#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2r97 s LYS 2 N 0.00 4.24 -0.14 0.00 1.02 -1.26 0.44 119.74 124.04 2r97 s LYS 2 Ca 0.00 0.58 0.01 0.00 0.02 0.00 0.00 55.97 56.58 2r97 s LYS 2 Cb 0.00 -3.55 0.02 0.00 -0.52 0.00 0.00 37.83 33.78 2r97 s LYS 2 CO 0.00 -0.15 -0.17 0.08 -0.92 0.00 0.00 175.35 174.18 2r97 s VAL 3 N 1.63 1.73 -0.19 3.17 1.01 -0.55 -0.03 120.40 127.16 2r97 s VAL 3 Ca 0.28 -0.76 -0.08 0.00 0.00 0.00 0.00 61.98 61.43 2r97 s VAL 3 Cb -0.16 -1.57 -0.04 0.00 0.00 0.00 0.00 36.38 34.61 2r97 s VAL 3 CO 0.11 0.48 0.07 -0.22 0.00 0.00 0.00 175.10 175.54 2r97 s LEU 4 N 1.14 3.81 -0.48 3.92 2.96 -0.07 -1.65 118.68 128.32 2r97 s LEU 4 Ca -0.02 0.06 -0.16 0.00 -0.22 0.00 0.00 54.13 53.80 2r97 s LEU 4 Cb -0.14 -1.97 0.08 0.00 0.50 0.00 0.00 46.19 44.66 2r97 s LEU 4 CO -0.06 0.15 0.41 -0.69 -1.32 0.00 0.00 176.35 174.84 2r97 s VAL 5 N 0.50 5.23 -0.25 1.68 1.01 0.31 0.11 120.40 128.98 2r97 s VAL 5 Ca 0.04 -1.09 -0.07 0.00 0.00 0.00 0.00 61.98 60.86 2r97 s VAL 5 Cb -0.13 -4.15 -0.02 0.00 0.00 0.00 0.00 36.38 32.09 2r97 s VAL 5 CO 0.01 -0.61 0.05 -0.22 0.00 0.00 0.00 175.10 174.33 2r97 s LEU 6 N 1.66 3.40 0.07 3.92 2.96 0.32 -1.06 118.68 129.94 2r97 s LEU 6 Ca 0.04 -0.30 0.01 0.00 -0.22 0.00 0.00 54.13 53.66 2r97 s LEU 6 Cb -0.25 -1.89 -0.03 0.00 0.50 0.00 0.00 46.19 44.52 2r97 s LEU 6 CO 0.06 -0.05 -0.06 -0.72 -1.32 0.00 0.00 176.35 174.26 2r97 s TYR 7 N 1.58 0.70 -0.08 5.38 -0.85 -0.50 -0.75 117.35 122.83 2r97 s TYR 7 Ca 0.06 -0.78 0.03 0.00 -0.52 0.00 0.00 57.07 55.86 2r97 s TYR 7 Cb -0.15 -0.43 -0.02 0.00 0.38 0.00 0.00 41.96 41.74 2r97 s TYR 7 CO 0.02 -0.17 -0.17 -0.47 -1.52 0.00 0.00 175.55 173.24 2r97 s TYR 8 N -2.78 2.66 -0.10 -3.49 5.04 0.10 -1.70 117.35 117.07 2r97 s TYR 8 Ca 0.02 -0.48 -0.06 0.00 -2.44 0.00 0.00 57.07 54.11 2r97 s TYR 8 Cb -0.00 -1.69 0.04 0.00 0.35 0.00 0.00 41.96 40.66 2r97 s TYR 8 CO -0.04 -0.06 0.25 0.45 -1.34 0.00 0.00 175.55 174.81 2r97 s SER 9 N -0.22 -0.26 -0.24 4.32 0.15 -1.26 -3.93 113.70 112.26 2r97 s SER 9 Ca -0.00 0.52 -0.02 0.00 0.70 0.00 0.00 55.95 57.15 2r97 s SER 9 Cb -0.13 0.43 -0.18 0.00 -1.71 0.00 0.00 66.02 64.43 2r97 s SER 9 CO 0.03 -0.15 -0.15 0.80 1.20 0.00 0.00 173.24 174.97 2r97 n MET 10 N 3.97 0.65 -0.09 5.44 1.56 -1.26 -4.70 117.12 122.68 2r97 n MET 10 Ca -0.23 0.19 0.04 0.00 -0.27 0.00 0.00 57.70 57.44 2r97 n MET 10 Cb 0.54 -1.55 0.09 0.00 2.15 0.00 0.00 33.22 34.45 2r97 n MET 10 CO 0.00 0.00 0.00 0.66 -0.73 0.00 0.00 175.97 175.90 2r97 n TYR 11 N -3.47 0.18 0.00 1.12 4.01 -1.26 0.64 117.16 118.38 2r97 n TYR 11 Ca -0.45 -0.66 0.00 0.00 -0.16 0.00 0.00 57.90 56.63 2r97 n TYR 11 Cb 0.97 -0.10 0.00 0.00 -0.31 0.00 0.00 39.34 39.91 2r97 n TYR 11 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2r97 n GLY 12 N -0.55 1.14 0.19 2.72 0.00 -1.26 -4.78 105.19 102.64 2r97 n GLY 12 Ca 0.08 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.00 2r97 n GLY 12 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 2r97 h HIS 13 N 0.00 0.63 -0.29 1.61 3.86 -1.96 -1.06 115.15 117.95 2r97 h HIS 13 Ca 0.00 -0.10 -0.13 0.00 -1.16 0.00 0.00 60.37 58.98 2r97 h HIS 13 Cb 0.00 -0.17 -0.01 0.00 1.06 0.00 0.00 27.41 28.29 2r97 h HIS 13 CO 0.00 0.69 -0.34 0.82 0.86 0.00 0.00 177.93 179.95 2r97 h ILE 14 N 0.40 1.29 -0.27 2.45 1.08 -1.93 -1.17 117.51 119.36 2r97 h ILE 14 Ca 0.10 -1.48 0.01 0.00 -0.39 0.00 0.00 64.86 63.10 2r97 h ILE 14 Cb 0.42 1.43 -0.02 0.00 -3.07 0.00 0.00 36.82 35.58 2r97 h ILE 14 CO 0.01 0.48 0.15 -0.08 -0.69 0.00 0.00 178.15 178.02 2r97 h GLU 15 N 0.54 0.30 -0.48 2.37 4.81 -1.81 0.61 114.58 120.92 2r97 h GLU 15 Ca 0.06 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.27 2r97 h GLU 15 Cb 0.85 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 30.13 2r97 h GLU 15 CO 0.07 0.20 0.31 1.15 -0.73 0.00 0.00 179.01 180.02 2r97 h THR 16 N 0.31 1.13 -0.81 0.32 2.02 -1.10 -2.03 112.91 112.74 2r97 h THR 16 Ca 0.11 -0.24 0.03 0.00 0.77 0.00 0.00 66.41 67.08 2r97 h THR 16 Cb 0.00 0.43 -0.05 0.00 -1.74 0.00 0.00 68.15 66.79 2r97 h THR 16 CO -0.05 0.12 0.52 0.24 0.37 0.00 0.00 175.52 176.72 2r97 h MET 17 N 0.65 0.98 -0.42 6.66 2.86 -0.54 -2.92 114.93 122.21 2r97 h MET 17 Ca 0.17 -0.06 -0.07 0.00 -2.06 0.00 0.00 59.70 57.69 2r97 h MET 17 Cb -0.07 -0.22 -0.02 0.00 0.06 0.00 0.00 31.60 31.35 2r97 h MET 17 CO -0.04 0.65 -0.02 0.00 1.06 0.00 0.00 176.91 178.56 2r97 h ALA 18 N 1.34 1.18 -0.62 6.32 0.00 0.61 -0.84 119.26 127.25 2r97 h ALA 18 Ca 0.32 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 2r97 h ALA 18 Cb 0.01 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 2r97 h ALA 18 CO -0.11 0.53 0.33 -0.09 0.00 0.00 0.00 179.25 179.91 2r97 h ARG 19 N 0.64 0.87 -0.40 0.00 2.43 -1.22 -1.57 114.38 115.13 2r97 h ARG 19 Ca 0.13 -0.11 -0.04 0.00 -0.81 0.00 0.00 59.98 59.15 2r97 h ARG 19 Cb 0.43 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 29.80 2r97 h ARG 19 CO 0.02 0.67 0.08 0.00 -1.51 0.00 0.00 179.97 179.23 2r97 h ALA 20 N 1.16 0.53 -0.19 2.80 0.00 -1.23 -1.24 119.26 121.10 2r97 h ALA 20 Ca 0.22 -0.20 0.05 0.00 0.00 0.00 0.00 54.91 54.98 2r97 h ALA 20 Cb 0.05 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.64 2r97 h ALA 20 CO -0.03 0.23 -0.16 0.28 0.00 0.00 0.00 179.25 179.57 2r97 h VAL 21 N 0.52 0.57 -0.95 0.00 2.07 -1.02 -1.67 116.25 115.77 2r97 h VAL 21 Ca 0.12 0.00 0.11 0.00 0.82 0.00 0.00 66.70 67.75 2r97 h VAL 21 Cb 0.34 0.57 -0.08 0.00 -1.52 0.00 0.00 31.29 30.60 2r97 h VAL 21 CO 0.00 0.00 0.58 0.00 0.02 0.00 0.00 177.57 178.18 2r97 h ALA 22 N 0.94 1.39 -0.28 1.67 0.00 -1.16 -0.69 119.26 121.13 2r97 h ALA 22 Ca 0.11 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 2r97 h ALA 22 Cb 0.34 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2r97 h ALA 22 CO -0.29 0.21 0.12 0.93 0.00 0.00 0.00 179.25 180.22 2r97 h GLU 23 N 0.95 0.42 -0.32 0.00 5.08 -0.74 0.33 114.58 120.30 2r97 h GLU 23 Ca 0.46 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 58.74 2r97 h GLU 23 Cb 0.41 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.58 2r97 h GLU 23 CO -0.25 0.43 0.19 0.78 -1.00 0.00 0.00 179.01 179.16 2r97 h GLY 24 N 0.31 0.46 1.16 -3.84 0.00 -0.58 -2.78 103.07 97.80 2r97 h GLY 24 Ca 0.09 -0.19 -0.00 0.00 0.00 0.00 0.00 47.33 47.23 2r97 h GLY 24 CO -0.01 0.19 0.52 0.00 0.00 0.00 0.00 176.54 177.24 2r97 h ALA 25 N 1.07 1.34 0.00 3.60 0.00 -0.98 -1.71 119.26 122.58 2r97 h ALA 25 Ca 0.11 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2r97 h ALA 25 Cb 0.01 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.46 2r97 h ALA 25 CO -0.02 0.58 0.00 0.43 0.00 0.00 0.00 179.25 180.24 2r97 n SER 26 N -4.38 0.54 0.26 0.00 7.64 0.09 -2.15 113.62 115.62 2r97 n SER 26 Ca 0.09 0.66 0.16 0.00 1.01 0.00 0.00 58.87 60.80 2r97 n SER 26 Cb 0.05 -0.77 0.63 0.00 -1.01 0.00 0.00 64.21 63.12 2r97 n SER 26 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 2r97 h LYS 27 N 0.00 0.00 -5.69 1.43 1.57 -1.10 -3.43 116.57 109.35 2r97 h LYS 27 Ca 0.00 0.00 -0.61 0.00 -1.87 0.00 0.00 60.65 58.17 2r97 h LYS 27 Cb 0.25 0.00 -0.11 0.00 0.08 0.00 0.00 32.23 32.45 2r97 h LYS 27 CO 0.00 0.00 0.32 0.08 -0.57 0.00 0.00 179.45 179.28 2r97 s VAL 28 N -3.60 4.83 0.07 0.50 1.01 -0.91 -5.00 120.40 117.30 2r97 s VAL 28 Ca 0.02 1.05 -0.30 0.00 0.00 0.00 0.00 61.98 62.75 2r97 s VAL 28 Cb 0.09 -4.11 -0.10 0.00 0.00 0.00 0.00 36.38 32.27 2r97 s VAL 28 CO 0.54 -0.23 1.94 0.47 0.00 0.00 0.00 175.10 177.81 2r97 n ASP 29 N 6.12 4.15 0.00 3.32 8.00 -1.26 -2.17 116.55 134.70 2r97 n ASP 29 Ca 0.02 0.93 0.00 0.00 0.71 0.00 0.00 54.79 56.45 2r97 n ASP 29 Cb 0.48 -1.54 0.00 0.00 -0.02 0.00 0.00 41.12 40.05 2r97 n ASP 29 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2r97 n GLY 30 N 4.46 2.85 3.65 0.44 0.00 -1.26 -5.01 105.19 110.32 2r97 n GLY 30 Ca 0.19 -0.76 -0.41 0.00 0.00 0.00 0.00 46.02 45.05 2r97 n GLY 30 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r97 s ALA 31 N -0.18 3.59 -0.49 4.61 0.00 -0.92 -4.62 121.76 123.74 2r97 s ALA 31 Ca 0.00 -0.12 -0.16 0.00 0.00 0.00 0.00 51.96 51.68 2r97 s ALA 31 Cb 0.00 -3.20 0.08 0.00 0.00 0.00 0.00 23.12 20.00 2r97 s ALA 31 CO 0.00 -0.77 0.47 -1.21 0.00 0.00 0.00 175.76 174.25 2r97 s GLU 32 N 2.45 3.01 -0.12 0.00 2.02 0.17 -4.85 118.70 121.38 2r97 s GLU 32 Ca 0.34 -1.31 -0.05 0.00 0.02 0.00 0.00 54.97 53.98 2r97 s GLU 32 Cb -0.16 -4.15 -0.04 0.00 0.10 0.00 0.00 34.13 29.88 2r97 s GLU 32 CO 0.10 -1.13 0.06 0.54 0.02 0.00 0.00 175.26 174.85 2r97 s VAL 33 N 1.88 4.83 0.00 2.63 0.11 -1.26 -1.48 120.40 127.11 2r97 s VAL 33 Ca 0.06 -0.04 0.02 0.00 -2.93 0.00 0.00 61.98 59.09 2r97 s VAL 33 Cb -0.24 -3.09 -0.01 0.00 -1.53 0.00 0.00 36.38 31.52 2r97 s VAL 33 CO 0.07 0.58 -0.07 0.54 -3.33 0.00 0.00 175.10 172.90 2r97 s VAL 34 N -0.69 0.52 -0.16 2.04 0.11 -0.66 -4.99 120.40 116.57 2r97 s VAL 34 Ca 0.12 -0.42 -0.05 0.00 -2.93 0.00 0.00 61.98 58.69 2r97 s VAL 34 Cb -0.12 -0.47 -0.03 0.00 -1.53 0.00 0.00 36.38 34.23 2r97 s VAL 34 CO 0.02 0.05 0.01 -0.69 -3.33 0.00 0.00 175.10 171.17 2r97 s VAL 35 N -0.36 4.36 0.06 2.04 1.01 -1.26 -0.53 120.40 125.71 2r97 s VAL 35 Ca 0.00 -0.19 -0.01 0.00 0.00 0.00 0.00 61.98 61.78 2r97 s VAL 35 Cb -0.04 -2.93 -0.04 0.00 0.00 0.00 0.00 36.38 33.37 2r97 s VAL 35 CO -0.00 0.49 -0.02 -0.54 0.00 0.00 0.00 175.10 175.03 2r97 s LYS 36 N 0.26 0.65 0.25 2.72 1.02 -0.22 -4.48 119.74 119.93 2r97 s LYS 36 Ca 0.00 -1.24 0.10 0.00 0.02 0.00 0.00 55.97 54.85 2r97 s LYS 36 Cb -0.13 0.22 -0.04 0.00 -0.52 0.00 0.00 37.83 37.35 2r97 s LYS 36 CO 0.02 -0.13 -0.07 -0.98 -0.92 0.00 0.00 175.35 173.27 2r97 s ARG 37 N -3.93 2.11 0.41 1.68 1.70 -0.45 -1.41 118.95 119.05 2r97 s ARG 37 Ca 0.09 -1.45 -0.19 0.00 -0.47 0.00 0.00 55.73 53.71 2r97 s ARG 37 Cb 0.08 -2.08 -0.10 0.00 -0.57 0.00 0.00 34.95 32.28 2r97 s ARG 37 CO -0.09 0.37 0.90 0.14 -1.08 0.00 0.00 175.30 175.55 2r97 s VAL 38 N -2.21 4.48 0.44 4.99 -7.23 -0.69 -1.05 120.40 119.14 2r97 s VAL 38 Ca 0.29 1.31 -0.25 0.00 -1.81 0.00 0.00 61.98 61.53 2r97 s VAL 38 Cb -0.07 -3.62 -0.09 0.00 0.56 0.00 0.00 36.38 33.17 2r97 s VAL 38 CO 0.18 -0.33 1.31 -2.65 -0.31 0.00 0.00 175.10 173.30 2r97 n PRO 39 N -0.69 1.98 -2.44 4.82 -0.02 -1.26 -4.90 135.00 132.49 2r97 n PRO 39 Ca 0.06 0.71 -0.42 0.00 -2.02 0.00 0.00 63.50 61.83 2r97 n PRO 39 Cb 0.54 -2.46 -0.03 0.00 -0.02 0.00 0.00 33.50 31.53 2r97 n PRO 39 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 2r97 s GLU 40 N -2.33 4.49 -0.12 -0.52 2.56 -1.26 -4.88 118.70 116.64 2r97 s GLU 40 Ca 0.62 1.78 0.15 0.00 0.00 0.00 0.00 54.97 57.52 2r97 s GLU 40 Cb -0.48 -3.31 -0.24 0.00 2.00 0.00 0.00 34.13 32.10 2r97 s GLU 40 CO 0.57 -0.13 0.38 2.41 -0.56 0.00 0.00 175.26 177.93 2r97 n THR 41 N 3.22 1.48 -2.87 -1.70 -1.04 -1.26 -4.88 114.28 107.24 2r97 n THR 41 Ca 0.06 -0.82 -0.40 0.00 -2.04 0.00 0.00 64.05 60.85 2r97 n THR 41 Cb 0.46 -0.75 -0.06 0.00 -1.82 0.00 0.00 70.33 68.17 2r97 n THR 41 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2r97 s MET 42 N -2.56 4.68 0.33 -2.82 0.23 -1.26 -5.00 119.30 112.90 2r97 s MET 42 Ca -0.07 1.30 -0.29 0.00 -1.03 0.00 0.00 55.69 55.60 2r97 s MET 42 Cb 0.07 -3.29 -0.11 0.00 -1.53 0.00 0.00 34.83 29.97 2r97 s MET 42 CO 0.83 0.48 1.51 -2.14 -2.03 0.00 0.00 175.02 173.67 2r97 s PRO 43 N -0.90 4.14 0.53 3.16 0.02 -1.26 -4.67 135.00 136.01 2r97 s PRO 43 Ca 0.39 2.53 0.26 0.00 0.02 0.00 0.00 61.00 64.20 2r97 s PRO 43 Cb -0.24 -3.01 0.89 0.00 0.02 0.00 0.00 34.50 32.17 2r97 s PRO 43 CO 0.28 -0.54 1.17 -2.30 -0.33 0.00 0.00 177.00 175.28 2r97 n PRO 44 N 1.27 0.01 -0.07 5.54 -0.02 -1.26 0.10 135.00 140.57 2r97 n PRO 44 Ca 0.04 0.90 -0.12 0.00 -2.02 0.00 0.00 63.50 62.30 2r97 n PRO 44 Cb 0.39 -2.23 -0.05 0.00 -0.02 0.00 0.00 33.50 31.59 2r97 n PRO 44 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 2r97 h GLN 45 N 0.00 0.43 0.10 -0.52 4.15 -2.00 -2.05 115.11 115.22 2r97 h GLN 45 Ca 0.48 -0.18 -0.27 0.00 0.77 0.00 0.00 58.65 59.45 2r97 h GLN 45 Cb 2.68 -0.01 -0.00 0.00 0.21 0.00 0.00 27.48 30.35 2r97 h GLN 45 CO -0.01 0.71 -1.25 -0.07 -1.93 0.00 0.00 178.83 176.29 2r97 h LEU 46 N 0.14 0.33 0.04 -2.39 3.38 -0.67 -2.63 115.31 113.51 2r97 h LEU 46 Ca 0.05 -0.37 0.02 0.00 0.09 0.00 0.00 57.88 57.67 2r97 h LEU 46 Cb 0.58 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 41.18 2r97 h LEU 46 CO 0.03 1.30 -0.22 0.15 0.09 0.00 0.00 178.44 179.79 2r97 h PHE 47 N 0.06 -0.58 -0.06 1.13 3.57 -1.57 -1.87 116.94 117.62 2r97 h PHE 47 Ca -0.13 0.02 -0.11 0.00 3.53 0.00 0.00 57.97 61.28 2r97 h PHE 47 Cb 1.94 0.25 -0.01 0.00 2.79 0.00 0.00 35.95 40.92 2r97 h PHE 47 CO 0.05 -0.31 -0.45 1.49 -2.23 0.00 0.00 178.31 176.86 2r97 h GLU 48 N -0.37 0.13 -0.50 1.11 4.22 -1.43 -1.02 114.58 116.72 2r97 h GLU 48 Ca 0.05 -0.06 -0.00 0.00 0.08 0.00 0.00 59.36 59.42 2r97 h GLU 48 Cb 0.43 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.65 2r97 h GLU 48 CO -0.17 0.56 0.30 -0.22 -2.18 0.00 0.00 179.01 177.29 2r97 h LYS 49 N 0.11 0.68 0.00 1.92 3.64 -1.40 -2.67 116.57 118.85 2r97 h LYS 49 Ca 0.01 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 2r97 h LYS 49 Cb 0.84 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.52 2r97 h LYS 49 CO 0.06 0.51 0.00 0.00 -2.27 0.00 0.00 179.45 177.75 2r97 n ALA 50 N -2.27 2.54 -0.94 5.00 0.00 -0.71 -4.89 120.51 119.25 2r97 n ALA 50 Ca 0.02 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.29 2r97 n ALA 50 Cb 0.06 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.04 2r97 n ALA 50 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2r97 n GLY 51 N 0.90 0.73 3.76 0.00 0.00 -1.01 -5.04 105.19 104.53 2r97 n GLY 51 Ca 0.20 -0.67 -0.33 0.00 0.00 0.00 0.00 46.02 45.22 2r97 n GLY 51 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2r97 s GLY 52 N -2.66 2.06 -0.31 -0.02 0.00 -0.41 -4.93 107.32 101.04 2r97 s GLY 52 Ca 0.00 0.54 -0.13 0.00 0.00 0.00 0.00 44.72 45.13 2r97 s GLY 52 CO 0.00 0.90 0.26 1.25 0.00 0.00 0.00 173.10 175.51 2r97 s LYS 53 N -4.27 3.70 0.11 2.90 2.20 0.21 -4.84 119.74 119.76 2r97 s LYS 53 Ca 0.67 -0.43 -0.31 0.00 -0.36 0.00 0.00 55.97 55.54 2r97 s LYS 53 Cb -0.21 -3.75 -0.10 0.00 -1.51 0.00 0.00 37.83 32.27 2r97 s LYS 53 CO 0.46 -0.36 1.77 0.99 -0.36 0.00 0.00 175.35 177.85 2r97 s THR 54 N 1.83 2.69 -0.05 3.43 2.01 -1.26 -4.73 115.64 119.55 2r97 s THR 54 Ca 0.08 0.19 -0.17 0.00 0.31 0.00 0.00 61.69 62.11 2r97 s THR 54 Cb -0.17 -3.12 -0.05 0.00 0.01 0.00 0.00 72.50 69.17 2r97 s THR 54 CO 0.11 -0.00 0.45 -1.10 -0.69 0.00 0.00 174.62 173.39 2r97 s GLN 55 N 2.69 4.14 -0.18 4.92 -1.52 -1.26 -4.99 119.66 123.47 2r97 s GLN 55 Ca 0.79 0.45 0.18 0.00 -1.95 0.00 0.00 55.36 54.83 2r97 s GLN 55 Cb -0.44 -3.32 -0.26 0.00 -0.22 0.00 0.00 33.01 28.77 2r97 s GLN 55 CO 0.35 0.44 0.12 2.41 -0.25 0.00 0.00 175.29 178.36 2r97 n THR 56 N 2.67 1.21 -1.70 -0.19 -1.04 -1.26 -5.02 114.28 108.95 2r97 n THR 56 Ca -0.11 -0.81 -0.38 0.00 -2.04 0.00 0.00 64.05 60.72 2r97 n THR 56 Cb 0.52 -0.41 0.06 0.00 -1.82 0.00 0.00 70.33 68.68 2r97 n THR 56 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2r97 n ALA 57 N -2.68 1.00 -1.71 2.41 0.00 -1.26 -4.91 120.51 113.36 2r97 n ALA 57 Ca -0.29 0.04 -0.41 0.00 0.00 0.00 0.00 53.44 52.78 2r97 n ALA 57 Cb 1.08 -2.27 0.01 0.00 0.00 0.00 0.00 19.45 18.27 2r97 n ALA 57 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2r97 n PRO 58 N -1.38 1.93 -2.98 0.00 -0.04 -1.26 -4.62 135.00 126.64 2r97 n PRO 58 Ca 0.14 0.69 -0.40 0.00 -0.04 0.00 0.00 63.50 63.88 2r97 n PRO 58 Cb 0.47 -2.41 -0.04 0.00 -0.04 0.00 0.00 33.50 31.47 2r97 n PRO 58 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2r97 s VAL 59 N -1.21 4.98 0.39 0.52 1.01 -1.26 -1.34 120.40 123.49 2r97 s VAL 59 Ca 0.62 1.52 -0.18 0.00 0.00 0.00 0.00 61.98 63.94 2r97 s VAL 59 Cb -0.50 -4.08 -0.10 0.00 0.00 0.00 0.00 36.38 31.71 2r97 s VAL 59 CO 0.57 0.17 0.85 0.00 0.00 0.00 0.00 175.10 176.70 2r97 s ALA 60 N 1.31 3.17 0.26 5.51 0.00 -0.22 -4.89 121.76 126.90 2r97 s ALA 60 Ca 0.38 0.20 -0.02 0.00 0.00 0.00 0.00 51.96 52.52 2r97 s ALA 60 Cb -0.17 -2.97 -0.04 0.00 0.00 0.00 0.00 23.12 19.94 2r97 s ALA 60 CO 0.16 0.18 0.48 0.95 0.00 0.00 0.00 175.76 177.53 2r97 s THR 61 N -2.15 5.12 0.36 0.00 -4.23 -1.26 -4.69 115.64 108.79 2r97 s THR 61 Ca 0.58 -0.21 0.03 0.00 -1.18 0.00 0.00 61.69 60.91 2r97 s THR 61 Cb -0.10 -3.75 0.26 0.00 1.34 0.00 0.00 72.50 70.26 2r97 s THR 61 CO 0.17 -0.28 2.02 -0.65 -0.54 0.00 0.00 174.62 175.34 2r97 h PRO 62 N 1.71 0.77 -0.20 3.99 0.11 -1.90 -3.05 132.00 133.43 2r97 h PRO 62 Ca -0.48 -0.05 -0.08 0.00 0.11 0.00 0.00 66.00 65.50 2r97 h PRO 62 Cb 1.19 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 32.12 2r97 h PRO 62 CO 0.66 0.52 -0.22 1.96 -0.21 0.00 0.00 178.00 180.71 2r97 h GLN 63 N 0.79 0.36 0.00 1.05 7.50 -1.95 -3.11 115.11 119.76 2r97 h GLN 63 Ca 0.21 -0.12 0.00 0.00 0.50 0.00 0.00 58.65 59.24 2r97 h GLN 63 Cb -0.08 -0.03 0.00 0.00 0.05 0.00 0.00 27.48 27.42 2r97 h GLN 63 CO -0.05 0.57 0.00 -0.85 -1.50 0.00 0.00 178.83 177.00 2r97 n GLU 64 N -4.16 0.00 -0.11 1.46 0.28 -1.15 -3.08 120.64 113.88 2r97 n GLU 64 Ca -0.00 0.22 0.20 0.00 -0.16 0.00 0.00 57.16 57.41 2r97 n GLU 64 Cb 0.36 -1.51 0.61 0.00 1.43 0.00 0.00 31.44 32.34 2r97 n GLU 64 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 177.13 176.90 2r97 h LEU 65 N 0.00 0.18 -1.54 -1.84 3.38 -1.70 -1.24 115.31 112.54 2r97 h LEU 65 Ca 0.00 0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.93 2r97 h LEU 65 Cb 0.29 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 2r97 h LEU 65 CO 0.00 0.09 -0.24 0.00 0.09 0.00 0.00 178.44 178.38 2r97 h ALA 66 N 1.66 1.35 0.00 1.53 0.00 -1.80 -1.91 119.26 120.09 2r97 h ALA 66 Ca 0.34 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2r97 h ALA 66 Cb 1.09 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.84 2r97 h ALA 66 CO -0.06 0.29 0.00 0.22 0.00 0.00 0.00 179.25 179.70 2r97 h ASP 67 N 0.00 0.00 -3.00 0.00 3.58 -1.47 -3.45 116.42 112.08 2r97 h ASP 67 Ca -0.00 0.00 -0.55 0.00 0.42 0.00 0.00 57.03 56.90 2r97 h ASP 67 Cb 0.50 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.53 2r97 h ASP 67 CO 0.03 0.00 -0.30 -0.31 -2.88 0.00 0.00 179.24 175.78 2r97 s TYR 68 N -3.71 3.48 -0.02 0.28 2.02 -0.72 -4.89 117.35 113.78 2r97 s TYR 68 Ca -0.00 0.45 0.09 0.00 -0.37 0.00 0.00 57.07 57.24 2r97 s TYR 68 Cb 0.10 -1.94 -0.23 0.00 -0.40 0.00 0.00 41.96 39.49 2r97 s TYR 68 CO 0.45 0.37 0.74 -0.44 -1.57 0.00 0.00 175.55 175.10 2r97 h ASP 69 N 2.22 0.07 -3.95 2.29 3.32 -0.76 -3.47 116.42 116.14 2r97 h ASP 69 Ca -0.47 -0.13 -0.21 0.00 0.02 0.00 0.00 57.03 56.24 2r97 h ASP 69 Cb 1.18 -0.02 -0.26 0.00 0.22 0.00 0.00 39.33 40.44 2r97 h ASP 69 CO 0.69 1.12 -0.65 0.00 -1.72 0.00 0.00 179.24 178.68 2r97 s ALA 70 N -2.61 -0.11 -0.13 3.45 0.00 -0.78 -2.28 121.76 119.30 2r97 s ALA 70 Ca -0.06 0.06 0.02 0.00 0.00 0.00 0.00 51.96 51.97 2r97 s ALA 70 Cb 0.08 -0.05 0.02 0.00 0.00 0.00 0.00 23.12 23.16 2r97 s ALA 70 CO 0.82 -0.05 -0.17 0.42 0.00 0.00 0.00 175.76 176.78 2r97 s ILE 71 N -0.20 1.67 -0.35 0.00 1.01 0.49 -0.89 121.20 122.94 2r97 s ILE 71 Ca -0.02 -0.73 -0.08 0.00 0.00 0.00 0.00 60.65 59.81 2r97 s ILE 71 Cb -0.02 -1.52 0.03 0.00 0.01 0.00 0.00 42.46 40.96 2r97 s ILE 71 CO 0.00 0.48 0.14 -0.63 0.00 0.00 0.00 174.94 174.93 2r97 s ILE 72 N 1.06 4.12 -0.08 2.92 1.01 0.12 -2.08 121.20 128.26 2r97 s ILE 72 Ca -0.04 -0.98 -0.18 0.00 0.00 0.00 0.00 60.65 59.45 2r97 s ILE 72 Cb -0.15 -3.30 -0.05 0.00 0.01 0.00 0.00 42.46 38.98 2r97 s ILE 72 CO -0.04 -0.18 0.48 -0.36 0.00 0.00 0.00 174.94 174.84 2r97 s PHE 73 N 1.47 3.57 -0.11 3.97 0.08 0.51 -0.52 117.98 126.96 2r97 s PHE 73 Ca 0.00 0.95 0.03 0.00 0.12 0.00 0.00 56.93 58.02 2r97 s PHE 73 Cb -0.19 -2.51 -0.01 0.00 -0.57 0.00 0.00 43.02 39.74 2r97 s PHE 73 CO 0.04 0.27 -0.20 0.20 -0.10 0.00 0.00 175.22 175.44 2r97 s GLY 74 N 0.22 1.41 0.00 4.36 0.00 0.07 -0.32 107.32 113.06 2r97 s GLY 74 Ca 0.26 -0.95 -0.00 0.00 0.00 0.00 0.00 44.72 44.03 2r97 s GLY 74 CO 0.12 -0.32 -0.00 -0.51 0.00 0.00 0.00 173.10 172.39 2r97 s THR 75 N 0.28 0.03 0.88 0.90 -4.23 -0.65 -0.72 115.64 112.13 2r97 s THR 75 Ca -0.14 -0.25 -0.10 0.00 -1.18 0.00 0.00 61.69 60.01 2r97 s THR 75 Cb -0.17 -0.09 0.13 0.00 1.34 0.00 0.00 72.50 73.71 2r97 s THR 75 CO 0.07 -0.14 1.13 -2.16 -0.54 0.00 0.00 174.62 172.98 2r97 s PRO 76 N -0.40 1.29 -0.10 3.99 0.04 -1.25 -3.06 135.00 135.51 2r97 s PRO 76 Ca -0.04 1.43 -0.24 0.00 0.04 0.00 0.00 61.00 62.19 2r97 s PRO 76 Cb -0.03 -1.77 -0.03 0.00 0.04 0.00 0.00 34.50 32.71 2r97 s PRO 76 CO -0.00 -2.40 0.72 -0.08 0.04 0.00 0.00 177.00 175.28 2r97 s THR 77 N -2.72 5.01 -0.48 1.26 -1.32 0.86 -3.96 115.64 114.28 2r97 s THR 77 Ca 0.65 1.46 0.04 0.00 -1.21 0.00 0.00 61.69 62.63 2r97 s THR 77 Cb -0.21 -4.05 0.13 0.00 -1.51 0.00 0.00 72.50 66.85 2r97 s THR 77 CO 0.58 0.19 0.23 -0.13 -2.21 0.00 0.00 174.62 173.28 2r97 s ARG 78 N 1.21 1.78 -1.50 7.08 1.81 -0.47 -4.80 118.95 124.06 2r97 s ARG 78 Ca 0.37 -2.42 -0.08 0.00 -1.72 0.00 0.00 55.73 51.88 2r97 s ARG 78 Cb -0.17 -3.10 0.06 0.00 -0.45 0.00 0.00 34.95 31.29 2r97 s ARG 78 CO 0.16 -1.10 0.70 1.19 -0.68 0.00 0.00 175.30 175.57 2r97 n PHE 79 N 3.32 -1.88 -1.01 -0.53 3.72 -1.26 -1.92 117.46 117.90 2r97 n PHE 79 Ca 0.05 0.82 -0.00 0.00 -0.05 0.00 0.00 57.45 58.27 2r97 n PHE 79 Cb 0.34 -3.70 -0.00 0.00 -0.94 0.00 0.00 39.48 35.17 2r97 n PHE 79 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2r97 n GLY 80 N -1.70 0.47 3.49 1.37 0.00 -1.26 -5.03 105.19 102.54 2r97 n GLY 80 Ca -0.12 -0.39 -0.23 0.00 0.00 0.00 0.00 46.02 45.27 2r97 n GLY 80 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2r97 s ASN 81 N -2.37 2.86 1.17 1.61 -0.87 -0.81 -2.48 114.94 114.06 2r97 s ASN 81 Ca 0.00 -1.35 -0.13 0.00 -1.57 0.00 0.00 52.86 49.82 2r97 s ASN 81 Cb 0.00 -0.19 0.29 0.00 -0.02 0.00 0.00 41.25 41.33 2r97 s ASN 81 CO 0.00 -0.52 1.03 0.00 -2.57 0.00 0.00 177.10 175.04 2r97 s MET 82 N -3.81 -1.01 0.61 -0.60 0.23 -1.26 -1.37 119.30 112.09 2r97 s MET 82 Ca 0.35 0.90 -0.14 0.00 -1.03 0.00 0.00 55.69 55.77 2r97 s MET 82 Cb 0.08 -1.54 -0.03 0.00 -1.53 0.00 0.00 34.83 31.82 2r97 s MET 82 CO 0.16 -3.80 1.05 -1.54 -2.03 0.00 0.00 175.02 168.85 2r97 s SER 83 N -2.43 5.80 0.46 -1.18 1.04 -1.25 -4.55 113.70 111.58 2r97 s SER 83 Ca 0.69 1.71 0.15 0.00 0.48 0.00 0.00 55.95 58.97 2r97 s SER 83 Cb -0.26 -2.52 1.09 0.00 0.10 0.00 0.00 66.02 64.44 2r97 s SER 83 CO 0.65 -1.16 2.02 1.23 0.98 0.00 0.00 173.24 176.96 2r97 h GLY 84 N 0.14 0.41 0.94 7.32 0.00 -1.96 0.76 103.07 110.68 2r97 h GLY 84 Ca -0.46 -0.13 -0.06 0.00 0.00 0.00 0.00 47.33 46.68 2r97 h GLY 84 CO 0.58 0.09 0.00 1.46 0.00 0.00 0.00 176.54 178.67 2r97 h GLN 85 N 0.32 0.67 -0.17 4.80 7.50 -1.91 -0.41 115.11 125.90 2r97 h GLN 85 Ca 0.21 -0.21 -0.14 0.00 0.50 0.00 0.00 58.65 59.01 2r97 h GLN 85 Cb 0.43 -0.06 -0.01 0.00 0.05 0.00 0.00 27.48 27.89 2r97 h GLN 85 CO -0.05 0.77 -0.49 1.98 -1.50 0.00 0.00 178.83 179.54 2r97 h MET 86 N 0.50 0.46 -0.23 1.46 4.05 -1.72 -2.27 114.93 117.18 2r97 h MET 86 Ca 0.11 -0.27 -0.16 0.00 -0.28 0.00 0.00 59.70 59.10 2r97 h MET 86 Cb 0.46 0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 31.28 2r97 h MET 86 CO 0.02 0.85 -0.50 -0.09 0.23 0.00 0.00 176.91 177.42 2r97 h ARG 87 N 0.37 0.64 0.09 0.39 9.65 -0.78 -0.68 114.38 124.06 2r97 h ARG 87 Ca 0.02 -0.38 -0.00 0.00 -1.10 0.00 0.00 59.98 58.51 2r97 h ARG 87 Cb 0.99 0.03 0.00 0.00 -1.39 0.00 0.00 29.97 29.61 2r97 h ARG 87 CO 0.09 0.99 -0.04 1.15 2.80 0.00 0.00 179.97 184.95 2r97 h THR 88 N 0.50 0.97 0.19 0.20 2.02 -1.05 -1.56 112.91 114.17 2r97 h THR 88 Ca 0.02 -0.22 0.01 0.00 0.77 0.00 0.00 66.41 66.99 2r97 h THR 88 Cb 1.05 1.11 -0.02 0.00 -1.74 0.00 0.00 68.15 68.56 2r97 h THR 88 CO 0.10 0.05 -0.20 0.15 0.37 0.00 0.00 175.52 175.99 2r97 h PHE 89 N -0.22 -0.52 -0.12 3.16 3.57 -1.31 -2.23 116.94 119.26 2r97 h PHE 89 Ca -0.01 0.00 0.04 0.00 3.53 0.00 0.00 57.97 61.53 2r97 h PHE 89 Cb 0.18 0.21 -0.00 0.00 2.79 0.00 0.00 35.95 39.13 2r97 h PHE 89 CO -0.04 -0.30 0.13 -0.07 -2.23 0.00 0.00 178.31 175.80 2r97 h LEU 90 N -0.42 0.00 -0.08 0.59 3.38 -1.09 -0.54 115.31 117.14 2r97 h LEU 90 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2r97 h LEU 90 Cb 0.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.15 2r97 h LEU 90 CO -0.06 0.00 0.00 0.47 0.09 0.00 0.00 178.44 178.94 2r97 n ASP 91 N -3.91 0.14 -1.67 -0.43 10.43 -0.59 -2.20 116.55 118.31 2r97 n ASP 91 Ca 0.00 0.53 0.09 0.00 2.57 0.00 0.00 54.79 57.98 2r97 n ASP 91 Cb 0.24 -0.56 0.37 0.00 1.84 0.00 0.00 41.12 43.02 2r97 n ASP 91 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 2r97 n GLN 92 N -1.64 4.00 -0.48 -1.24 6.02 -0.21 -4.19 117.38 119.64 2r97 n GLN 92 Ca 0.05 -2.97 0.08 0.00 -0.01 0.00 0.00 57.00 54.15 2r97 n GLN 92 Cb 0.25 -1.98 0.29 0.00 1.02 0.00 0.00 30.24 29.82 2r97 n GLN 92 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 2r97 n THR 93 N 1.06 1.75 -0.21 5.09 -2.24 -0.93 -4.59 114.28 114.21 2r97 n THR 93 Ca 0.27 -1.31 0.07 0.00 -2.27 0.00 0.00 64.05 60.81 2r97 n THR 93 Cb 0.96 0.13 0.34 0.00 -2.10 0.00 0.00 70.33 69.66 2r97 n THR 93 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2r97 h GLY 94 N 3.08 1.04 1.00 3.38 0.00 -1.79 -0.31 103.07 109.48 2r97 h GLY 94 Ca 0.00 -0.32 -0.09 0.00 0.00 0.00 0.00 47.33 46.92 2r97 h GLY 94 CO 0.18 0.22 -0.08 -1.33 0.00 0.00 0.00 176.54 175.52 2r97 h GLY 95 N 0.79 0.89 1.02 4.60 0.00 -1.94 -1.73 103.07 106.70 2r97 h GLY 95 Ca 0.34 -0.72 -0.03 0.00 0.00 0.00 0.00 47.33 46.92 2r97 h GLY 95 CO -0.12 0.66 0.37 1.41 0.00 0.00 0.00 176.54 178.85 2r97 h LEU 96 N 0.65 1.01 -0.13 3.11 3.38 -1.75 -2.09 115.31 119.50 2r97 h LEU 96 Ca 0.11 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.95 2r97 h LEU 96 Cb 0.61 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 2r97 h LEU 96 CO 0.04 0.86 0.08 -0.25 0.09 0.00 0.00 178.44 179.27 2r97 h TRP 97 N 1.09 0.16 -0.60 1.13 7.01 -0.92 0.14 115.95 123.95 2r97 h TRP 97 Ca 0.26 0.00 0.04 0.00 2.11 0.00 0.00 58.89 61.31 2r97 h TRP 97 Cb 0.12 -0.05 -0.03 0.00 -2.10 0.00 0.00 29.16 27.10 2r97 h TRP 97 CO 0.01 0.10 0.40 0.00 -2.79 0.00 0.00 178.44 176.16 2r97 h ALA 98 N 1.04 1.73 0.00 2.65 0.00 -1.24 -1.72 119.26 121.73 2r97 h ALA 98 Ca 0.05 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2r97 h ALA 98 Cb -0.02 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.60 2r97 h ALA 98 CO -0.01 0.19 -0.17 0.66 0.00 0.00 0.00 179.25 179.92 2r97 h SER 99 N 0.66 0.00 -0.73 0.00 4.64 -0.87 -3.48 113.55 113.76 2r97 h SER 99 Ca 0.25 -0.01 -0.12 0.00 -0.47 0.00 0.00 61.79 61.44 2r97 h SER 99 Cb 0.16 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.24 2r97 h SER 99 CO -0.07 0.01 -0.14 0.61 -0.87 0.00 0.00 176.83 176.36 2r97 n GLY 100 N 1.17 0.27 0.24 -0.77 0.00 0.36 -4.97 105.19 101.49 2r97 n GLY 100 Ca 0.04 -0.67 -0.06 0.00 0.00 0.00 0.00 46.02 45.33 2r97 n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r97 h ALA 101 N 0.23 0.76 -0.01 4.61 0.00 -1.50 -2.61 119.26 120.73 2r97 h ALA 101 Ca -0.14 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.72 2r97 h ALA 101 Cb 0.96 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.51 2r97 h ALA 101 CO 0.17 0.21 0.00 1.28 0.00 0.00 0.00 179.25 180.91 2r97 n LEU 102 N -4.65 0.60 -4.71 0.00 4.77 -1.26 -4.92 117.00 106.83 2r97 n LEU 102 Ca 0.04 -0.21 -0.42 0.00 -0.03 0.00 0.00 56.01 55.39 2r97 n LEU 102 Cb 0.03 -0.01 -0.03 0.00 -2.33 0.00 0.00 43.42 41.08 2r97 n LEU 102 CO 0.36 0.10 1.38 -0.47 -1.33 0.00 0.00 177.39 177.43 2r97 s TYR 103 N -1.99 2.65 0.00 -1.77 5.04 -0.99 -1.96 117.35 118.33 2r97 s TYR 103 Ca 0.42 0.26 0.00 0.00 -2.44 0.00 0.00 57.07 55.31 2r97 s TYR 103 Cb 0.21 -4.11 0.00 0.00 0.35 0.00 0.00 41.96 38.40 2r97 s TYR 103 CO 0.34 -4.34 0.00 0.41 -1.34 0.00 0.00 175.55 170.62 2r97 n GLY 104 N 4.03 2.01 3.78 8.97 0.00 0.83 -4.92 105.19 119.88 2r97 n GLY 104 Ca 0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.86 2r97 n GLY 104 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2r97 s LYS 105 N -0.03 2.74 0.20 1.61 1.02 -0.83 -4.43 119.74 120.03 2r97 s LYS 105 Ca 0.00 1.31 -0.28 0.00 0.02 0.00 0.00 55.97 57.01 2r97 s LYS 105 Cb 0.00 -1.95 -0.08 0.00 -0.52 0.00 0.00 37.83 35.28 2r97 s LYS 105 CO 0.00 -1.28 0.89 -0.51 -0.92 0.00 0.00 175.35 173.53 2r97 s LEU 106 N -5.08 4.62 0.02 3.17 1.43 -0.96 -0.42 118.68 121.46 2r97 s LEU 106 Ca 0.65 1.84 0.02 0.00 -1.03 0.00 0.00 54.13 55.61 2r97 s LEU 106 Cb -0.19 -3.51 -0.01 0.00 0.03 0.00 0.00 46.19 42.51 2r97 s LEU 106 CO 0.45 0.16 -0.06 0.00 0.23 0.00 0.00 176.35 177.12 2r97 s ALA 107 N -1.07 0.48 -0.01 4.21 0.00 0.01 -0.38 121.76 125.01 2r97 s ALA 107 Ca 0.40 -0.51 -0.28 0.00 0.00 0.00 0.00 51.96 51.57 2r97 s ALA 107 Cb -0.25 -0.02 0.07 0.00 0.00 0.00 0.00 23.12 22.92 2r97 s ALA 107 CO 0.30 0.03 0.63 0.45 0.00 0.00 0.00 175.76 177.17 2r97 s SER 108 N -0.92 -0.60 -0.02 0.00 0.15 -0.88 -1.10 113.70 110.32 2r97 s SER 108 Ca -0.05 0.52 0.03 0.00 0.70 0.00 0.00 55.95 57.16 2r97 s SER 108 Cb -0.06 0.53 -0.01 0.00 -1.71 0.00 0.00 66.02 64.77 2r97 s SER 108 CO 0.00 -0.67 -0.12 -0.69 1.20 0.00 0.00 173.24 172.97 2r97 s VAL 109 N -1.72 0.94 0.14 4.45 1.01 -1.26 -0.36 120.40 123.59 2r97 s VAL 109 Ca -0.09 -0.49 0.06 0.00 0.00 0.00 0.00 61.98 61.47 2r97 s VAL 109 Cb -0.00 -0.80 -0.04 0.00 0.00 0.00 0.00 36.38 35.53 2r97 s VAL 109 CO 0.05 0.27 -0.14 0.72 0.00 0.00 0.00 175.10 176.00 2r97 s PHE 110 N -0.13 1.45 0.29 5.22 -0.71 0.56 -3.91 117.98 120.75 2r97 s PHE 110 Ca 0.02 -0.57 0.05 0.00 -1.04 0.00 0.00 56.93 55.39 2r97 s PHE 110 Cb -0.06 -0.75 -0.03 0.00 -1.21 0.00 0.00 43.02 40.97 2r97 s PHE 110 CO -0.00 0.17 0.24 0.45 -1.34 0.00 0.00 175.22 174.74 2r97 s SER 111 N -2.61 1.24 0.04 1.98 0.15 -0.20 -1.63 113.70 112.66 2r97 s SER 111 Ca 0.11 -1.65 -0.02 0.00 0.70 0.00 0.00 55.95 55.09 2r97 s SER 111 Cb -0.04 0.51 -0.02 0.00 -1.71 0.00 0.00 66.02 64.76 2r97 s SER 111 CO 0.03 -1.00 0.02 -0.94 1.20 0.00 0.00 173.24 172.55 2r97 s SER 112 N -3.31 0.29 0.23 5.45 1.04 -1.17 -2.66 113.70 113.57 2r97 s SER 112 Ca 0.40 -0.67 0.04 0.00 0.48 0.00 0.00 55.95 56.21 2r97 s SER 112 Cb 0.04 0.18 -0.05 0.00 0.10 0.00 0.00 66.02 66.28 2r97 s SER 112 CO 0.23 -0.47 -0.03 0.42 0.98 0.00 0.00 173.24 174.38 2r97 s THR 113 N -2.64 1.16 0.00 2.02 -4.23 -0.15 -0.10 115.64 111.69 2r97 s THR 113 Ca -0.05 -2.05 0.00 0.00 -1.18 0.00 0.00 61.69 58.41 2r97 s THR 113 Cb -0.01 -2.30 0.00 0.00 1.34 0.00 0.00 72.50 71.53 2r97 s THR 113 CO -0.05 -0.37 0.00 0.61 -0.54 0.00 0.00 174.62 174.26 2r97 n GLY 114 N -0.42 -0.03 0.23 3.99 0.00 -1.26 0.24 105.19 107.95 2r97 n GLY 114 Ca -0.06 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.83 2r97 n GLY 114 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2r97 h THR 115 N 0.00 0.57 0.00 2.61 2.02 -1.89 -1.79 112.91 114.43 2r97 h THR 115 Ca 0.00 -0.50 0.00 0.00 0.77 0.00 0.00 66.41 66.68 2r97 h THR 115 Cb 0.00 0.79 0.00 0.00 -1.74 0.00 0.00 68.15 67.20 2r97 h THR 115 CO 0.00 0.09 0.00 0.61 0.37 0.00 0.00 175.52 176.59 2r97 n GLY 116 N -0.45 4.01 0.00 2.16 0.00 -1.26 -4.75 105.19 104.89 2r97 n GLY 116 Ca -0.10 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 44.88 2r97 n GLY 116 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2r97 n GLY 117 N -1.53 1.84 0.00 -0.02 0.00 -1.26 -5.02 105.19 99.19 2r97 n GLY 117 Ca 0.00 -1.42 0.00 0.00 0.00 0.00 0.00 46.02 44.60 2r97 n GLY 117 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2r97 n GLY 118 N 2.78 2.42 0.37 -0.02 0.00 -1.26 -4.73 105.19 104.75 2r97 n GLY 118 Ca 0.00 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.07 2r97 n GLY 118 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 2r97 h GLN 119 N 1.62 1.03 -0.44 1.61 -0.00 -1.93 0.24 115.11 117.24 2r97 h GLN 119 Ca 0.00 -0.06 -0.12 0.00 -0.00 0.00 0.00 58.65 58.46 2r97 h GLN 119 Cb 0.00 -0.23 -0.01 0.00 -0.00 0.00 0.00 27.48 27.24 2r97 h GLN 119 CO 0.00 0.68 -0.21 0.93 -0.00 0.00 0.00 178.83 180.24 2r97 h GLU 120 N 1.06 0.91 -0.58 0.06 5.08 -1.95 -2.38 114.58 116.79 2r97 h GLU 120 Ca 0.46 -0.40 -0.07 0.00 -1.00 0.00 0.00 59.36 58.35 2r97 h GLU 120 Cb 0.33 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.53 2r97 h GLU 120 CO -0.21 1.05 0.07 1.96 -1.00 0.00 0.00 179.01 180.89 2r97 h GLN 121 N 0.74 0.94 -0.08 2.33 1.08 -1.55 -1.22 115.11 117.35 2r97 h GLN 121 Ca 0.10 -0.24 0.00 0.00 -1.45 0.00 0.00 58.65 57.06 2r97 h GLN 121 Cb 0.78 -0.12 -0.00 0.00 -0.05 0.00 0.00 27.48 28.09 2r97 h GLN 121 CO 0.06 0.88 0.05 1.15 -0.95 0.00 0.00 178.83 180.03 2r97 h THR 122 N 0.89 1.02 0.02 -0.54 2.02 -0.25 -0.14 112.91 115.92 2r97 h THR 122 Ca 0.18 -0.04 -0.00 0.00 0.77 0.00 0.00 66.41 67.32 2r97 h THR 122 Cb 0.42 0.90 0.00 0.00 -1.74 0.00 0.00 68.15 67.73 2r97 h THR 122 CO 0.01 0.02 -0.01 0.40 0.37 0.00 0.00 175.52 176.31 2r97 h ILE 123 N 0.11 1.19 -0.03 3.11 2.04 -1.32 -1.80 117.51 120.79 2r97 h ILE 123 Ca 0.03 -0.62 -0.11 0.00 1.00 0.00 0.00 64.86 65.16 2r97 h ILE 123 Cb -0.01 1.60 -0.01 0.00 -0.74 0.00 0.00 36.82 37.66 2r97 h ILE 123 CO -0.01 0.16 -0.50 0.71 0.00 0.00 0.00 178.15 178.51 2r97 h THR 124 N -0.29 1.36 0.00 -0.27 1.35 -1.19 -0.92 112.91 112.95 2r97 h THR 124 Ca -0.00 -1.73 -0.09 0.00 -0.55 0.00 0.00 66.41 64.04 2r97 h THR 124 Cb 0.28 1.89 -0.01 0.00 -1.73 0.00 0.00 68.15 68.58 2r97 h THR 124 CO 0.00 0.50 -0.41 0.77 -0.25 0.00 0.00 175.52 176.14 2r97 h SER 125 N 0.07 0.00 -0.25 5.36 4.64 -0.99 -2.83 113.55 119.55 2r97 h SER 125 Ca 0.00 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.24 2r97 h SER 125 Cb 0.91 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.00 2r97 h SER 125 CO 0.07 0.41 -0.16 0.74 -0.87 0.00 0.00 176.83 177.02 2r97 h THR 126 N 0.00 1.31 -0.82 2.95 2.02 -0.84 -3.18 112.91 114.35 2r97 h THR 126 Ca -0.00 -1.27 0.18 0.00 0.77 0.00 0.00 66.41 66.09 2r97 h THR 126 Cb 0.93 1.59 -0.11 0.00 -1.74 0.00 0.00 68.15 68.82 2r97 h THR 126 CO 0.05 0.39 0.32 -0.50 0.37 0.00 0.00 175.52 176.16 2r97 h TRP 127 N 0.26 0.53 -0.38 3.16 6.55 -1.01 -1.98 115.95 123.09 2r97 h TRP 127 Ca 0.05 0.04 0.07 0.00 0.95 0.00 0.00 58.89 60.00 2r97 h TRP 127 Cb 0.68 -0.11 -0.09 0.00 -0.86 0.00 0.00 29.16 28.78 2r97 h TRP 127 CO 0.07 -0.01 -0.42 1.15 -1.05 0.00 0.00 178.44 178.18 2r97 h THR 128 N 0.40 0.12 -0.78 1.49 2.02 -1.48 0.09 112.91 114.77 2r97 h THR 128 Ca 0.48 0.00 0.11 0.00 0.77 0.00 0.00 66.41 67.77 2r97 h THR 128 Cb 0.84 0.12 -0.08 0.00 -1.74 0.00 0.00 68.15 67.29 2r97 h THR 128 CO -0.48 0.00 0.40 0.74 0.37 0.00 0.00 175.52 176.55 2r97 h THR 129 N -0.34 0.82 -0.74 3.16 2.02 -1.44 -2.32 112.91 114.08 2r97 h THR 129 Ca 0.13 -0.22 -0.02 0.00 0.77 0.00 0.00 66.41 67.07 2r97 h THR 129 Cb 0.58 0.12 -0.03 0.00 -1.74 0.00 0.00 68.15 67.08 2r97 h THR 129 CO -0.56 0.12 0.37 -0.07 0.37 0.00 0.00 175.52 175.76 2r97 h LEU 130 N 0.65 0.93 -1.20 2.58 3.38 -0.94 -2.54 115.31 118.17 2r97 h LEU 130 Ca 0.39 -0.09 -0.02 0.00 0.09 0.00 0.00 57.88 58.25 2r97 h LEU 130 Cb 0.45 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 2r97 h LEU 130 CO -0.29 0.77 0.31 0.00 0.09 0.00 0.00 178.44 179.31 2r97 h ALA 131 N 1.37 1.38 -0.47 1.53 0.00 -0.50 -0.82 119.26 121.75 2r97 h ALA 131 Ca 0.26 -0.12 -0.10 0.00 0.00 0.00 0.00 54.91 54.95 2r97 h ALA 131 Cb 0.07 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 2r97 h ALA 131 CO -0.04 0.49 -0.11 0.45 0.00 0.00 0.00 179.25 180.04 2r97 h HIS 132 N 0.86 0.95 0.00 0.00 3.86 -1.05 -1.78 115.15 117.99 2r97 h HIS 132 Ca 0.22 -0.18 0.00 0.00 -1.16 0.00 0.00 60.37 59.24 2r97 h HIS 132 Cb 0.07 -0.24 0.00 0.00 1.06 0.00 0.00 27.41 28.30 2r97 h HIS 132 CO 0.01 0.92 0.00 0.72 0.86 0.00 0.00 177.93 180.44 2r97 n HIS 133 N -4.15 0.00 -1.01 2.45 -0.00 -1.02 -4.89 115.22 106.60 2r97 n HIS 133 Ca 0.01 0.00 -0.00 0.00 -0.00 0.00 0.00 57.72 57.73 2r97 n HIS 133 Cb 0.38 -0.21 -0.00 0.00 -0.00 0.00 0.00 29.99 30.16 2r97 n HIS 133 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2r97 n GLY 134 N 0.17 0.45 3.76 -1.41 0.00 -0.67 -3.02 105.19 104.48 2r97 n GLY 134 Ca 0.10 -0.60 -0.39 0.00 0.00 0.00 0.00 46.02 45.12 2r97 n GLY 134 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2r97 s MET 135 N -1.19 4.55 -0.05 1.61 1.00 -0.36 -0.12 119.30 124.74 2r97 s MET 135 Ca 0.00 1.66 -0.30 0.00 0.00 0.00 0.00 55.69 57.05 2r97 s MET 135 Cb 0.00 -3.01 -0.04 0.00 0.00 0.00 0.00 34.83 31.78 2r97 s MET 135 CO 0.00 0.17 1.30 0.08 0.00 0.00 0.00 175.02 176.57 2r97 s VAL 136 N -1.32 4.04 -0.21 -6.03 1.01 0.44 -4.45 120.40 113.89 2r97 s VAL 136 Ca 0.48 1.37 -0.13 0.00 0.00 0.00 0.00 61.98 63.70 2r97 s VAL 136 Cb -0.28 -3.88 -0.05 0.00 0.00 0.00 0.00 36.38 32.17 2r97 s VAL 136 CO 0.35 -0.03 0.25 -0.63 0.00 0.00 0.00 175.10 175.05 2r97 s ILE 137 N 2.55 5.31 -0.39 2.22 1.01 -1.26 -0.81 121.20 129.84 2r97 s ILE 137 Ca 0.59 0.41 -0.01 0.00 0.00 0.00 0.00 60.65 61.64 2r97 s ILE 137 Cb -0.27 -3.59 0.10 0.00 0.01 0.00 0.00 42.46 38.72 2r97 s ILE 137 CO 0.23 0.34 0.15 -0.69 0.00 0.00 0.00 174.94 174.97 2r97 s VAL 138 N 0.93 2.99 0.63 2.92 1.01 -0.26 -4.97 120.40 123.65 2r97 s VAL 138 Ca 0.13 -2.11 -0.11 0.00 0.00 0.00 0.00 61.98 59.89 2r97 s VAL 138 Cb -0.13 -3.08 -0.03 0.00 0.00 0.00 0.00 36.38 33.14 2r97 s VAL 138 CO 0.05 -0.64 1.03 -2.84 0.00 0.00 0.00 175.10 172.69 2r97 s PRO 139 N 1.08 3.43 0.18 2.72 0.02 -1.26 -4.51 135.00 136.66 2r97 s PRO 139 Ca 0.08 0.66 0.24 0.00 0.02 0.00 0.00 61.00 62.00 2r97 s PRO 139 Cb -0.22 -2.08 0.25 0.00 0.02 0.00 0.00 34.50 32.47 2r97 s PRO 139 CO -0.05 -0.65 1.27 -0.84 -0.33 0.00 0.00 177.00 176.40 2r97 h ILE 140 N -0.36 0.00 0.00 2.83 3.07 -1.11 -3.49 117.51 118.45 2r97 h ILE 140 Ca -0.44 -0.69 0.00 0.00 1.55 0.00 0.00 64.86 65.27 2r97 h ILE 140 Cb 1.20 1.30 0.00 0.00 -0.27 0.00 0.00 36.82 39.05 2r97 h ILE 140 CO 0.62 0.00 0.00 0.61 -1.05 0.00 0.00 178.15 178.33 2r97 n GLY 141 N 1.27 1.54 2.81 0.16 0.00 -0.12 -3.66 105.19 107.18 2r97 n GLY 141 Ca 0.02 -0.53 -0.34 0.00 0.00 0.00 0.00 46.02 45.17 2r97 n GLY 141 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2r97 n TYR 142 N 3.77 3.49 0.00 1.61 4.01 -1.26 -4.08 117.16 124.70 2r97 n TYR 142 Ca 0.00 -3.80 0.00 0.00 -0.16 0.00 0.00 57.90 53.94 2r97 n TYR 142 Cb 0.00 -0.91 0.00 0.00 -0.31 0.00 0.00 39.34 38.12 2r97 n TYR 142 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2r97 n ALA 143 N 1.49 0.00 0.02 -0.72 0.00 -1.24 -5.10 120.51 114.97 2r97 n ALA 143 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.70 2r97 n ALA 143 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.82 2r97 n ALA 143 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2r97 n ALA 144 N -3.00 3.00 -2.68 0.00 0.00 -1.26 -4.70 120.51 111.87 2r97 n ALA 144 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.39 2r97 n ALA 144 Cb 0.00 0.08 0.07 0.00 0.00 0.00 0.00 19.45 19.60 2r97 n ALA 144 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2r97 n GLN 145 N -2.74 0.52 0.00 0.00 -0.00 -1.26 -4.66 117.38 109.23 2r97 n GLN 145 Ca 0.00 -1.14 0.00 0.00 -0.00 0.00 0.00 57.00 55.86 2r97 n GLN 145 Cb 0.08 -0.24 0.00 0.00 -0.00 0.00 0.00 30.24 30.08 2r97 n GLN 145 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.06 176.21 2r97 n GLU 146 N -0.08 -0.03 0.00 2.61 0.28 -1.26 -4.63 120.64 117.53 2r97 n GLU 146 Ca -0.10 -0.24 0.00 0.00 -0.16 0.00 0.00 57.16 56.66 2r97 n GLU 146 Cb 0.73 -0.61 0.00 0.00 1.43 0.00 0.00 31.44 32.99 2r97 n GLU 146 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 2r97 n LEU 147 N -0.02 0.00 0.00 -1.84 4.77 -1.26 -4.70 117.00 113.95 2r97 n LEU 147 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2r97 n LEU 147 Cb 0.25 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 2r97 n LEU 147 CO 0.00 0.00 0.00 0.54 -1.33 0.00 0.00 177.39 176.60 2r97 n ARG 154 N 0.00 0.53 0.00 3.23 1.74 -1.26 -4.19 116.66 116.71 2r97 n ARG 154 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2r97 n ARG 154 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 2r97 n ARG 154 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2r97 n GLY 155 N 0.00 0.15 3.83 -0.13 0.00 -1.26 -4.81 105.19 102.97 2r97 n GLY 155 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 2r97 n GLY 155 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2r97 s GLY 156 N 0.47 1.64 -0.01 -0.02 0.00 -1.26 -4.91 107.32 103.24 2r97 s GLY 156 Ca 0.00 -0.15 -0.09 0.00 0.00 0.00 0.00 44.72 44.48 2r97 s GLY 156 CO 0.00 0.22 0.18 -1.08 0.00 0.00 0.00 173.10 172.41 2r97 s THR 157 N -3.18 0.07 -0.92 0.90 -1.32 -1.26 -5.01 115.64 104.92 2r97 s THR 157 Ca 0.59 -0.57 0.16 0.00 -1.21 0.00 0.00 61.69 60.67 2r97 s THR 157 Cb -0.13 -0.45 0.14 0.00 -1.51 0.00 0.00 72.50 70.55 2r97 s THR 157 CO 0.54 -0.31 1.52 -0.81 -2.21 0.00 0.00 174.62 173.34 2r97 n PRO 158 N 1.61 0.03 0.08 7.08 -0.04 -1.26 -3.59 135.00 138.90 2r97 n PRO 158 Ca -0.21 0.27 -0.09 0.00 -0.04 0.00 0.00 63.50 63.42 2r97 n PRO 158 Cb 0.56 -1.56 0.01 0.00 -0.04 0.00 0.00 33.50 32.47 2r97 n PRO 158 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 2r97 h TYR 159 N 0.00 0.39 0.00 0.54 0.99 -1.95 0.55 116.97 117.50 2r97 h TYR 159 Ca 0.00 -0.20 0.00 0.00 2.00 0.00 0.00 58.73 60.53 2r97 h TYR 159 Cb 0.28 -0.05 0.00 0.00 1.00 0.00 0.00 36.73 37.96 2r97 h TYR 159 CO 0.00 0.99 0.00 0.41 -0.00 0.00 0.00 178.16 179.56 2r97 n GLY 160 N 0.76 0.95 3.77 3.88 0.00 -1.24 -3.99 105.19 109.32 2r97 n GLY 160 Ca -0.04 -0.93 -0.38 0.00 0.00 0.00 0.00 46.02 44.67 2r97 n GLY 160 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2r97 s ALA 161 N -2.00 3.04 0.17 4.61 0.00 -1.25 -4.36 121.76 121.96 2r97 s ALA 161 Ca 0.00 1.08 -0.00 0.00 0.00 0.00 0.00 51.96 53.04 2r97 s ALA 161 Cb 0.00 -3.44 -0.04 0.00 0.00 0.00 0.00 23.12 19.64 2r97 s ALA 161 CO 0.00 -0.81 0.07 0.95 0.00 0.00 0.00 175.76 175.97 2r97 s THR 162 N -1.41 0.26 -0.00 0.00 -4.23 -1.26 -1.03 115.64 107.96 2r97 s THR 162 Ca 0.62 -1.96 -0.08 0.00 -1.18 0.00 0.00 61.69 59.10 2r97 s THR 162 Cb -0.33 -2.24 0.00 0.00 1.34 0.00 0.00 72.50 71.27 2r97 s THR 162 CO 0.41 -0.30 0.15 0.28 -0.54 0.00 0.00 174.62 174.61 2r97 s THR 163 N -3.95 0.08 -0.24 3.99 -1.32 -1.09 -4.86 115.64 108.25 2r97 s THR 163 Ca 0.29 -0.62 -0.11 0.00 -1.21 0.00 0.00 61.69 60.04 2r97 s THR 163 Cb 0.07 -0.43 -0.05 0.00 -1.51 0.00 0.00 72.50 70.59 2r97 s THR 163 CO 0.06 -0.34 0.19 -0.63 -2.21 0.00 0.00 174.62 171.69 2r97 s ILE 164 N -1.26 5.33 -0.52 5.08 1.01 -1.26 -0.98 121.20 128.60 2r97 s ILE 164 Ca -0.13 0.23 0.23 0.00 0.00 0.00 0.00 60.65 60.98 2r97 s ILE 164 Cb -0.07 -3.53 -0.05 0.00 0.01 0.00 0.00 42.46 38.82 2r97 s ILE 164 CO 0.02 0.32 1.10 0.00 0.00 0.00 0.00 174.94 176.37 2r97 n ALA 165 N 4.47 3.06 0.00 9.38 0.00 0.14 -4.57 120.51 132.99 2r97 n ALA 165 Ca -0.14 -0.33 0.00 0.00 0.00 0.00 0.00 53.44 52.97 2r97 n ALA 165 Cb 0.52 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 18.92 2r97 n ALA 165 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2r97 n GLY 166 N 1.32 -2.36 0.31 0.00 0.00 -0.67 -1.10 105.19 102.68 2r97 n GLY 166 Ca 0.02 -1.47 0.19 0.00 0.00 0.00 0.00 46.02 44.75 2r97 n GLY 166 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2r97 h GLY 167 N 0.00 0.00 1.84 -0.02 0.00 -1.85 -0.35 103.07 102.69 2r97 h GLY 167 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 47.33 47.10 2r97 h GLY 167 CO 0.00 0.00 -1.11 -1.80 0.00 0.00 0.00 176.54 173.63 2r97 h ASP 168 N 0.00 0.06 0.00 0.19 -0.00 -1.91 -3.46 116.42 111.30 2r97 h ASP 168 Ca -0.00 -0.07 0.00 0.00 -0.00 0.00 0.00 57.03 56.96 2r97 h ASP 168 Cb 0.16 -0.02 0.00 0.00 -0.00 0.00 0.00 39.33 39.47 2r97 h ASP 168 CO 0.00 1.05 0.00 0.61 -0.00 0.00 0.00 179.24 180.91 2r97 n GLY 169 N 1.40 0.47 0.07 -0.78 0.00 -0.14 -4.93 105.19 101.28 2r97 n GLY 169 Ca -0.03 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.90 2r97 n GLY 169 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2r97 h SER 170 N 0.00 0.09 -3.82 1.61 4.64 -1.73 -3.47 113.55 110.88 2r97 h SER 170 Ca 0.00 -0.09 -0.53 0.00 -0.47 0.00 0.00 61.79 60.69 2r97 h SER 170 Cb 0.17 -0.03 0.10 0.00 -0.31 0.00 0.00 62.40 62.32 2r97 h SER 170 CO 0.00 1.05 0.78 -0.60 -0.87 0.00 0.00 176.83 177.19 2r97 s ARG 171 N -2.75 4.15 0.15 4.77 3.52 -0.26 -5.02 118.95 123.50 2r97 s ARG 171 Ca -0.00 2.52 0.04 0.00 -0.13 0.00 0.00 55.73 58.16 2r97 s ARG 171 Cb 0.10 -2.99 -0.04 0.00 -1.56 0.00 0.00 34.95 30.45 2r97 s ARG 171 CO 0.83 -0.50 0.14 -0.65 -0.81 0.00 0.00 175.30 174.31 2r97 s GLN 172 N -1.74 2.96 0.30 5.12 -1.52 -1.26 -4.50 119.66 119.01 2r97 s GLN 172 Ca 0.54 -0.81 -0.30 0.00 -1.95 0.00 0.00 55.36 52.84 2r97 s GLN 172 Cb -0.46 -2.69 -0.12 0.00 -0.22 0.00 0.00 33.01 29.52 2r97 s GLN 172 CO 0.59 0.50 1.40 -2.30 -0.25 0.00 0.00 175.29 175.23 2r97 n PRO 173 N -0.24 2.23 -1.58 2.91 -0.02 -1.26 -4.95 135.00 132.08 2r97 n PRO 173 Ca -0.08 0.79 -0.30 0.00 -2.02 0.00 0.00 63.50 61.89 2r97 n PRO 173 Cb 0.54 -2.45 0.08 0.00 -0.02 0.00 0.00 33.50 31.66 2r97 n PRO 173 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2r97 s SER 174 N 0.08 4.72 0.33 2.55 1.04 -1.26 -4.86 113.70 116.29 2r97 s SER 174 Ca 0.62 1.34 0.05 0.00 0.48 0.00 0.00 55.95 58.44 2r97 s SER 174 Cb -0.58 -2.11 0.70 0.00 0.10 0.00 0.00 66.02 64.13 2r97 s SER 174 CO 0.55 -1.83 1.87 -0.61 0.98 0.00 0.00 173.24 174.20 2r97 h GLN 175 N -0.99 0.81 -0.10 4.02 4.15 -1.99 -1.15 115.11 119.85 2r97 h GLN 175 Ca -0.46 -0.05 -0.21 0.00 0.77 0.00 0.00 58.65 58.70 2r97 h GLN 175 Cb 1.26 -0.18 0.00 0.00 0.21 0.00 0.00 27.48 28.77 2r97 h GLN 175 CO 0.59 0.53 -0.77 1.49 -1.93 0.00 0.00 178.83 178.74 2r97 h GLU 176 N 0.83 0.58 -0.79 1.69 4.81 -1.93 -1.89 114.58 117.89 2r97 h GLU 176 Ca 0.45 -0.49 -0.05 0.00 -0.13 0.00 0.00 59.36 59.14 2r97 h GLU 176 Cb 0.56 0.10 -0.03 0.00 0.63 0.00 0.00 28.75 30.01 2r97 h GLU 176 CO -0.21 1.11 0.30 0.93 -0.73 0.00 0.00 179.01 180.41 2r97 h GLU 177 N 0.39 1.19 -0.76 1.92 5.08 -1.76 -2.12 114.58 118.51 2r97 h GLU 177 Ca -0.05 -0.22 -0.02 0.00 -1.00 0.00 0.00 59.36 58.08 2r97 h GLU 177 Cb 1.38 -0.19 -0.04 0.00 0.50 0.00 0.00 28.75 30.40 2r97 h GLU 177 CO 0.15 0.97 0.42 -0.07 -1.00 0.00 0.00 179.01 179.47 2r97 h LEU 178 N 1.15 0.96 -0.98 1.33 3.38 -1.20 -1.65 115.31 118.31 2r97 h LEU 178 Ca 0.26 -0.10 -0.08 0.00 0.09 0.00 0.00 57.88 58.05 2r97 h LEU 178 Cb 0.23 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 2r97 h LEU 178 CO -0.02 0.78 -0.12 0.28 0.09 0.00 0.00 178.44 179.46 2r97 h SER 179 N 1.06 0.60 -0.49 -0.43 0.02 -1.13 0.11 113.55 113.28 2r97 h SER 179 Ca 0.27 -0.16 -0.06 0.00 -0.84 0.00 0.00 61.79 61.00 2r97 h SER 179 Cb 0.04 -0.16 -0.02 0.00 0.14 0.00 0.00 62.40 62.40 2r97 h SER 179 CO -0.04 0.74 0.08 0.40 -1.14 0.00 0.00 176.83 176.88 2r97 h ILE 180 N 0.56 1.25 -0.32 3.27 2.04 -1.25 0.26 117.51 123.32 2r97 h ILE 180 Ca 0.10 -0.91 -0.02 0.00 1.00 0.00 0.00 64.86 65.03 2r97 h ILE 180 Cb 0.53 0.89 -0.01 0.00 -0.74 0.00 0.00 36.82 37.49 2r97 h ILE 180 CO 0.03 0.33 0.12 0.00 0.00 0.00 0.00 178.15 178.63 2r97 h ALA 181 N 0.97 0.42 -0.23 1.87 0.00 -0.87 -0.88 119.26 120.52 2r97 h ALA 181 Ca 0.15 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 54.95 2r97 h ALA 181 Cb 0.39 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 2r97 h ALA 181 CO 0.01 0.03 0.05 0.00 0.00 0.00 0.00 179.25 179.34 2r97 h ARG 182 N 0.36 0.14 -0.49 0.00 3.08 -0.69 -2.11 114.38 114.67 2r97 h ARG 182 Ca 0.11 -0.01 0.10 0.00 0.07 0.00 0.00 59.98 60.25 2r97 h ARG 182 Cb 0.21 -0.03 -0.09 0.00 0.08 0.00 0.00 29.97 30.13 2r97 h ARG 182 CO -0.01 0.09 -0.12 -0.92 -1.07 0.00 0.00 179.97 177.95 2r97 h TYR 183 N 0.14 -0.25 -0.28 3.04 3.20 -0.67 -0.65 116.97 121.49 2r97 h TYR 183 Ca 0.11 0.04 0.04 0.00 3.14 0.00 0.00 58.73 62.06 2r97 h TYR 183 Cb 0.10 0.19 -0.04 0.00 1.54 0.00 0.00 36.73 38.52 2r97 h TYR 183 CO -0.15 -0.21 0.03 0.37 -1.64 0.00 0.00 178.16 176.56 2r97 h GLN 184 N 0.00 0.12 -0.51 1.82 4.15 -0.82 0.62 115.11 120.49 2r97 h GLN 184 Ca 0.24 -0.01 0.01 0.00 0.77 0.00 0.00 58.65 59.67 2r97 h GLN 184 Cb 0.36 -0.03 -0.03 0.00 0.21 0.00 0.00 27.48 28.00 2r97 h GLN 184 CO -0.51 0.08 0.32 0.78 -1.93 0.00 0.00 178.83 177.57 2r97 h GLY 185 N 0.12 0.72 0.98 2.39 0.00 -1.07 -1.45 103.07 104.77 2r97 h GLY 185 Ca 0.13 -0.25 -0.09 0.00 0.00 0.00 0.00 47.33 47.12 2r97 h GLY 185 CO -0.20 0.23 -0.12 -2.09 0.00 0.00 0.00 176.54 174.36 2r97 h GLU 186 N 0.65 0.77 0.38 4.80 4.81 -0.53 -1.39 114.58 124.06 2r97 h GLU 186 Ca 0.20 -0.30 -0.02 0.00 -0.13 0.00 0.00 59.36 59.10 2r97 h GLU 186 Cb -0.03 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.32 2r97 h GLU 186 CO -0.07 0.91 -0.18 -0.92 -0.73 0.00 0.00 179.01 178.03 2r97 h TYR 187 N 0.57 -0.47 -0.30 0.92 3.20 0.36 -1.51 116.97 119.74 2r97 h TYR 187 Ca 0.10 -0.01 -0.06 0.00 3.14 0.00 0.00 58.73 61.89 2r97 h TYR 187 Cb 0.65 0.16 -0.02 0.00 1.54 0.00 0.00 36.73 39.05 2r97 h TYR 187 CO 0.05 -0.21 -0.09 -0.39 -1.64 0.00 0.00 178.16 175.89 2r97 h VAL 188 N -0.66 1.22 -0.85 1.81 -1.51 -1.30 -2.27 116.25 112.69 2r97 h VAL 188 Ca -0.05 -0.94 -0.00 0.00 -1.23 0.00 0.00 66.70 64.47 2r97 h VAL 188 Cb 0.47 1.09 -0.04 0.00 -2.13 0.00 0.00 31.29 30.68 2r97 h VAL 188 CO 0.09 0.31 0.53 0.00 -1.23 0.00 0.00 177.57 177.26 2r97 h ALA 189 N 1.44 1.08 -0.30 5.19 0.00 -1.20 0.35 119.26 125.82 2r97 h ALA 189 Ca 0.09 -0.09 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 2r97 h ALA 189 Cb 0.44 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2r97 h ALA 189 CO 0.02 0.53 -0.25 0.78 0.00 0.00 0.00 179.25 180.33 2r97 h GLY 190 N 1.16 0.63 0.84 0.00 0.00 -1.08 -0.14 103.07 104.48 2r97 h GLY 190 Ca 0.31 -0.53 -0.03 0.00 0.00 0.00 0.00 47.33 47.08 2r97 h GLY 190 CO -0.06 0.48 0.02 -2.00 0.00 0.00 0.00 176.54 174.98 2r97 h LEU 191 N 0.51 0.38 -0.90 3.11 5.85 -0.80 0.74 115.31 124.20 2r97 h LEU 191 Ca 0.07 -0.29 0.02 0.00 0.84 0.00 0.00 57.88 58.52 2r97 h LEU 191 Cb 0.70 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 41.58 2r97 h LEU 191 CO 0.05 0.58 0.59 0.00 -0.34 0.00 0.00 178.44 179.32 2r97 h ALA 192 N 0.82 1.16 -0.12 1.25 0.00 -0.11 -1.26 119.26 121.00 2r97 h ALA 192 Ca 0.07 -0.06 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 2r97 h ALA 192 Cb 0.37 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 2r97 h ALA 192 CO 0.01 0.51 -0.03 0.28 0.00 0.00 0.00 179.25 180.02 2r97 h VAL 193 N 1.20 1.29 -0.95 0.00 2.07 -0.91 0.21 116.25 119.15 2r97 h VAL 193 Ca 0.34 -0.96 0.27 0.00 0.82 0.00 0.00 66.70 67.17 2r97 h VAL 193 Cb -0.10 1.67 -0.14 0.00 -1.52 0.00 0.00 31.29 31.21 2r97 h VAL 193 CO -0.09 0.28 0.44 0.50 0.02 0.00 0.00 177.57 178.73 2r97 h LYS 194 N -0.07 0.32 0.00 1.57 3.64 -0.52 -2.55 116.57 118.95 2r97 h LYS 194 Ca 0.03 -0.02 -0.13 0.00 -1.27 0.00 0.00 60.65 59.26 2r97 h LYS 194 Cb 0.44 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.17 2r97 h LYS 194 CO 0.01 0.21 -1.24 -0.07 -2.27 0.00 0.00 179.45 176.09 2r97 h LEU 195 N 0.32 0.00 0.00 5.20 3.38 -0.99 -3.44 115.31 119.78 2r97 h LEU 195 Ca 0.65 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.62 2r97 h LEU 195 Cb 1.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.13 2r97 h LEU 195 CO -0.60 0.47 -0.76 0.59 0.09 0.00 0.00 178.44 178.23 2r97 n ASN 196 N -2.89 1.35 -0.69 -0.43 3.02 0.71 -5.04 115.26 111.30 2r97 n ASN 196 Ca -0.07 -0.44 0.13 0.00 -0.03 0.00 0.00 54.58 54.17 2r97 n ASN 196 Cb 0.78 1.14 0.34 0.00 -0.61 0.00 0.00 39.78 41.44 2r97 n ASN 196 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25