 -0.51 0.00 0.00 58.31 55.85 1rlw n LYS 32 Cb 0.57 -1.40 0.00 0.00 -0.51 0.00 0.00 35.03 33.69 1rlw n LYS 32 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1rlw n GLY 33 N 1.19 2.10 0.08 0.72 0.00 -1.26 -4.37 105.19 103.64 1rlw n GLY 33 Ca 0.12 -2.03 -0.12 0.00 0.00 0.00 0.00 46.02 43.99 1rlw n GLY 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rlw h ALA 34 N 0.00 -0.06 -0.18 4.61 0.00 -1.98 -0.09 119.26 121.56 1rlw h ALA 34 Ca 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1rlw h ALA 34 Cb 0.00 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.84 1rlw h ALA 34 CO 0.00 -0.54 0.06 0.35 0.00 0.00 0.00 179.25 179.12 1rlw h PHE 35 N -0.08 0.28 -0.64 0.00 3.57 -2.00 -1.16 116.94 116.91 1rlw h PHE 35 Ca 0.01 -0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.46 1rlw h PHE 35 Cb 0.08 -0.08 -0.03 0.00 2.79 0.00 0.00 35.95 38.71 1rlw h PHE 35 CO -0.10 0.37 0.33 0.78 -2.23 0.00 0.00 178.31 177.47 1rlw h GLY 36 N 0.12 0.97 1.82 2.40 0.00 -1.75 -1.54 103.07 105.09 1rlw h GLY 36 Ca 0.06 -0.46 -0.04 0.00 0.00 0.00 0.00 47.33 46.89 1rlw h GLY 36 CO -0.00 0.44 -0.11 -0.55 0.00 0.00 0.00 176.54 176.31 1rlw h ASP 37 N 0.88 0.21 0.08 0.19 3.32 -0.87 0.22 116.42 120.45 1rlw h ASP 37 Ca 0.22 -0.04 -0.19 0.00 0.02 0.00 0.00 57.03 57.05 1rlw h ASP 37 Cb 0.07 -0.05 -0.00 0.00 0.22 0.00 0.00 39.33 39.57 1rlw h ASP 37 CO -0.03 0.35 -0.69 0.00 -1.72 0.00 0.00 179.24 177.14 1rlw h MET 38 N 0.21 0.55 -0.04 3.56 -0.00 -0.53 -3.17 114.93 115.52 1rlw h MET 38 Ca 0.04 -0.42 -0.00 0.00 -0.00 0.00 0.00 59.70 59.32 1rlw h MET 38 Cb 0.33 0.08 -0.00 0.00 -0.00 0.00 0.00 31.60 32.01 1rlw h MET 38 CO 0.02 1.05 0.01 -0.07 -0.00 0.00 0.00 176.91 177.91 1rlw h LEU 39 N 0.39 0.07 -6.97 -0.10 3.38 -0.48 -3.44 115.31 108.16 1rlw h LEU 39 Ca -0.03 -0.26 -0.18 0.00 0.09 0.00 0.00 57.88 57.50 1rlw h LEU 39 Cb 1.28 -0.02 -0.31 0.00 0.09 0.00 0.00 40.66 41.70 1rlw h LEU 39 CO 0.13 0.31 -0.49 -0.62 0.09 0.00 0.00 178.44 177.86 1rlw s ASP 40 N -5.52 0.29 0.20 -0.43 2.15 0.69 -5.11 116.67 108.93 1rlw s ASP 40 Ca -0.14 0.52 -0.31 0.00 0.43 0.00 0.00 52.55 53.04 1rlw s ASP 40 Cb 0.04 0.93 -0.10 0.00 -0.30 0.00 0.00 42.92 43.48 1rlw s ASP 40 CO 0.68 -0.26 1.56 -0.89 -0.17 0.00 0.00 175.17 176.09 1rlw s THR 41 N 2.49 2.52 0.23 1.71 2.01 -1.21 -4.20 115.64 119.19 1rlw s THR 41 Ca 0.04 0.39 -0.30 0.00 0.31 0.00 0.00 61.69 62.12 1rlw s THR 41 Cb -0.13 -3.25 -0.15 0.00 0.01 0.00 0.00 72.50 68.98 1rlw s THR 41 CO -0.12 0.04 1.02 -2.65 -0.69 0.00 0.00 174.62 172.22 1rlw n PRO 42 N 3.52 1.12 -3.84 4.92 -0.02 -1.26 -4.28 135.00 135.17 1rlw n PRO 42 Ca 0.12 0.40 -0.29 0.00 -2.02 0.00 0.00 63.50 61.71 1rlw n PRO 42 Cb 0.38 -1.78 -0.11 0.00 -0.02 0.00 0.00 33.50 31.98 1rlw n PRO 42 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1rlw n ASP 43 N 1.62 3.28 -4.88 2.55 8.00 -1.26 -0.93 116.55 124.93 1rlw n ASP 43 Ca 0.13 -3.21 -0.30 0.00 0.71 0.00 0.00 54.79 52.12 1rlw n ASP 43 Cb 0.28 -0.81 -0.03 0.00 -0.02 0.00 0.00 41.12 40.54 1rlw n ASP 43 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 1rlw s PRO 44 N -1.51 3.74 0.16 -0.24 0.04 -1.13 0.13 135.00 136.20 1rlw s PRO 44 Ca 0.26 0.40 -0.19 0.00 0.04 0.00 0.00 61.00 61.51 1rlw s PRO 44 Cb -0.04 -2.42 0.04 0.00 0.04 0.00 0.00 34.50 32.13 1rlw s PRO 44 CO -0.16 -0.03 0.51 1.52 0.04 0.00 0.00 177.00 178.89 1rlw s TYR 45 N -2.37 -0.29 0.02 0.56 1.13 -0.13 -1.83 117.35 114.44 1rlw s TYR 45 Ca 0.50 -0.01 0.05 0.00 -1.41 0.00 0.00 57.07 56.20 1rlw s TYR 45 Cb -0.10 0.41 -0.03 0.00 -1.10 0.00 0.00 41.96 41.14 1rlw s TYR 45 CO 0.32 -0.83 -0.13 0.08 -2.51 0.00 0.00 175.55 172.48 1rlw s VAL 46 N -3.81 3.16 -0.06 -3.49 1.01 -1.26 0.43 120.40 116.38 1rlw s VAL 46 Ca 0.04 -0.97 0.04 0.00 0.00 0.00 0.00 61.98 61.09 1rlw s VAL 46 Cb -0.00 -2.34 -0.00 0.00 0.00 0.00 0.00 36.38 34.03 1rlw s VAL 46 CO -0.09 0.39 -0.18 -0.70 0.00 0.00 0.00 175.10 174.51 1rlw s GLU 47 N -1.36 2.03 0.03 2.72 2.12 0.04 -1.15 118.70 123.14 1rlw s GLU 47 Ca 0.15 -0.65 0.06 0.00 0.36 0.00 0.00 54.97 54.89 1rlw s GLU 47 Cb -0.11 -1.70 -0.03 0.00 0.26 0.00 0.00 34.13 32.55 1rlw s GLU 47 CO 0.06 0.22 -0.14 -0.51 -0.54 0.00 0.00 175.26 174.35 1rlw s LEU 48 N 0.15 2.82 -0.25 2.70 1.43 0.16 -0.77 118.68 124.91 1rlw s LEU 48 Ca -0.07 -0.32 -0.15 0.00 -1.03 0.00 0.00 54.13 52.55 1rlw s LEU 48 Cb -0.13 -1.64 0.07 0.00 0.03 0.00 0.00 46.19 44.52 1rlw s LEU 48 CO 0.03 0.26 0.62 0.12 0.23 0.00 0.00 176.35 177.62 1rlw s PHE 49 N -0.96 -0.94 -0.31 0.29 5.36 -0.31 -0.49 117.98 120.62 1rlw s PHE 49 Ca 0.16 1.92 0.00 0.00 -0.96 0.00 0.00 56.93 58.05 1rlw s PHE 49 Cb -0.11 0.53 0.10 0.00 -0.34 0.00 0.00 43.02 43.20 1rlw s PHE 49 CO 0.06 -0.48 0.07 0.42 -1.46 0.00 0.00 175.22 173.84 1rlw s ILE 50 N 1.51 1.24 0.55 3.12 1.01 -1.26 -0.16 121.20 127.20 1rlw s ILE 50 Ca -0.09 -1.57 0.25 0.00 0.00 0.00 0.00 60.65 59.23 1rlw s ILE 50 Cb -0.06 -1.89 0.32 0.00 0.01 0.00 0.00 42.46 40.84 1rlw s ILE 50 CO -0.17 -0.60 2.20 0.77 0.00 0.00 0.00 174.94 177.14 1rlw h SER 51 N 7.97 0.00 -0.18 3.58 4.64 -1.96 -2.92 113.55 124.68 1rlw h SER 51 Ca -0.12 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.20 1rlw h SER 51 Cb 1.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.11 1rlw h SER 51 CO 0.47 0.02 0.00 0.35 -0.87 0.00 0.00 176.83 176.80 1rlw n THR 52 N -4.05 0.58 -3.84 2.95 -2.24 -1.26 -4.79 114.28 101.63 1rlw n THR 52 Ca -0.03 -0.35 -0.12 0.00 -2.27 0.00 0.00 64.05 61.28 1rlw n THR 52 Cb 0.10 -0.20 -0.14 0.00 -2.10 0.00 0.00 70.33 68.00 1rlw n THR 52 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 1rlw s THR 53 N -1.59 -0.01 0.00 4.28 -1.32 -1.10 -4.80 115.64 111.10 1rlw s THR 53 Ca 0.15 0.03 0.00 0.00 -1.21 0.00 0.00 61.69 60.66 1rlw s THR 53 Cb 0.10 -0.07 0.00 0.00 -1.51 0.00 0.00 72.50 71.02 1rlw s THR 53 CO 0.07 0.01 0.00 -0.81 -2.21 0.00 0.00 174.62 171.68 1rlw n PRO 54 N 3.22 0.00 -2.60 7.08 -0.04 -1.26 -3.88 135.00 137.51 1rlw n PRO 54 Ca -0.14 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 62.89 1rlw n PRO 54 Cb 0.58 0.00 0.01 0.00 -0.04 0.00 0.00 33.50 34.05 1rlw n PRO 54 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1rlw n ASP 55 N 0.00 6.16 0.17 3.54 8.00 -1.26 -4.79 116.55 128.37 1rlw n ASP 55 Ca 0.00 -3.30 0.09 0.00 0.71 0.00 0.00 54.79 52.30 1rlw n ASP 55 Cb 0.00 -1.35 0.09 0.00 -0.02 0.00 0.00 41.12 39.84 1rlw n ASP 55 CO 0.00 0.00 0.00 0.77 -0.39 0.00 0.00 177.20 177.58 1rlw h SER 56 N 5.35 0.00 -1.66 -2.24 4.64 -1.84 -3.46 113.55 114.34 1rlw h SER 56 Ca 0.36 0.00 -0.64 0.00 -0.47 0.00 0.00 61.79 61.04 1rlw h SER 56 Cb 0.56 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.65 1rlw h SER 56 CO 1.45 0.13 1.27 -1.14 -0.87 0.00 0.00 176.83 177.68 1rlw n ARG 57 N -3.03 1.69 -4.29 4.77 0.63 -1.26 -4.56 116.66 110.62 1rlw n ARG 57 Ca 0.02 0.55 -0.16 0.00 -0.92 0.00 0.00 57.85 57.34 1rlw n ARG 57 Cb 0.59 -2.66 -0.10 0.00 0.45 0.00 0.00 32.46 30.74 1rlw n ARG 57 CO 0.00 0.00 0.00 0.15 -2.51 0.00 0.00 177.63 175.27 1rlw s LYS 58 N 5.23 1.17 0.07 -0.14 1.02 0.36 -4.98 119.74 122.47 1rlw s LYS 58 Ca 1.01 -1.53 -0.26 0.00 0.02 0.00 0.00 55.97 55.20 1rlw s LYS 58 Cb -0.71 -0.69 0.07 0.00 -0.52 0.00 0.00 37.83 35.99 1rlw s LYS 58 CO 0.49 0.04 0.66 -0.98 -0.92 0.00 0.00 175.35 174.64 1rlw s ARG 59 N -3.77 1.15 0.86 1.68 1.04 -1.26 0.35 118.95 119.01 1rlw s ARG 59 Ca 0.21 -0.20 -0.11 0.00 -1.04 0.00 0.00 55.73 54.59 1rlw s ARG 59 Cb 0.03 0.53 0.16 0.00 -2.04 0.00 0.00 34.95 33.64 1rlw s ARG 59 CO 0.04 -0.46 1.20 0.95 -0.04 0.00 0.00 175.30 176.98 1rlw s THR 60 N -2.79 2.06 0.63 4.99 -4.23 -0.30 -5.01 115.64 110.99 1rlw s THR 60 Ca -0.03 -0.20 -0.11 0.00 -1.18 0.00 0.00 61.69 60.18 1rlw s THR 60 Cb -0.01 -2.86 -0.03 0.00 1.34 0.00 0.00 72.50 70.94 1rlw s THR 60 CO -0.05 0.00 1.04 0.00 -0.54 0.00 0.00 174.62 175.07 1rlw s ARG 61 N -5.61 3.53 0.28 3.99 1.70 -1.26 -4.66 118.95 116.92 1rlw s ARG 61 Ca 0.70 0.72 0.02 0.00 -0.47 0.00 0.00 55.73 56.70 1rlw s ARG 61 Cb -0.05 -2.07 -0.03 0.00 -0.57 0.00 0.00 34.95 32.22 1rlw s ARG 61 CO 0.50 -0.62 0.45 -3.38 -1.08 0.00 0.00 175.30 171.17 1rlw s HIS 62 N -3.20 3.48 -0.03 5.89 -3.43 -1.26 -4.52 115.29 112.23 1rlw s HIS 62 Ca 0.55 0.22 0.07 0.00 -0.80 0.00 0.00 55.06 55.11 1rlw s HIS 62 Cb -0.11 -1.78 -0.02 0.00 -1.43 0.00 0.00 32.58 29.24 1rlw s HIS 62 CO 0.54 0.28 -0.24 -0.06 -2.00 0.00 0.00 174.74 173.26 1rlw s PHE 63 N -2.11 2.40 0.17 0.38 0.08 -0.76 -4.96 117.98 113.18 1rlw s PHE 63 Ca 0.38 -0.39 -0.30 0.00 0.12 0.00 0.00 56.93 56.73 1rlw s PHE 63 Cb -0.10 -1.53 -0.07 0.00 -0.57 0.00 0.00 43.02 40.75 1rlw s PHE 63 CO 0.32 -0.00 1.01 -0.80 -0.10 0.00 0.00 175.22 175.65 1rlw s ASN 64 N -0.62 7.44 -1.18 1.36 -0.87 -1.26 -2.84 114.94 116.96 1rlw s ASN 64 Ca 0.10 1.96 -0.34 0.00 -1.57 0.00 0.00 52.86 53.01 1rlw s ASN 64 Cb -0.10 -2.60 0.05 0.00 -0.02 0.00 0.00 41.25 38.57 1rlw s ASN 64 CO -0.01 -0.07 0.66 0.59 -2.57 0.00 0.00 177.10 175.71 1rlw n ASN 65 N 2.25 -4.04 -3.71 -1.22 3.02 -1.13 -4.92 115.26 105.51 1rlw n ASN 65 Ca 0.01 -1.28 -0.27 0.00 -0.03 0.00 0.00 54.58 53.01 1rlw n ASN 65 Cb 0.47 -1.55 -0.17 0.00 -0.61 0.00 0.00 39.78 37.93 1rlw n ASN 65 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1rlw s ASP 66 N -3.54 2.72 0.00 6.41 -1.08 -0.11 -4.96 116.67 116.11 1rlw s ASP 66 Ca 0.47 -0.74 0.27 0.00 -0.52 0.00 0.00 52.55 52.03 1rlw s ASP 66 Cb -0.27 -0.51 0.81 0.00 -1.46 0.00 0.00 42.92 41.49 1rlw s ASP 66 CO 0.96 -0.31 1.60 2.30 0.52 0.00 0.00 175.17 180.24 1rlw n ILE 67 N 5.10 0.00 -3.13 4.11 -5.35 -1.26 -4.10 119.36 114.73 1rlw n ILE 67 Ca -0.08 -0.13 -0.22 0.00 -0.27 0.00 0.00 62.75 62.04 1rlw n ILE 67 Cb 0.48 0.37 -0.04 0.00 -1.74 0.00 0.00 39.64 38.70 1rlw n ILE 67 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1rlw n ASN 68 N -0.62 2.08 -4.75 7.28 3.02 -1.26 -0.62 115.26 120.39 1rlw n ASN 68 Ca 0.13 -3.21 -0.41 0.00 -0.03 0.00 0.00 54.58 51.06 1rlw n ASN 68 Cb 0.34 -0.61 -0.03 0.00 -0.61 0.00 0.00 39.78 38.88 1rlw n ASN 68 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1rlw s PRO 69 N -2.61 4.44 -0.29 3.52 0.04 -1.15 -4.80 135.00 134.14 1rlw s PRO 69 Ca 0.42 2.05 -0.03 0.00 0.04 0.00 0.00 61.00 63.48 1rlw s PRO 69 Cb 0.29 -3.15 0.04 0.00 0.04 0.00 0.00 34.50 31.72 1rlw s PRO 69 CO -0.10 -0.11 0.01 0.08 0.04 0.00 0.00 177.00 176.92 1rlw s VAL 70 N -0.67 3.22 -0.22 -0.36 1.01 -1.26 -0.58 120.40 121.53 1rlw s VAL 70 Ca 0.51 -1.14 -0.16 0.00 0.00 0.00 0.00 61.98 61.18 1rlw s VAL 70 Cb -0.36 -2.76 -0.12 0.00 0.00 0.00 0.00 36.38 33.14 1rlw s VAL 70 CO 0.44 -0.00 -0.17 0.79 0.00 0.00 0.00 175.10 176.16 1rlw n TRP 71 N 4.70 0.41 -3.69 5.22 8.01 0.20 -4.97 117.44 127.33 1rlw n TRP 71 Ca -0.14 0.18 -0.23 0.00 -1.31 0.00 0.00 57.50 56.00 1rlw n TRP 71 Cb 0.45 -0.91 0.03 0.00 -2.01 0.00 0.00 31.31 28.88 1rlw n TRP 71 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.69 176.77 1rlw n ASN 72 N -4.39 -2.17 -4.54 -0.99 5.03 -0.02 -4.98 115.26 103.21 1rlw n ASN 72 Ca -0.35 -0.86 -0.34 0.00 0.87 0.00 0.00 54.58 53.90 1rlw n ASN 72 Cb 0.68 -3.93 -0.12 0.00 -1.02 0.00 0.00 39.78 35.39 1rlw n ASN 72 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 1rlw s GLU 73 N -5.91 3.31 -0.18 3.52 2.02 -0.23 -4.94 118.70 116.28 1rlw s GLU 73 Ca 0.11 -0.52 -0.08 0.00 0.02 0.00 0.00 54.97 54.50 1rlw s GLU 73 Cb -0.03 -2.79 -0.04 0.00 0.10 0.00 0.00 34.13 31.37 1rlw s GLU 73 CO 0.82 0.42 0.08 0.99 0.02 0.00 0.00 175.26 177.59 1rlw s THR 74 N -0.13 4.94 -0.01 3.63 2.01 -1.26 -0.07 115.64 124.75 1rlw s THR 74 Ca 0.02 0.02 0.06 0.00 0.31 0.00 0.00 61.69 62.10 1rlw s THR 74 Cb -0.13 -3.22 -0.02 0.00 0.01 0.00 0.00 72.50 69.14 1rlw s THR 74 CO 0.03 0.47 -0.20 -0.36 -0.69 0.00 0.00 174.62 173.87 1rlw s PHE 75 N 0.21 1.78 -0.07 4.92 0.08 0.92 -4.99 117.98 120.83 1rlw s PHE 75 Ca 0.05 -0.34 0.05 0.00 0.12 0.00 0.00 56.93 56.81 1rlw s PHE 75 Cb -0.12 -1.14 -0.00 0.00 -0.57 0.00 0.00 43.02 41.18 1rlw s PHE 75 CO -0.00 -0.03 -0.23 -1.21 -0.10 0.00 0.00 175.22 173.65 1rlw s GLU 76 N -0.49 2.63 -0.08 0.44 2.02 -1.26 -0.09 118.70 121.88 1rlw s GLU 76 Ca 0.08 -0.84 0.03 0.00 0.02 0.00 0.00 54.97 54.26 1rlw s GLU 76 Cb -0.08 -2.12 0.01 0.00 0.10 0.00 0.00 34.13 32.04 1rlw s GLU 76 CO -0.01 0.27 -0.17 -0.06 0.02 0.00 0.00 175.26 175.31 1rlw s PHE 77 N 0.10 1.88 -0.40 1.61 0.08 -0.09 -4.99 117.98 116.18 1rlw s PHE 77 Ca -0.10 -0.72 -0.15 0.00 0.12 0.00 0.00 56.93 56.07 1rlw s PHE 77 Cb -0.15 -1.31 0.01 0.00 -0.57 0.00 0.00 43.02 41.00 1rlw s PHE 77 CO 0.06 -0.32 0.33 0.42 -0.10 0.00 0.00 175.22 175.61 1rlw s ILE 78 N 0.50 5.21 0.18 0.64 1.01 -1.26 -0.24 121.20 127.24 1rlw s ILE 78 Ca -0.15 -0.45 0.07 0.00 0.00 0.00 0.00 60.65 60.12 1rlw s ILE 78 Cb -0.16 -3.92 -0.04 0.00 0.01 0.00 0.00 42.46 38.35 1rlw s ILE 78 CO 0.06 -0.28 0.01 -0.76 0.00 0.00 0.00 174.94 173.97 1rlw s LEU 79 N 1.84 3.33 -0.30 2.97 1.43 0.52 -4.90 118.68 123.56 1rlw s LEU 79 Ca 0.08 -0.41 -0.12 0.00 -1.03 0.00 0.00 54.13 52.65 1rlw s LEU 79 Cb -0.18 -1.96 -0.04 0.00 0.03 0.00 0.00 46.19 44.04 1rlw s LEU 79 CO 0.11 0.08 0.21 -0.62 0.23 0.00 0.00 176.35 176.36 1rlw s ASP 80 N -3.04 6.04 0.00 2.29 -1.08 -1.26 -0.35 116.67 119.27 1rlw s ASP 80 Ca 0.28 -0.17 0.14 0.00 -0.52 0.00 0.00 52.55 52.28 1rlw s ASP 80 Cb -0.09 -2.13 0.71 0.00 -1.46 0.00 0.00 42.92 39.95 1rlw s ASP 80 CO 0.19 -0.12 1.35 -0.81 0.52 0.00 0.00 175.17 176.29 1rlw n PRO 81 N 5.08 0.23 0.15 4.34 -0.04 -1.26 -1.12 135.00 142.38 1rlw n PRO 81 Ca -0.13 0.14 0.09 0.00 -0.04 0.00 0.00 63.50 63.56 1rlw n PRO 81 Cb 0.51 -1.50 0.07 0.00 -0.04 0.00 0.00 33.50 32.54 1rlw n PRO 81 CO 0.00 0.00 0.00 -0.91 -0.04 0.00 0.00 175.50 174.55 1rlw h ASN 82 N 0.00 0.00 -4.13 3.54 2.35 -1.93 -3.47 115.58 111.94 1rlw h ASN 82 Ca 0.00 0.00 -0.48 0.00 -0.55 0.00 0.00 56.30 55.27 1rlw h ASN 82 Cb 0.11 0.00 0.02 0.00 0.05 0.00 0.00 38.32 38.50 1rlw h ASN 82 CO 0.00 0.12 0.34 -1.10 -1.65 0.00 0.00 177.43 175.14 1rlw s GLN 83 N -3.20 3.88 -1.27 0.81 -1.52 -0.28 -4.98 119.66 113.10 1rlw s GLN 83 Ca 0.03 0.85 -0.15 0.00 -1.95 0.00 0.00 55.36 54.14 1rlw s GLN 83 Cb 0.07 -2.17 0.13 0.00 -0.22 0.00 0.00 33.01 30.82 1rlw s GLN 83 CO 0.73 -0.27 1.64 0.39 -0.25 0.00 0.00 175.29 177.54 1rlw n GLU 84 N -1.69 3.30 -2.52 2.91 -0.58 -1.26 -4.96 120.64 115.83 1rlw n GLU 84 Ca 0.06 -3.53 -0.43 0.00 -0.42 0.00 0.00 57.16 52.84 1rlw n GLU 84 Cb 0.54 -3.21 -0.02 0.00 -0.57 0.00 0.00 31.44 28.18 1rlw n GLU 84 CO 0.00 0.00 0.00 -0.80 -0.48 0.00 0.00 177.13 175.85 1rlw s ASN 85 N 3.17 6.78 -0.17 1.62 -0.87 -1.26 -4.89 114.94 119.31 1rlw s ASN 85 Ca 0.47 1.10 0.01 0.00 -1.57 0.00 0.00 52.86 52.87 1rlw s ASN 85 Cb 0.02 -2.54 0.03 0.00 -0.02 0.00 0.00 41.25 38.73 1rlw s ASN 85 CO 0.02 -1.01 -0.15 0.54 -2.57 0.00 0.00 177.10 173.94 1rlw s VAL 86 N 4.07 1.76 -0.15 1.60 0.11 -1.26 -1.16 120.40 125.37 1rlw s VAL 86 Ca 0.51 -0.83 -0.29 0.00 -2.93 0.00 0.00 61.98 58.44 1rlw s VAL 86 Cb -0.14 -1.67 -0.01 0.00 -1.53 0.00 0.00 36.38 33.03 1rlw s VAL 86 CO 0.20 0.42 1.21 -0.22 -3.33 0.00 0.00 175.10 173.39 1rlw s LEU 87 N 1.40 4.19 -0.27 2.54 2.96 0.16 -4.47 118.68 125.18 1rlw s LEU 87 Ca 0.04 1.67 -0.10 0.00 -0.22 0.00 0.00 54.13 55.51 1rlw s LEU 87 Cb -0.14 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 42.97 1rlw s LEU 87 CO -0.11 -0.71 0.15 -1.61 -1.32 0.00 0.00 176.35 172.75 1rlw s GLU 88 N 3.19 3.83 -0.19 1.98 2.02 0.77 0.08 118.70 130.39 1rlw s GLU 88 Ca 0.53 -0.38 -0.03 0.00 0.02 0.00 0.00 54.97 55.10 1rlw s GLU 88 Cb -0.21 -3.55 -0.02 0.00 0.10 0.00 0.00 34.13 30.45 1rlw s GLU 88 CO 0.15 -0.19 -0.05 0.42 0.02 0.00 0.00 175.26 175.60 1rlw s ILE 89 N 1.71 3.49 -0.12 -1.63 1.01 0.91 -1.16 121.20 125.41 1rlw s ILE 89 Ca 0.07 -0.47 0.02 0.00 0.00 0.00 0.00 60.65 60.26 1rlw s ILE 89 Cb -0.16 -2.56 0.01 0.00 0.01 0.00 0.00 42.46 39.77 1rlw s ILE 89 CO 0.09 0.45 -0.17 -0.89 0.00 0.00 0.00 174.94 174.42 1rlw s THR 90 N 1.01 1.65 -0.31 2.92 2.01 0.05 0.32 115.64 123.29 1rlw s THR 90 Ca 0.00 -0.73 -0.23 0.00 0.31 0.00 0.00 61.69 61.04 1rlw s THR 90 Cb -0.15 -1.50 -0.00 0.00 0.01 0.00 0.00 72.50 70.87 1rlw s THR 90 CO 0.00 0.47 0.77 -0.22 -0.69 0.00 0.00 174.62 174.96 1rlw s LEU 91 N 0.97 4.09 0.20 4.42 2.96 -0.28 -0.78 118.68 130.26 1rlw s LEU 91 Ca -0.06 0.64 0.10 0.00 -0.22 0.00 0.00 54.13 54.59 1rlw s LEU 91 Cb -0.15 -3.05 -0.04 0.00 0.50 0.00 0.00 46.19 43.44 1rlw s LEU 91 CO -0.02 -0.60 -0.16 -0.04 -1.32 0.00 0.00 176.35 174.21 1rlw s MET 92 N 2.93 1.83 -0.21 1.98 -1.94 0.17 -1.02 119.30 123.04 1rlw s MET 92 Ca 0.32 -1.42 -0.02 0.00 -1.71 0.00 0.00 55.69 52.86 1rlw s MET 92 Cb -0.14 -2.01 0.00 0.00 2.01 0.00 0.00 34.83 34.69 1rlw s MET 92 CO 0.12 0.41 -0.09 0.34 -0.01 0.00 0.00 175.02 175.79 1rlw s ASP 93 N -2.87 3.93 -0.14 3.03 2.15 -0.00 -0.95 116.67 121.83 1rlw s ASP 93 Ca 0.24 -0.48 -0.29 0.00 0.43 0.00 0.00 52.55 52.44 1rlw s ASP 93 Cb -0.08 -1.66 -0.03 0.00 -0.30 0.00 0.00 42.92 40.86 1rlw s ASP 93 CO 0.13 -0.02 1.42 0.00 -0.17 0.00 0.00 175.17 176.53 1rlw s ALA 94 N 1.42 3.61 0.31 3.66 0.00 0.35 -1.18 121.76 129.92 1rlw s ALA 94 Ca 0.05 0.60 0.08 0.00 0.00 0.00 0.00 51.96 52.70 1rlw s ALA 94 Cb -0.14 -3.68 -0.06 0.00 0.00 0.00 0.00 23.12 19.24 1rlw s ALA 94 CO -0.06 -1.33 -0.08 -0.80 0.00 0.00 0.00 175.76 173.49 1rlw s ASN 95 N 2.62 3.21 0.22 0.00 0.01 -1.26 -4.59 114.94 115.15 1rlw s ASN 95 Ca 0.62 -1.19 0.00 0.00 -0.71 0.00 0.00 52.86 51.59 1rlw s ASN 95 Cb -0.26 -0.25 0.21 0.00 0.41 0.00 0.00 41.25 41.37 1rlw s ASN 95 CO 0.21 -0.27 1.56 1.88 -1.51 0.00 0.00 177.10 178.97 1rlw h TYR 96 N 2.17 0.54 0.00 2.20 0.05 -2.01 -3.39 116.97 116.53 1rlw h TYR 96 Ca -0.41 -0.18 -0.32 0.00 0.05 0.00 0.00 58.73 57.87 1rlw h TYR 96 Cb 1.24 -0.11 -0.05 0.00 1.01 0.00 0.00 36.73 38.83 1rlw h TYR 96 CO 0.72 0.86 -2.09 0.28 -1.05 0.00 0.00 178.16 176.88 1rlw n VAL 97 N -3.96 1.07 -3.57 -2.88 0.31 -1.26 -4.99 118.33 103.05 1rlw n VAL 97 Ca -0.02 -0.29 -0.12 0.00 -0.01 0.00 0.00 64.34 63.89 1rlw n VAL 97 Cb 0.57 -1.70 -0.11 0.00 -0.91 0.00 0.00 33.84 31.69 1rlw n VAL 97 CO 0.00 0.00 0.00 -0.32 -1.32 0.00 0.00 176.83 175.19 1rlw s MET 98 N -2.36 0.23 0.27 5.55 1.75 -1.26 -5.13 119.30 118.35 1rlw s MET 98 Ca -0.27 0.67 -0.30 0.00 -1.25 0.00 0.00 55.69 54.54 1rlw s MET 98 Cb 0.10 -0.26 -0.13 0.00 2.84 0.00 0.00 34.83 37.38 1rlw s MET 98 CO 0.35 -0.42 1.31 -0.25 -0.65 0.00 0.00 175.02 175.37 1rlw n ASP 99 N 5.36 2.49 -4.79 1.11 9.92 -1.26 -4.51 116.55 124.86 1rlw n ASP 99 Ca -0.06 1.16 -0.36 0.00 -0.53 0.00 0.00 54.79 55.00 1rlw n ASP 99 Cb 0.50 -1.41 -0.07 0.00 -0.64 0.00 0.00 41.12 39.49 1rlw n ASP 99 CO 0.00 0.00 0.00 -0.70 0.13 0.00 0.00 177.20 176.63 1rlw s GLU 100 N -0.93 3.61 -0.40 -1.24 2.12 -0.33 -4.91 118.70 116.62 1rlw s GLU 100 Ca 0.64 -0.21 -0.22 0.00 0.36 0.00 0.00 54.97 55.54 1rlw s GLU 100 Cb -0.65 -3.19 0.01 0.00 0.26 0.00 0.00 34.13 30.56 1rlw s GLU 100 CO 0.54 0.61 0.75 -0.08 -0.54 0.00 0.00 175.26 176.54 1rlw s THR 101 N -0.55 4.74 -0.53 -1.70 -1.32 -1.26 -0.82 115.64 114.20 1rlw s THR 101 Ca 0.12 0.61 0.24 0.00 -1.21 0.00 0.00 61.69 61.45 1rlw s THR 101 Cb -0.12 -4.22 0.20 0.00 -1.51 0.00 0.00 72.50 66.85 1rlw s THR 101 CO 0.02 -0.52 1.50 -0.07 -2.21 0.00 0.00 174.62 173.33 1rlw h LEU 102 N 9.81 0.00 0.00 9.08 3.38 -1.43 -3.48 115.31 132.67 1rlw h LEU 102 Ca -0.25 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.68 1rlw h LEU 102 Cb 1.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.84 1rlw h LEU 102 CO 0.91 0.02 0.00 0.61 0.09 0.00 0.00 178.44 180.08 1rlw n GLY 103 N 1.22 1.06 2.94 0.83 0.00 -1.18 -4.86 105.19 105.20 1rlw n GLY 103 Ca 0.04 -0.60 -0.20 0.00 0.00 0.00 0.00 46.02 45.25 1rlw n GLY 103 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rlw s THR 104 N -2.00 0.65 0.11 2.61 2.01 -1.26 -1.13 115.64 116.64 1rlw s THR 104 Ca 0.00 -0.23 0.04 0.00 0.31 0.00 0.00 61.69 61.81 1rlw s THR 104 Cb 0.00 -0.63 -0.04 0.00 0.01 0.00 0.00 72.50 71.84 1rlw s THR 104 CO 0.00 0.23 -0.11 0.00 -0.69 0.00 0.00 174.62 174.05 1rlw s ALA 105 N 0.60 1.26 0.01 7.40 0.00 0.15 -4.99 121.76 126.19 1rlw s ALA 105 Ca -0.09 -1.26 0.07 0.00 0.00 0.00 0.00 51.96 50.69 1rlw s ALA 105 Cb -0.12 0.00 -0.02 0.00 0.00 0.00 0.00 23.12 22.98 1rlw s ALA 105 CO 0.01 -0.01 -0.22 0.95 0.00 0.00 0.00 175.76 176.49 1rlw s THR 106 N -2.49 1.73 -0.21 0.00 -4.23 -1.26 -0.07 115.64 109.12 1rlw s THR 106 Ca 0.08 -1.05 -0.00 0.00 -1.18 0.00 0.00 61.69 59.54 1rlw s THR 106 Cb -0.03 -1.46 0.06 0.00 1.34 0.00 0.00 72.50 72.41 1rlw s THR 106 CO 0.01 0.39 -0.03 0.12 -0.54 0.00 0.00 174.62 174.57 1rlw s PHE 107 N -0.62 1.89 -0.43 3.99 5.36 0.11 -4.95 117.98 123.33 1rlw s PHE 107 Ca 0.08 -1.37 -0.28 0.00 -0.96 0.00 0.00 56.93 54.40 1rlw s PHE 107 Cb -0.09 -1.38 0.02 0.00 -0.34 0.00 0.00 43.02 41.24 1rlw s PHE 107 CO 0.00 -0.70 1.06 0.99 -1.46 0.00 0.00 175.22 175.12 1rlw s THR 108 N 1.57 4.36 0.61 0.12 2.01 -1.26 0.35 115.64 123.40 1rlw s THR 108 Ca -0.03 1.26 0.33 0.00 0.31 0.00 0.00 61.69 63.56 1rlw s THR 108 Cb -0.18 -4.50 0.38 0.00 0.01 0.00 0.00 72.50 68.21 1rlw s THR 108 CO -0.07 -0.80 2.26 0.58 -0.69 0.00 0.00 174.62 175.89 1rlw h VAL 109 N 6.05 0.39 -0.98 3.82 2.07 -1.53 -2.28 116.25 123.78 1rlw h VAL 109 Ca -0.23 0.00 0.26 0.00 0.82 0.00 0.00 66.70 67.56 1rlw h VAL 109 Cb 1.07 0.97 -0.13 0.00 -1.52 0.00 0.00 31.29 31.67 1rlw h VAL 109 CO 1.07 0.00 0.54 0.28 0.02 0.00 0.00 177.57 179.48 1rlw h SER 110 N 0.00 0.54 -0.10 0.57 0.02 -1.91 0.17 113.55 112.84 1rlw h SER 110 Ca 0.01 0.16 0.03 0.00 -0.84 0.00 0.00 61.79 61.15 1rlw h SER 110 Cb 0.08 0.09 -0.00 0.00 0.14 0.00 0.00 62.40 62.70 1rlw h SER 110 CO -0.00 0.00 0.19 0.77 -1.14 0.00 0.00 176.83 176.65 1rlw h SER 111 N 0.46 0.00 -2.80 3.07 4.64 -1.81 -3.41 113.55 113.69 1rlw h SER 111 Ca 0.65 0.00 -0.54 0.00 -0.47 0.00 0.00 61.79 61.43 1rlw h SER 111 Cb 1.33 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.40 1rlw h SER 111 CO -0.53 0.00 -0.37 -0.04 -0.87 0.00 0.00 176.83 175.02 1rlw s MET 112 N -4.39 3.50 0.14 4.77 -1.94 0.58 -5.13 119.30 116.84 1rlw s MET 112 Ca -0.04 -0.39 0.10 0.00 -1.71 0.00 0.00 55.69 53.65 1rlw s MET 112 Cb 0.13 -2.87 -0.04 0.00 2.01 0.00 0.00 34.83 34.06 1rlw s MET 112 CO 0.45 0.44 -0.24 0.15 -0.01 0.00 0.00 175.02 175.81 1rlw s LYS 113 N -3.24 1.33 0.26 2.03 1.02 -1.26 -5.02 119.74 114.85 1rlw s LYS 113 Ca 0.38 -1.33 -0.29 0.00 0.02 0.00 0.00 55.97 54.74 1rlw s LYS 113 Cb -0.11 -1.68 -0.14 0.00 -0.52 0.00 0.00 37.83 35.37 1rlw s LYS 113 CO 0.29 0.39 1.13 0.28 -0.92 0.00 0.00 175.35 176.52 1rlw n VAL 114 N 0.79 1.62 0.00 3.17 0.31 -1.26 -0.93 118.33 122.03 1rlw n VAL 114 Ca -0.17 -0.40 0.00 0.00 -0.01 0.00 0.00 64.34 63.76 1rlw n VAL 114 Cb 0.54 -1.11 0.00 0.00 -0.91 0.00 0.00 33.84 32.36 1rlw n VAL 114 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1rlw n GLY 115 N 1.47 3.01 3.79 2.92 0.00 0.10 -4.97 105.19 111.52 1rlw n GLY 115 Ca 0.10 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.78 1rlw n GLY 115 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1rlw s GLU 116 N -0.22 3.93 -0.16 1.61 2.02 -0.10 -4.88 118.70 120.91 1rlw s GLU 116 Ca 0.00 1.39 -0.04 0.00 0.02 0.00 0.00 54.97 56.34 1rlw s GLU 116 Cb 0.00 -2.23 0.08 0.00 0.10 0.00 0.00 34.13 32.07 1rlw s GLU 116 CO 0.00 -0.32 0.26 0.21 0.02 0.00 0.00 175.26 175.43 1rlw s LYS 117 N -3.01 0.17 0.08 1.61 2.20 -1.26 -1.72 119.74 117.81 1rlw s LYS 117 Ca 0.64 0.60 -0.07 0.00 -0.36 0.00 0.00 55.97 56.78 1rlw s LYS 117 Cb -0.18 -0.36 -0.01 0.00 -1.51 0.00 0.00 37.83 35.78 1rlw s LYS 117 CO 0.22 -0.40 0.13 -1.59 -0.36 0.00 0.00 175.35 173.35 1rlw s LYS 118 N 2.40 0.78 -0.25 4.03 -2.85 0.13 -4.99 119.74 118.99 1rlw s LYS 118 Ca 0.04 -1.01 -0.17 0.00 -1.00 0.00 0.00 55.97 53.83 1rlw s LYS 118 Cb -0.13 0.31 -0.03 0.00 -2.06 0.00 0.00 37.83 35.91 1rlw s LYS 118 CO -0.10 -0.22 0.49 -2.00 0.10 0.00 0.00 175.35 173.62 1rlw s GLU 119 N -3.80 4.09 -0.28 1.78 2.12 -1.26 -0.09 118.70 121.25 1rlw s GLU 119 Ca 0.05 0.29 0.01 0.00 0.36 0.00 0.00 54.97 55.68 1rlw s GLU 119 Cb 0.05 -3.63 0.06 0.00 0.26 0.00 0.00 34.13 30.87 1rlw s GLU 119 CO -0.10 -0.29 -0.05 0.08 -0.54 0.00 0.00 175.26 174.36 1rlw s VAL 120 N 2.11 2.60 0.12 3.70 1.01 0.33 -4.98 120.40 125.30 1rlw s VAL 120 Ca 0.21 -1.52 -0.24 0.00 0.00 0.00 0.00 61.98 60.43 1rlw s VAL 120 Cb -0.16 -2.52 -0.07 0.00 0.00 0.00 0.00 36.38 33.64 1rlw s VAL 120 CO 0.09 -0.08 0.73 -2.16 0.00 0.00 0.00 175.10 173.68 1rlw s PRO 121 N 1.18 4.47 -0.02 2.72 0.04 -1.26 -1.51 135.00 140.62 1rlw s PRO 121 Ca -0.07 1.04 0.07 0.00 0.04 0.00 0.00 61.00 62.08 1rlw s PRO 121 Cb -0.20 -3.28 -0.02 0.00 0.04 0.00 0.00 34.50 31.04 1rlw s PRO 121 CO -0.03 0.52 -0.22 -0.06 0.04 0.00 0.00 177.00 177.25 1rlw s PHE 122 N -0.88 2.45 -0.20 0.56 0.40 0.13 -4.97 117.98 115.47 1rlw s PHE 122 Ca 0.35 -0.35 -0.04 0.00 -0.60 0.00 0.00 56.93 56.29 1rlw s PHE 122 Cb -0.22 -1.53 -0.01 0.00 0.51 0.00 0.00 43.02 41.77 1rlw s PHE 122 CO 0.24 0.04 -0.04 0.42 0.70 0.00 0.00 175.22 176.59 1rlw s ILE 123 N -0.67 3.55 -0.20 0.64 -1.09 -1.26 -0.23 121.20 121.94 1rlw s ILE 123 Ca 0.11 -0.45 -0.06 0.00 -2.23 0.00 0.00 60.65 58.02 1rlw s ILE 123 Cb -0.10 -2.60 -0.03 0.00 -1.58 0.00 0.00 42.46 38.15 1rlw s ILE 123 CO -0.00 0.44 0.04 -0.36 -1.23 0.00 0.00 174.94 173.82 1rlw s PHE 124 N 1.18 3.13 -1.70 3.97 0.40 0.29 -4.49 117.98 120.75 1rlw s PHE 124 Ca 0.02 -0.21 0.00 0.00 -0.60 0.00 0.00 56.93 56.14 1rlw s PHE 124 Cb -0.14 -2.11 0.00 0.00 0.51 0.00 0.00 43.02 41.27 1rlw s PHE 124 CO -0.00 -0.10 0.00 0.09 0.70 0.00 0.00 175.22 175.91 1rlw n ASN 125 N 4.08 -5.04 -1.44 1.36 3.02 -1.26 -1.53 115.26 114.44 1rlw n ASN 125 Ca -0.17 0.29 -0.18 0.00 -0.03 0.00 0.00 54.58 54.49 1rlw n ASN 125 Cb 0.52 -4.07 -0.08 0.00 -0.61 0.00 0.00 39.78 35.54 1rlw n ASN 125 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1rlw n GLN 126 N -2.55 -1.49 0.02 3.52 6.02 -1.26 -4.74 117.38 116.91 1rlw n GLN 126 Ca -0.18 1.13 0.00 0.00 -0.01 0.00 0.00 57.00 57.94 1rlw n GLN 126 Cb 0.59 -5.51 0.00 0.00 1.02 0.00 0.00 30.24 26.33 1rlw n GLN 126 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 1rlw n VAL 127 N -2.30 0.15 -3.62 5.09 0.31 -0.93 -5.08 118.33 111.95 1rlw n VAL 127 Ca -0.18 0.05 -0.36 0.00 -0.01 0.00 0.00 64.34 63.84 1rlw n VAL 127 Cb 0.65 -1.00 -0.07 0.00 -0.91 0.00 0.00 33.84 32.51 1rlw n VAL 127 CO 0.00 0.00 0.00 0.28 -1.32 0.00 0.00 176.83 175.79 1rlw s THR 128 N -2.00 5.35 -0.18 2.52 -1.32 -0.59 -4.79 115.64 114.64 1rlw s THR 128 Ca 0.00 0.41 -0.08 0.00 -1.21 0.00 0.00 61.69 60.81 1rlw s THR 128 Cb 0.00 -3.57 -0.04 0.00 -1.51 0.00 0.00 72.50 67.38 1rlw s THR 128 CO 0.00 0.41 0.09 -0.70 -2.21 0.00 0.00 174.62 172.22 1rlw s GLU 129 N 0.38 3.95 -0.14 7.08 2.12 -0.47 -0.54 118.70 131.09 1rlw s GLU 129 Ca 0.13 -0.27 0.02 0.00 0.36 0.00 0.00 54.97 55.21 1rlw s GLU 129 Cb -0.12 -3.27 0.01 0.00 0.26 0.00 0.00 34.13 31.01 1rlw s GLU 129 CO 0.02 0.36 -0.20 1.41 -0.54 0.00 0.00 175.26 176.31 1rlw s MET 130 N 0.14 2.83 -0.20 4.30 -2.45 0.68 0.28 119.30 124.89 1rlw s MET 130 Ca 0.07 -0.78 -0.06 0.00 -1.25 0.00 0.00 55.69 53.67 1rlw s MET 130 Cb -0.12 -2.32 -0.03 0.00 1.25 0.00 0.00 34.83 33.61 1rlw s MET 130 CO -0.00 -0.05 0.03 0.08 1.05 0.00 0.00 175.02 176.13 1rlw s VAL 131 N 0.91 4.27 0.05 10.11 1.01 0.13 0.19 120.40 137.07 1rlw s VAL 131 Ca -0.05 -0.21 0.09 0.00 0.00 0.00 0.00 61.98 61.80 1rlw s VAL 131 Cb -0.15 -2.93 -0.03 0.00 0.00 0.00 0.00 36.38 33.27 1rlw s VAL 131 CO -0.03 0.43 -0.24 -0.76 0.00 0.00 0.00 175.10 174.50 1rlw s LEU 132 N 0.81 2.18 -0.23 3.92 1.43 -0.57 -1.85 118.68 124.36 1rlw s LEU 132 Ca 0.02 -0.57 -0.04 0.00 -1.03 0.00 0.00 54.13 52.50 1rlw s LEU 132 Cb -0.14 -1.15 -0.01 0.00 0.03 0.00 0.00 46.19 44.93 1rlw s LEU 132 CO 0.02 0.21 -0.02 -0.70 0.23 0.00 0.00 176.35 176.09 1rlw s GLU 133 N -1.27 3.35 -0.11 1.70 2.12 -0.40 0.12 118.70 124.21 1rlw s GLU 133 Ca 0.10 -0.65 -0.06 0.00 0.36 0.00 0.00 54.97 54.73 1rlw s GLU 133 Cb -0.10 -3.08 -0.04 0.00 0.26 0.00 0.00 34.13 31.17 1rlw s GLU 133 CO 0.02 -0.23 0.11 -1.64 -0.54 0.00 0.00 175.26 172.98 1rlw s MET 134 N 1.49 3.33 -0.02 4.30 -1.94 0.87 -0.39 119.30 126.94 1rlw s MET 134 Ca 0.05 -0.20 0.02 0.00 -1.71 0.00 0.00 55.69 53.85 1rlw s MET 134 Cb -0.15 -3.09 0.00 0.00 2.01 0.00 0.00 34.83 33.60 1rlw s MET 134 CO -0.02 0.76 -0.07 -1.12 -0.01 0.00 0.00 175.02 174.56 1rlw s SER 135 N -1.00 0.92 -0.13 3.03 0.01 0.45 -0.70 113.70 116.30 1rlw s SER 135 Ca 0.15 -0.14 0.01 0.00 1.31 0.00 0.00 55.95 57.28 1rlw s SER 135 Cb -0.12 -0.23 0.02 0.00 0.21 0.00 0.00 66.02 65.90 1rlw s SER 135 CO 0.04 0.05 -0.15 -0.22 0.41 0.00 0.00 173.24 173.36 1rlw s LEU 136 N 0.18 1.71 0.17 2.44 2.96 -0.70 0.04 118.68 125.48 1rlw s LEU 136 Ca -0.02 -0.46 0.05 0.00 -0.22 0.00 0.00 54.13 53.47 1rlw s LEU 136 Cb -0.07 -1.14 -0.05 0.00 0.50 0.00 0.00 46.19 45.43 1rlw s LEU 136 CO -0.00 -0.02 -0.08 -1.61 -1.32 0.00 0.00 176.35 173.32 1rlw s GLU 137 N 1.22 1.15 0.27 1.98 2.02 -0.23 0.03 118.70 125.13 1rlw s GLU 137 Ca -0.01 -1.51 0.25 0.00 0.02 0.00 0.00 54.97 53.72 1rlw s GLU 137 Cb -0.14 -0.67 0.69 0.00 0.10 0.00 0.00 34.13 34.12 1rlw s GLU 137 CO -0.06 0.05 1.73 0.28 0.02 0.00 0.00 175.26 177.28 1rlw h VAL 138 N 2.69 0.00 -0.14 2.63 2.07 -1.85 0.44 116.25 122.10 1rlw h VAL 138 Ca -0.37 -0.61 -0.05 0.00 0.82 0.00 0.00 66.70 66.49 1rlw h VAL 138 Cb 1.20 1.61 0.01 0.00 -1.52 0.00 0.00 31.29 32.59 1rlw h VAL 138 CO 0.64 0.00 -0.08 0.00 0.02 0.00 0.00 177.57 178.15 1rlw n ALA 139 N -1.87 -1.49 -2.66 1.67 0.00 -1.26 -4.32 120.51 110.58 1rlw n ALA 139 Ca 0.05 0.01 -0.04 0.00 0.00 0.00 0.00 53.44 53.46 1rlw n ALA 139 Cb 0.45 -0.12 0.07 0.00 0.00 0.00 0.00 19.45 19.86 1rlw n ALA 139 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1rlw n SER 140 N 0.19 -1.21 0.00 0.00 2.88 -1.26 -4.19 113.62 110.03 1rlw n SER 140 Ca 0.01 -1.60 0.00 0.00 -1.33 0.00 0.00 58.87 55.95 1rlw n SER 140 Cb 0.03 0.64 0.00 0.00 -0.75 0.00 0.00 64.21 64.13 1rlw n SER 140 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61