#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b76 s THR 2 N 0.00 3.75 -2.38 4.28 2.01 -1.26 -5.03 115.64 117.02 2b76 s THR 2 Ca 0.00 -1.62 0.22 0.00 0.31 0.00 0.00 61.69 60.59 2b76 s THR 2 Cb 0.00 -2.96 0.43 0.00 0.01 0.00 0.00 72.50 69.98 2b76 s THR 2 CO 0.00 -0.27 1.47 1.17 -0.69 0.00 0.00 174.62 176.30 2b76 n LYS 3 N -0.64 2.10 -4.03 4.92 4.81 -1.26 -4.95 118.16 119.11 2b76 n LYS 3 Ca -0.08 -1.65 -0.22 0.00 -0.87 0.00 0.00 58.31 55.49 2b76 n LYS 3 Cb 0.57 -1.45 -0.05 0.00 0.02 0.00 0.00 35.03 34.13 2b76 n LYS 3 CO 0.00 0.00 0.00 0.50 1.17 0.00 0.00 177.40 179.07 2b76 s ARG 4 N -1.66 2.61 -0.55 1.64 3.52 -1.26 -5.07 118.95 118.18 2b76 s ARG 4 Ca 0.35 -1.33 0.04 0.00 -0.13 0.00 0.00 55.73 54.66 2b76 s ARG 4 Cb 0.20 -2.36 0.14 0.00 -1.56 0.00 0.00 34.95 31.36 2b76 s ARG 4 CO 0.28 0.21 0.30 0.15 -0.81 0.00 0.00 175.30 175.44 2b76 s LYS 5 N -3.87 2.05 -0.80 5.12 -0.14 -1.26 -5.08 119.74 115.75 2b76 s LYS 5 Ca 0.37 -2.75 -0.26 0.00 -1.36 0.00 0.00 55.97 51.97 2b76 s LYS 5 Cb -0.05 -3.31 -0.11 0.00 -1.68 0.00 0.00 37.83 32.68 2b76 s LYS 5 CO 0.24 -1.15 2.28 -2.14 -0.76 0.00 0.00 175.35 173.82 2b76 s PRO 6 N -0.50 1.90 -0.03 -1.68 0.02 -1.26 -4.93 135.00 128.51 2b76 s PRO 6 Ca 0.19 0.34 -0.30 0.00 0.02 0.00 0.00 61.00 61.24 2b76 s PRO 6 Cb -0.22 -4.84 -0.06 0.00 0.02 0.00 0.00 34.50 29.41 2b76 s PRO 6 CO -0.03 -4.08 1.59 -0.47 -0.33 0.00 0.00 177.00 173.68 2b76 s TYR 7 N 13.31 2.26 -0.16 6.54 6.14 -1.26 -5.01 117.35 139.17 2b76 s TYR 7 Ca 0.86 0.37 -0.06 0.00 0.64 0.00 0.00 57.07 58.88 2b76 s TYR 7 Cb -0.11 -3.86 -0.04 0.00 0.42 0.00 0.00 41.96 38.37 2b76 s TYR 7 CO 0.07 -3.50 0.03 0.08 0.64 0.00 0.00 175.55 172.87 2b76 s VAL 8 N 3.46 4.52 0.40 3.14 1.01 -1.26 -5.11 120.40 126.56 2b76 s VAL 8 Ca 0.71 -0.14 -0.11 0.00 0.00 0.00 0.00 61.98 62.44 2b76 s VAL 8 Cb -0.34 -3.00 -0.06 0.00 0.00 0.00 0.00 36.38 32.98 2b76 s VAL 8 CO 0.29 0.50 0.77 -0.13 0.00 0.00 0.00 175.10 176.52 2b76 s ARG 9 N 0.14 3.79 0.25 2.72 0.52 -1.26 -5.06 118.95 120.05 2b76 s ARG 9 Ca 0.03 0.48 -0.30 0.00 -0.52 0.00 0.00 55.73 55.42 2b76 s ARG 9 Cb -0.13 -2.39 -0.09 0.00 0.52 0.00 0.00 34.95 32.86 2b76 s ARG 9 CO 0.01 -0.03 1.21 -2.14 0.02 0.00 0.00 175.30 174.37 2b76 s PRO 10 N -3.82 4.49 -0.77 3.54 0.02 -1.26 -4.99 135.00 132.22 2b76 s PRO 10 Ca 0.51 1.96 0.01 0.00 0.02 0.00 0.00 61.00 63.50 2b76 s PRO 10 Cb -0.10 -3.18 0.19 0.00 0.02 0.00 0.00 34.50 31.43 2b76 s PRO 10 CO 0.31 -0.04 0.60 1.41 -0.33 0.00 0.00 177.00 178.95 2b76 s MET 11 N -0.95 2.82 1.32 5.54 1.75 -1.26 -5.09 119.30 123.43 2b76 s MET 11 Ca 0.50 -3.17 -0.19 0.00 -1.25 0.00 0.00 55.69 51.58 2b76 s MET 11 Cb -0.35 -3.70 0.33 0.00 2.84 0.00 0.00 34.83 33.96 2b76 s MET 11 CO 0.42 -1.25 0.97 -0.08 -0.65 0.00 0.00 175.02 174.43 2b76 s THR 12 N -1.16 1.51 -0.22 10.11 -1.32 -1.26 -4.94 115.64 118.35 2b76 s THR 12 Ca 0.25 0.00 0.22 0.00 -1.21 0.00 0.00 61.69 60.94 2b76 s THR 12 Cb -0.09 -2.10 -0.01 0.00 -1.51 0.00 0.00 72.50 68.78 2b76 s THR 12 CO -0.12 0.00 1.02 -1.28 -2.21 0.00 0.00 174.62 172.03 2b76 h SER 13 N -3.10 0.00 -0.05 8.08 0.87 -2.06 -3.13 113.55 114.16 2b76 h SER 13 Ca -0.50 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.06 2b76 h SER 13 Cb 1.34 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.30 2b76 h SER 13 CO 0.37 0.10 0.00 0.35 -0.53 0.00 0.00 176.83 177.11 2b76 n THR 14 N -2.73 0.06 0.01 2.23 -2.24 -1.26 -4.36 114.28 105.99 2b76 n THR 14 Ca -0.01 -0.08 -0.11 0.00 -2.27 0.00 0.00 64.05 61.57 2b76 n THR 14 Cb 0.60 -0.10 -0.05 0.00 -2.10 0.00 0.00 70.33 68.68 2b76 n THR 14 CO 0.00 0.00 0.00 4.11 -0.57 0.00 0.00 175.07 178.61 2b76 h TRP 15 N 0.48 -0.98 0.00 4.78 5.08 -1.91 -1.54 115.95 121.87 2b76 h TRP 15 Ca 0.00 0.04 -0.00 0.00 1.08 0.00 0.00 58.89 60.01 2b76 h TRP 15 Cb 0.11 0.45 -0.00 0.00 -3.00 0.00 0.00 29.16 26.71 2b76 h TRP 15 CO 0.03 -0.42 -0.00 0.11 -1.28 0.00 0.00 178.44 176.87 2b76 h TRP 16 N -0.43 0.00 0.00 0.12 5.08 -1.88 -2.68 115.95 116.17 2b76 h TRP 16 Ca 0.09 0.00 -0.03 0.00 1.08 0.00 0.00 58.89 60.03 2b76 h TRP 16 Cb 0.57 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 26.73 2b76 h TRP 16 CO -0.42 0.00 -0.15 -0.22 -1.28 0.00 0.00 178.44 176.36 2b76 h LYS 17 N 0.00 0.00 0.00 0.12 3.64 -1.58 -2.81 116.57 115.94 2b76 h LYS 17 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2b76 h LYS 17 Cb 0.16 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.98 2b76 h LYS 17 CO 0.00 0.15 0.00 1.63 -2.27 0.00 0.00 179.45 178.96 2b76 n LYS 18 N -4.13 0.00 -2.11 1.90 4.76 -1.01 -4.79 118.16 112.78 2b76 n LYS 18 Ca -0.02 0.00 -0.41 0.00 -2.87 0.00 0.00 58.31 55.01 2b76 n LYS 18 Cb 0.23 -0.41 -0.02 0.00 -1.84 0.00 0.00 35.03 32.99 2b76 n LYS 18 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2b76 s LEU 19 N 0.00 4.41 0.00 -0.35 1.02 -1.26 -4.95 118.68 117.56 2b76 s LEU 19 Ca 0.00 2.61 0.11 0.00 0.02 0.00 0.00 54.13 56.86 2b76 s LEU 19 Cb 0.00 -3.63 0.64 0.00 0.02 0.00 0.00 46.19 43.22 2b76 s LEU 19 CO 0.00 -0.58 1.16 -2.65 0.02 0.00 0.00 176.35 174.31 2b76 n PRO 20 N 1.72 0.67 -0.07 1.29 -0.02 -1.26 -1.15 135.00 136.18 2b76 n PRO 20 Ca 0.04 0.00 -0.04 0.00 -2.02 0.00 0.00 63.50 61.48 2b76 n PRO 20 Cb 0.42 -1.25 -0.16 0.00 -0.02 0.00 0.00 33.50 32.48 2b76 n PRO 20 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2b76 n PHE 21 N -0.75 0.03 -0.01 6.00 7.35 -1.26 -3.66 117.46 125.16 2b76 n PHE 21 Ca 0.08 0.01 -0.17 0.00 -0.76 0.00 0.00 57.45 56.61 2b76 n PHE 21 Cb 0.04 -0.87 -0.12 0.00 0.35 0.00 0.00 39.48 38.88 2b76 n PHE 21 CO 0.00 0.00 0.00 1.88 -0.76 0.00 0.00 176.76 177.88 2b76 h TYR 22 N 0.00 0.37 -0.33 -5.13 0.05 -1.51 -2.39 116.97 108.03 2b76 h TYR 22 Ca -0.39 -0.23 0.06 0.00 0.05 0.00 0.00 58.73 58.23 2b76 h TYR 22 Cb 1.89 -0.03 -0.06 0.00 1.01 0.00 0.00 36.73 39.54 2b76 h TYR 22 CO 0.00 1.09 -0.07 -0.09 -1.05 0.00 0.00 178.16 178.05 2b76 h ARG 23 N -0.45 0.02 0.00 4.88 2.43 -0.86 0.47 114.38 120.87 2b76 h ARG 23 Ca -0.07 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 2b76 h ARG 23 Cb 1.24 -0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.79 2b76 h ARG 23 CO 0.09 0.01 0.00 0.74 -1.51 0.00 0.00 179.97 179.30 2b76 h PHE 24 N 0.02 0.00 0.29 2.20 0.04 -1.63 -2.31 116.94 115.55 2b76 h PHE 24 Ca 0.16 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.91 2b76 h PHE 24 Cb 0.24 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.39 2b76 h PHE 24 CO -0.29 0.00 -0.14 -0.92 -0.60 0.00 0.00 178.31 176.36 2b76 h TYR 25 N 0.00 -0.36 -0.42 -0.55 3.20 0.43 -1.67 116.97 117.59 2b76 h TYR 25 Ca 0.00 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 61.88 2b76 h TYR 25 Cb 0.34 0.12 -0.03 0.00 1.54 0.00 0.00 36.73 38.70 2b76 h TYR 25 CO 0.00 -0.09 0.25 0.52 -1.64 0.00 0.00 178.16 177.20 2b76 h MET 26 N -0.60 0.49 0.11 1.82 2.86 -1.16 -2.36 114.93 116.08 2b76 h MET 26 Ca -0.04 -0.03 0.01 0.00 -2.06 0.00 0.00 59.70 57.58 2b76 h MET 26 Cb 0.43 -0.11 -0.03 0.00 0.06 0.00 0.00 31.60 31.95 2b76 h MET 26 CO 0.07 0.32 -0.36 1.25 1.06 0.00 0.00 176.91 179.25 2b76 h LEU 27 N 0.50 -1.08 -1.72 1.22 5.85 -1.31 0.65 115.31 119.43 2b76 h LEU 27 Ca 0.17 0.11 0.37 0.00 0.84 0.00 0.00 57.88 59.37 2b76 h LEU 27 Cb 0.01 0.39 -0.05 0.00 0.37 0.00 0.00 40.66 41.38 2b76 h LEU 27 CO -0.08 -0.39 1.07 -0.09 -0.34 0.00 0.00 178.44 178.62 2b76 h ARG 28 N -0.53 0.00 0.06 1.25 1.12 -1.07 0.67 114.38 115.87 2b76 h ARG 28 Ca -0.01 0.00 -0.15 0.00 -1.11 0.00 0.00 59.98 58.71 2b76 h ARG 28 Cb 0.53 0.00 0.02 0.00 -0.01 0.00 0.00 29.97 30.50 2b76 h ARG 28 CO -0.18 0.00 -0.63 0.93 -3.11 0.00 0.00 179.97 176.97 2b76 h GLU 29 N 0.00 0.33 -1.09 0.20 4.39 0.59 -3.15 114.58 115.85 2b76 h GLU 29 Ca 0.60 -0.43 0.30 0.00 0.34 0.00 0.00 59.36 60.17 2b76 h GLU 29 Cb 2.74 0.14 -0.08 0.00 -0.10 0.00 0.00 28.75 31.46 2b76 h GLU 29 CO -0.01 1.14 0.74 0.78 -1.16 0.00 0.00 179.01 180.50 2b76 h GLY 30 N -0.27 0.78 0.00 -3.84 0.00 0.48 -1.19 103.07 99.03 2b76 h GLY 30 Ca -0.09 -0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.11 2b76 h GLY 30 CO 0.12 -0.10 0.74 -0.37 0.00 0.00 0.00 176.54 176.93 2b76 n THR 31 N -4.47 0.00 0.05 4.70 5.66 -0.86 0.56 114.28 119.91 2b76 n THR 31 Ca 0.26 0.74 -0.22 0.00 -3.05 0.00 0.00 64.05 61.77 2b76 n THR 31 Cb 1.03 -1.49 -0.14 0.00 -1.55 0.00 0.00 70.33 68.17 2b76 n THR 31 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2b76 h ALA 32 N 0.00 0.16 -0.32 1.79 0.00 -1.44 -3.29 119.26 116.16 2b76 h ALA 32 Ca 0.00 -1.12 0.00 0.00 0.00 0.00 0.00 54.91 53.79 2b76 h ALA 32 Cb 1.47 0.46 0.00 0.00 0.00 0.00 0.00 17.79 19.72 2b76 h ALA 32 CO 0.00 0.94 0.00 0.28 0.00 0.00 0.00 179.25 180.47 2b76 n VAL 33 N -3.73 0.00 0.08 0.00 0.31 0.19 0.13 118.33 115.31 2b76 n VAL 33 Ca -0.25 1.45 0.19 0.00 -0.01 0.00 0.00 64.34 65.72 2b76 n VAL 33 Cb 1.00 -2.02 0.73 0.00 -0.91 0.00 0.00 33.84 32.65 2b76 n VAL 33 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 2b76 h PRO 34 N 0.00 0.00 -0.07 5.55 0.13 -1.78 -1.03 132.00 134.80 2b76 h PRO 34 Ca 0.00 0.00 0.02 0.00 -0.87 0.00 0.00 66.00 65.15 2b76 h PRO 34 Cb 0.00 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.13 2b76 h PRO 34 CO 0.00 0.00 0.09 0.00 -0.23 0.00 0.00 178.00 177.86 2b76 h ALA 35 N 1.71 1.57 0.00 -0.56 0.00 -0.38 0.16 119.26 121.75 2b76 h ALA 35 Ca 0.19 -0.00 -0.32 0.00 0.00 0.00 0.00 54.91 54.77 2b76 h ALA 35 Cb 0.85 0.01 -0.06 0.00 0.00 0.00 0.00 17.79 18.58 2b76 h ALA 35 CO -0.00 -0.12 -2.21 1.33 0.00 0.00 0.00 179.25 178.25 2b76 n VAL 36 N -3.71 1.21 -0.29 0.00 0.24 -0.44 -3.79 118.33 111.56 2b76 n VAL 36 Ca -0.01 -0.59 0.03 0.00 -2.04 0.00 0.00 64.34 61.72 2b76 n VAL 36 Cb 0.18 -0.94 0.16 0.00 -1.47 0.00 0.00 33.84 31.77 2b76 n VAL 36 CO 0.00 0.00 0.00 -0.25 -2.14 0.00 0.00 176.83 174.44 2b76 h TRP 37 N 0.00 0.84 -0.92 6.34 2.91 -1.02 0.71 115.95 124.81 2b76 h TRP 37 Ca -0.48 0.03 0.04 0.00 1.13 0.00 0.00 58.89 59.61 2b76 h TRP 37 Cb 1.89 -0.25 -0.05 0.00 -0.51 0.00 0.00 29.16 30.23 2b76 h TRP 37 CO 0.01 0.34 0.60 0.35 -1.03 0.00 0.00 178.44 178.72 2b76 h PHE 38 N 0.78 1.11 0.00 2.65 3.57 -0.86 0.25 116.94 124.44 2b76 h PHE 38 Ca 0.39 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.89 2b76 h PHE 38 Cb 0.36 -0.37 -0.00 0.00 2.79 0.00 0.00 35.95 38.72 2b76 h PHE 38 CO -0.06 0.64 -0.13 1.03 -2.23 0.00 0.00 178.31 177.56 2b76 h SER 39 N 1.15 0.00 -0.03 0.41 0.87 0.07 -0.82 113.55 115.20 2b76 h SER 39 Ca 0.36 0.00 -0.22 0.00 -1.23 0.00 0.00 61.79 60.71 2b76 h SER 39 Cb 0.02 0.00 0.02 0.00 -0.44 0.00 0.00 62.40 62.00 2b76 h SER 39 CO -0.11 0.13 -0.83 0.40 -0.53 0.00 0.00 176.83 175.89 2b76 h ILE 40 N 0.00 1.33 0.28 2.23 2.04 0.30 -2.76 117.51 120.92 2b76 h ILE 40 Ca -0.00 -2.13 0.00 0.00 1.00 0.00 0.00 64.86 63.74 2b76 h ILE 40 Cb 0.23 2.39 -0.04 0.00 -0.74 0.00 0.00 36.82 38.66 2b76 h ILE 40 CO 0.02 0.65 -0.49 -0.33 0.00 0.00 0.00 178.15 177.99 2b76 h GLU 41 N 0.23 -0.80 -1.11 2.37 5.08 0.34 0.30 114.58 121.00 2b76 h GLU 41 Ca -0.10 0.05 0.32 0.00 -1.00 0.00 0.00 59.36 58.64 2b76 h GLU 41 Cb 1.50 0.18 -0.04 0.00 0.50 0.00 0.00 28.75 30.89 2b76 h GLU 41 CO 0.17 -0.53 0.86 -0.07 -1.00 0.00 0.00 179.01 178.43 2b76 h LEU 42 N -0.83 0.00 0.21 1.33 -0.00 -1.26 -0.00 115.31 114.75 2b76 h LEU 42 Ca -0.02 0.00 -0.01 0.00 -0.00 0.00 0.00 57.88 57.85 2b76 h LEU 42 Cb 0.79 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.45 2b76 h LEU 42 CO -0.19 0.00 -0.10 0.40 -0.00 0.00 0.00 178.44 178.56 2b76 h ILE 43 N 0.00 0.54 -0.86 1.22 2.04 -0.16 -1.01 117.51 119.28 2b76 h ILE 43 Ca 0.53 -1.01 0.22 0.00 1.00 0.00 0.00 64.86 65.60 2b76 h ILE 43 Cb 2.24 0.92 -0.14 0.00 -0.74 0.00 0.00 36.82 39.10 2b76 h ILE 43 CO -0.01 0.15 0.17 -0.26 0.00 0.00 0.00 178.15 178.20 2b76 h PHE 44 N -0.97 0.24 -0.25 1.37 0.04 0.18 0.53 116.94 118.09 2b76 h PHE 44 Ca -0.03 0.05 0.05 0.00 2.80 0.00 0.00 57.97 60.85 2b76 h PHE 44 Cb 0.45 0.03 -0.05 0.00 2.20 0.00 0.00 35.95 38.58 2b76 h PHE 44 CO 0.06 -0.23 -0.10 0.78 -0.60 0.00 0.00 178.31 178.22 2b76 h GLY 45 N 0.17 0.12 1.14 -1.45 0.00 -1.01 0.25 103.07 102.28 2b76 h GLY 45 Ca 0.53 0.13 0.02 0.00 0.00 0.00 0.00 47.33 48.00 2b76 h GLY 45 CO -0.67 -0.13 0.55 -2.00 0.00 0.00 0.00 176.54 174.29 2b76 h LEU 46 N -0.06 0.92 -0.68 3.11 5.85 0.13 -0.92 115.31 123.66 2b76 h LEU 46 Ca 0.13 -0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.78 2b76 h LEU 46 Cb 0.26 -0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 2b76 h LEU 46 CO -0.29 0.66 -0.23 -0.26 -0.34 0.00 0.00 178.44 177.98 2b76 h PHE 47 N 1.08 0.00 0.12 1.25 0.05 0.10 -3.18 116.94 116.37 2b76 h PHE 47 Ca 0.31 0.00 -0.33 0.00 3.82 0.00 0.00 57.97 61.77 2b76 h PHE 47 Cb -0.06 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 37.87 2b76 h PHE 47 CO -0.00 0.23 -1.74 0.00 -0.18 0.00 0.00 178.31 176.62 2b76 h ALA 48 N 1.77 0.36 0.00 2.45 0.00 -0.71 -2.56 119.26 120.57 2b76 h ALA 48 Ca -0.00 -1.24 0.00 0.00 0.00 0.00 0.00 54.91 53.66 2b76 h ALA 48 Cb 0.92 0.47 0.00 0.00 0.00 0.00 0.00 17.79 19.18 2b76 h ALA 48 CO 0.03 1.22 0.00 -0.11 0.00 0.00 0.00 179.25 180.39 2b76 n LEU 49 N -3.44 1.70 0.00 0.00 7.94 -0.38 -2.07 117.00 120.75 2b76 n LEU 49 Ca -0.23 -0.85 0.00 0.00 -1.11 0.00 0.00 56.01 53.82 2b76 n LEU 49 Cb 1.05 -0.30 0.00 0.00 0.53 0.00 0.00 43.42 44.71 2b76 n LEU 49 CO 0.48 0.29 0.00 1.17 -1.11 0.00 0.00 177.39 178.21 2b76 n LYS 50 N 0.67 0.00 0.00 1.96 0.00 -1.23 -4.71 118.16 114.85 2b76 n LYS 50 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 58.31 58.32 2b76 n LYS 50 Cb 0.29 -0.25 0.06 0.00 0.00 0.00 0.00 35.03 35.12 2b76 n LYS 50 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 2b76 n ASN 51 N -1.90 0.00 0.00 3.14 3.02 -0.88 -4.88 115.26 113.76 2b76 n ASN 51 Ca 0.00 -0.63 0.00 0.00 -0.03 0.00 0.00 54.58 53.92 2b76 n ASN 51 Cb 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 2b76 n ASN 51 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2b76 n GLY 52 N -0.18 0.12 0.55 7.41 0.00 -1.16 -4.63 105.19 107.30 2b76 n GLY 52 Ca 0.01 -1.40 0.40 0.00 0.00 0.00 0.00 46.02 45.04 2b76 n GLY 52 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2b76 n PRO 53 N 0.93 0.00 -0.04 1.61 -0.04 -1.26 0.16 135.00 136.35 2b76 n PRO 53 Ca 0.00 0.85 -0.10 0.00 -0.04 0.00 0.00 63.50 64.21 2b76 n PRO 53 Cb 0.00 -1.98 -0.03 0.00 -0.04 0.00 0.00 33.50 31.44 2b76 n PRO 53 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 2b76 h GLU 54 N 0.00 0.27 0.03 0.54 4.22 -1.93 -3.08 114.58 114.64 2b76 h GLU 54 Ca 0.71 -0.02 -0.00 0.00 0.08 0.00 0.00 59.36 60.13 2b76 h GLU 54 Cb 2.93 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 32.12 2b76 h GLU 54 CO -0.01 0.18 -0.02 0.00 -2.18 0.00 0.00 179.01 176.99 2b76 h ALA 55 N 1.07 -0.04 -0.79 2.92 0.00 -0.54 -3.11 119.26 118.76 2b76 h ALA 55 Ca 0.07 -0.16 0.23 0.00 0.00 0.00 0.00 54.91 55.05 2b76 h ALA 55 Cb -0.03 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 2b76 h ALA 55 CO -0.02 -0.37 0.72 2.35 0.00 0.00 0.00 179.25 181.94 2b76 h TRP 56 N -0.36 0.00 0.00 0.00 2.91 -1.54 0.91 115.95 117.86 2b76 h TRP 56 Ca -0.00 0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.02 2b76 h TRP 56 Cb 0.34 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 28.99 2b76 h TRP 56 CO 0.03 0.00 -0.28 0.00 -1.03 0.00 0.00 178.44 177.16 2b76 h ALA 57 N 1.29 0.82 0.00 2.65 0.00 -1.46 -2.57 119.26 120.00 2b76 h ALA 57 Ca 0.38 0.00 -0.06 0.00 0.00 0.00 0.00 54.91 55.22 2b76 h ALA 57 Cb 1.82 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.60 2b76 h ALA 57 CO -0.00 0.00 -0.65 0.78 0.00 0.00 0.00 179.25 179.38 2b76 h GLY 58 N 4.42 0.00 0.89 0.00 0.00 0.72 -2.29 103.07 106.81 2b76 h GLY 58 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.29 2b76 h GLY 58 CO 0.00 0.00 -0.37 -2.75 0.00 0.00 0.00 176.54 173.42 2b76 h PHE 59 N 0.00 -0.95 -0.00 5.60 -0.00 -0.71 -2.09 116.94 118.79 2b76 h PHE 59 Ca -0.03 -0.02 0.00 0.00 -0.00 0.00 0.00 57.97 57.92 2b76 h PHE 59 Cb 1.22 0.32 -0.00 0.00 -0.00 0.00 0.00 35.95 37.49 2b76 h PHE 59 CO 0.00 -0.58 0.00 0.28 -0.00 0.00 0.00 178.31 178.02 2b76 h VAL 60 N -1.15 0.85 -0.49 1.41 2.07 -1.57 0.06 116.25 117.42 2b76 h VAL 60 Ca -0.11 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.42 2b76 h VAL 60 Cb 0.81 1.00 -0.03 0.00 -1.52 0.00 0.00 31.29 31.55 2b76 h VAL 60 CO 0.17 0.00 0.32 -0.78 0.02 0.00 0.00 177.57 177.31 2b76 h ASP 61 N 0.00 0.55 -0.63 0.57 3.58 -0.89 0.48 116.42 120.09 2b76 h ASP 61 Ca 0.00 -0.01 0.04 0.00 0.42 0.00 0.00 57.03 57.48 2b76 h ASP 61 Cb 0.00 -0.14 -0.05 0.00 1.72 0.00 0.00 39.33 40.87 2b76 h ASP 61 CO -0.00 0.40 0.36 0.15 -2.88 0.00 0.00 179.24 177.27 2b76 h PHE 62 N 0.66 0.67 0.00 0.28 3.04 -0.35 0.15 116.94 121.39 2b76 h PHE 62 Ca 0.18 0.02 0.00 0.00 3.98 0.00 0.00 57.97 62.16 2b76 h PHE 62 Cb -0.07 -0.21 0.00 0.00 2.56 0.00 0.00 35.95 38.23 2b76 h PHE 62 CO -0.04 0.35 0.00 -0.07 -2.02 0.00 0.00 178.31 176.53 2b76 h LEU 63 N 0.69 0.00 0.00 0.59 3.38 -0.56 -2.86 115.31 116.55 2b76 h LEU 63 Ca 0.27 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.24 2b76 h LEU 63 Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 2b76 h LEU 63 CO -0.14 0.00 -0.70 1.56 0.09 0.00 0.00 178.44 179.25 2b76 h GLN 64 N 0.00 0.00 -6.42 1.13 4.20 0.28 -3.44 115.11 110.86 2b76 h GLN 64 Ca 0.00 0.00 -0.61 0.00 0.06 0.00 0.00 58.65 58.10 2b76 h GLN 64 Cb 0.43 0.00 0.05 0.00 0.30 0.00 0.00 27.48 28.26 2b76 h GLN 64 CO 0.00 0.00 0.74 0.09 -0.67 0.00 0.00 178.83 178.99 2b76 n ASN 65 N -2.67 2.76 -0.20 1.46 3.02 -0.84 -4.88 115.26 113.91 2b76 n ASN 65 Ca 0.02 1.08 0.00 0.00 -0.03 0.00 0.00 54.58 55.65 2b76 n ASN 65 Cb 0.52 -1.36 0.11 0.00 -0.61 0.00 0.00 39.78 38.44 2b76 n ASN 65 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 2b76 h PRO 66 N 5.91 0.27 0.40 3.52 0.13 -1.90 -2.81 132.00 137.53 2b76 h PRO 66 Ca -0.46 -0.02 -0.02 0.00 -0.87 0.00 0.00 66.00 64.63 2b76 h PRO 66 Cb 1.28 -0.06 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2b76 h PRO 66 CO 0.87 0.18 -0.19 0.28 -0.23 0.00 0.00 178.00 178.91 2b76 h VAL 67 N 0.28 0.61 0.00 1.56 2.07 -1.95 -0.15 116.25 118.67 2b76 h VAL 67 Ca 0.31 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 67.67 2b76 h VAL 67 Cb 0.45 0.69 0.00 0.00 -1.52 0.00 0.00 31.29 30.91 2b76 h VAL 67 CO -0.38 0.03 0.28 0.40 0.02 0.00 0.00 177.57 177.92 2b76 h ILE 68 N -0.64 0.00 -0.01 4.57 5.03 -1.78 0.30 117.51 124.98 2b76 h ILE 68 Ca -0.06 0.00 0.00 0.00 -0.12 0.00 0.00 64.86 64.68 2b76 h ILE 68 Cb 0.47 0.33 0.00 0.00 -3.03 0.00 0.00 36.82 34.59 2b76 h ILE 68 CO 0.09 0.00 -0.66 0.52 -0.68 0.00 0.00 178.15 177.42 2b76 n VAL 69 N -2.14 0.00 0.10 1.67 0.31 -0.13 -0.96 118.33 117.19 2b76 n VAL 69 Ca -0.01 -0.17 -0.09 0.00 -0.01 0.00 0.00 64.34 64.06 2b76 n VAL 69 Cb 0.30 1.09 -0.06 0.00 -0.91 0.00 0.00 33.84 34.27 2b76 n VAL 69 CO 0.00 0.00 0.00 -0.29 -1.32 0.00 0.00 176.83 175.22 2b76 h ILE 70 N 0.86 0.44 -0.93 2.52 2.10 0.21 -2.91 117.51 119.80 2b76 h ILE 70 Ca 0.00 -0.90 0.17 0.00 1.08 0.00 0.00 64.86 65.21 2b76 h ILE 70 Cb 0.51 0.73 -0.17 0.00 -1.09 0.00 0.00 36.82 36.81 2b76 h ILE 70 CO 0.00 0.11 -0.28 0.40 -1.08 0.00 0.00 178.15 177.31 2b76 h ILE 71 N -0.99 0.06 0.00 2.19 2.04 -1.36 0.32 117.51 119.77 2b76 h ILE 71 Ca -0.03 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.81 2b76 h ILE 71 Cb 0.45 0.06 -0.00 0.00 -0.74 0.00 0.00 36.82 36.58 2b76 h ILE 71 CO 0.06 0.00 -0.09 0.78 0.00 0.00 0.00 178.15 178.90 2b76 h ASN 72 N -0.01 0.00 0.20 1.72 -0.26 -1.08 -1.72 115.58 114.42 2b76 h ASN 72 Ca 0.41 0.00 -0.01 0.00 -0.56 0.00 0.00 56.30 56.14 2b76 h ASN 72 Cb 0.65 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.92 2b76 h ASN 72 CO -0.95 0.09 -0.10 -0.07 -1.06 0.00 0.00 177.43 175.34 2b76 h LEU 73 N 0.00 -0.23 -1.00 1.61 3.38 -0.17 -2.38 115.31 116.51 2b76 h LEU 73 Ca -0.00 -0.30 0.38 0.00 0.09 0.00 0.00 57.88 58.05 2b76 h LEU 73 Cb 0.50 0.06 -0.17 0.00 0.09 0.00 0.00 40.66 41.14 2b76 h LEU 73 CO 0.01 0.25 0.55 0.40 0.09 0.00 0.00 178.44 179.75 2b76 h ILE 74 N -0.80 0.13 -0.49 1.22 2.04 -1.14 1.02 117.51 119.49 2b76 h ILE 74 Ca -0.03 -0.05 -0.10 0.00 1.00 0.00 0.00 64.86 65.68 2b76 h ILE 74 Cb 0.51 -0.02 -0.02 0.00 -0.74 0.00 0.00 36.82 36.55 2b76 h ILE 74 CO 0.05 0.03 -0.10 0.74 0.00 0.00 0.00 178.15 178.87 2b76 h THR 75 N 0.15 1.27 -0.64 -0.27 2.02 -1.15 -1.72 112.91 112.58 2b76 h THR 75 Ca 0.80 -1.23 0.02 0.00 0.77 0.00 0.00 66.41 66.77 2b76 h THR 75 Cb 1.99 1.05 -0.04 0.00 -1.74 0.00 0.00 68.15 69.42 2b76 h THR 75 CO -0.70 0.43 0.41 0.25 0.37 0.00 0.00 175.52 176.28 2b76 h LEU 76 N 0.79 0.69 -0.41 2.58 5.85 0.15 -1.60 115.31 123.36 2b76 h LEU 76 Ca 0.13 -0.01 0.04 0.00 0.84 0.00 0.00 57.88 58.88 2b76 h LEU 76 Cb 0.65 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.48 2b76 h LEU 76 CO 0.04 0.49 0.19 0.00 -0.34 0.00 0.00 178.44 178.82 2b76 h ALA 77 N 1.25 0.50 0.24 1.25 0.00 -0.69 0.80 119.26 122.61 2b76 h ALA 77 Ca 0.24 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.17 2b76 h ALA 77 Cb -0.04 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2b76 h ALA 77 CO -0.08 -0.18 -0.25 0.00 0.00 0.00 0.00 179.25 178.74 2b76 h ALA 78 N 1.23 -0.94 -0.74 0.00 0.00 -0.76 0.67 119.26 118.71 2b76 h ALA 78 Ca 0.18 -0.09 0.14 0.00 0.00 0.00 0.00 54.91 55.13 2b76 h ALA 78 Cb 0.11 0.51 -0.14 0.00 0.00 0.00 0.00 17.79 18.27 2b76 h ALA 78 CO -0.14 -0.96 -0.28 0.00 0.00 0.00 0.00 179.25 177.87 2b76 h ALA 79 N -1.31 0.25 -0.21 0.00 0.00 -1.09 0.39 119.26 117.28 2b76 h ALA 79 Ca -0.03 0.25 0.06 0.00 0.00 0.00 0.00 54.91 55.18 2b76 h ALA 79 Cb 0.43 0.73 -0.07 0.00 0.00 0.00 0.00 17.79 18.88 2b76 h ALA 79 CO -0.04 -0.54 -0.30 -0.07 0.00 0.00 0.00 179.25 178.30 2b76 h LEU 80 N -0.06 -0.95 0.11 0.00 3.38 -0.32 0.73 115.31 118.20 2b76 h LEU 80 Ca 0.32 0.15 0.02 0.00 0.09 0.00 0.00 57.88 58.46 2b76 h LEU 80 Cb 0.57 0.42 -0.05 0.00 0.09 0.00 0.00 40.66 41.69 2b76 h LEU 80 CO -0.79 -0.33 -0.48 0.25 0.09 0.00 0.00 178.44 177.18 2b76 h LEU 81 N -0.33 -1.44 -0.79 1.67 5.85 0.20 -0.44 115.31 120.03 2b76 h LEU 81 Ca 0.12 0.16 0.19 0.00 0.84 0.00 0.00 57.88 59.18 2b76 h LEU 81 Cb 0.52 0.54 -0.13 0.00 0.37 0.00 0.00 40.66 41.96 2b76 h LEU 81 CO -0.39 -0.53 0.09 -0.74 -0.34 0.00 0.00 178.44 176.53 2b76 h HIS 82 N -0.70 0.11 -0.43 1.25 2.76 -0.08 0.49 115.15 118.54 2b76 h HIS 82 Ca 0.01 0.05 0.04 0.00 -2.20 0.00 0.00 60.37 58.27 2b76 h HIS 82 Cb 0.73 0.08 -0.04 0.00 1.55 0.00 0.00 27.41 29.72 2b76 h HIS 82 CO -0.42 -0.21 0.20 1.15 -1.30 0.00 0.00 177.93 177.35 2b76 h THR 83 N 0.16 0.94 0.64 6.26 2.02 0.19 0.11 112.91 123.22 2b76 h THR 83 Ca 0.45 -0.14 -0.03 0.00 0.77 0.00 0.00 66.41 67.47 2b76 h THR 83 Cb 0.83 0.51 -0.01 0.00 -1.74 0.00 0.00 68.15 67.74 2b76 h THR 83 CO -0.64 0.07 -0.42 0.50 0.37 0.00 0.00 175.52 175.40 2b76 h LYS 84 N 0.40 -0.97 0.01 6.66 3.64 0.14 -2.52 116.57 123.94 2b76 h LYS 84 Ca 0.19 0.07 0.02 0.00 -1.27 0.00 0.00 60.65 59.65 2b76 h LYS 84 Cb 0.12 0.22 -0.03 0.00 -0.41 0.00 0.00 32.23 32.13 2b76 h LYS 84 CO -0.15 -0.64 -0.13 1.79 -2.27 0.00 0.00 179.45 178.05 2b76 h THR 85 N -1.00 0.69 -0.57 1.00 1.35 -0.91 -2.87 112.91 110.60 2b76 h THR 85 Ca -0.08 0.00 0.11 0.00 -0.55 0.00 0.00 66.41 65.89 2b76 h THR 85 Cb 0.81 0.69 -0.11 0.00 -1.73 0.00 0.00 68.15 67.82 2b76 h THR 85 CO 0.07 0.00 -0.12 -0.25 -0.25 0.00 0.00 175.52 174.97 2b76 h TRP 86 N -0.22 -0.26 -0.59 4.73 2.91 -0.79 0.05 115.95 121.79 2b76 h TRP 86 Ca 0.04 0.05 0.03 0.00 1.13 0.00 0.00 58.89 60.14 2b76 h TRP 86 Cb 0.27 0.20 -0.03 0.00 -0.51 0.00 0.00 29.16 29.09 2b76 h TRP 86 CO -0.18 -0.23 0.39 0.74 -1.03 0.00 0.00 178.44 178.13 2b76 h PHE 87 N 0.02 0.67 0.00 2.65 0.05 -1.23 -0.65 116.94 118.45 2b76 h PHE 87 Ca 0.28 0.02 -0.01 0.00 3.82 0.00 0.00 57.97 62.08 2b76 h PHE 87 Cb 0.43 -0.23 -0.00 0.00 2.00 0.00 0.00 35.95 38.15 2b76 h PHE 87 CO -0.45 0.40 -0.03 0.93 -0.18 0.00 0.00 178.31 178.98 2b76 h GLU 88 N 0.70 0.00 0.03 1.51 5.08 -0.88 -3.34 114.58 117.69 2b76 h GLU 88 Ca 0.23 0.00 -0.39 0.00 -1.00 0.00 0.00 59.36 58.20 2b76 h GLU 88 Cb 0.06 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.25 2b76 h GLU 88 CO -0.06 0.03 -2.32 1.28 -1.00 0.00 0.00 179.01 176.93 2b76 n LEU 89 N -3.18 2.69 -0.20 1.33 4.77 -0.30 -4.46 117.00 117.64 2b76 n LEU 89 Ca -0.01 0.04 -0.02 0.00 -0.03 0.00 0.00 56.01 55.99 2b76 n LEU 89 Cb 0.22 -0.94 0.05 0.00 -2.33 0.00 0.00 43.42 40.42 2b76 n LEU 89 CO 0.25 0.83 0.71 0.00 -1.33 0.00 0.00 177.39 177.86 2b76 h ALA 90 N -0.17 0.30 -0.84 -1.18 0.00 -1.54 -0.53 119.26 115.29 2b76 h ALA 90 Ca -0.56 0.22 0.21 0.00 0.00 0.00 0.00 54.91 54.79 2b76 h ALA 90 Cb 1.85 0.55 -0.14 0.00 0.00 0.00 0.00 17.79 20.05 2b76 h ALA 90 CO -0.11 -0.49 0.17 -1.00 0.00 0.00 0.00 179.25 177.81 2b76 h PRO 91 N -0.05 0.17 0.00 0.00 0.13 -1.80 -1.41 132.00 129.05 2b76 h PRO 91 Ca 0.28 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.40 2b76 h PRO 91 Cb 0.49 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 31.58 2b76 h PRO 91 CO -0.65 0.12 0.00 1.17 -0.23 0.00 0.00 178.00 178.41 2b76 n LYS 92 N -5.26 0.00 -0.35 0.86 3.00 -0.21 -0.41 118.16 115.79 2b76 n LYS 92 Ca 0.19 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.50 2b76 n LYS 92 Cb 0.62 -0.95 0.00 0.00 0.00 0.00 0.00 35.03 34.69 2b76 n LYS 92 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2b76 n ALA 93 N 0.35 1.70 -3.52 3.14 0.00 -0.53 -5.01 120.51 116.64 2b76 n ALA 93 Ca 0.00 -0.57 -0.33 0.00 0.00 0.00 0.00 53.44 52.54 2b76 n ALA 93 Cb 0.00 -0.24 -0.15 0.00 0.00 0.00 0.00 19.45 19.06 2b76 n ALA 93 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2b76 s ALA 94 N 0.00 2.46 -0.77 0.00 0.00 0.46 -5.05 121.76 118.86 2b76 s ALA 94 Ca 0.00 -1.07 0.03 0.00 0.00 0.00 0.00 51.96 50.92 2b76 s ALA 94 Cb 0.00 -1.20 0.28 0.00 0.00 0.00 0.00 23.12 22.20 2b76 s ALA 94 CO 0.00 -0.06 1.01 -1.71 0.00 0.00 0.00 175.76 175.00 2b76 n ASN 95 N 4.11 4.71 -4.84 0.00 4.05 -1.26 -4.99 115.26 117.04 2b76 n ASN 95 Ca -0.19 -3.48 -0.33 0.00 0.45 0.00 0.00 54.58 51.03 2b76 n ASN 95 Cb 0.52 -0.84 -0.07 0.00 1.23 0.00 0.00 39.78 40.62 2b76 n ASN 95 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 2b76 s ILE 96 N -2.86 4.55 -0.18 -1.44 1.01 -1.26 -5.02 121.20 116.00 2b76 s ILE 96 Ca 0.39 1.19 -0.01 0.00 0.00 0.00 0.00 60.65 62.21 2b76 s ILE 96 Cb 0.14 -3.61 0.05 0.00 0.01 0.00 0.00 42.46 39.05 2b76 s ILE 96 CO 0.00 -0.25 -0.04 -0.63 0.00 0.00 0.00 174.94 174.03 2b76 s ILE 97 N -2.07 1.11 0.20 2.92 1.01 -1.26 -2.26 121.20 120.85 2b76 s ILE 97 Ca 0.58 -0.73 0.10 0.00 0.00 0.00 0.00 60.65 60.60 2b76 s ILE 97 Cb -0.10 -1.35 -0.04 0.00 0.01 0.00 0.00 42.46 40.98 2b76 s ILE 97 CO 0.15 0.04 -0.15 0.68 0.00 0.00 0.00 174.94 175.66 2b76 s VAL 98 N 1.62 2.82 0.00 2.92 -7.23 -0.99 -4.94 120.40 114.61 2b76 s VAL 98 Ca -0.01 -1.89 0.00 0.00 -1.81 0.00 0.00 61.98 58.27 2b76 s VAL 98 Cb -0.16 -2.40 0.00 0.00 0.56 0.00 0.00 36.38 34.38 2b76 s VAL 98 CO -0.07 -0.16 0.00 0.29 -0.31 0.00 0.00 175.10 174.85 2b76 n LYS 99 N -0.00 0.00 -0.18 4.82 5.02 -1.26 -1.32 118.16 125.24 2b76 n LYS 99 Ca -0.11 0.00 0.07 0.00 -2.02 0.00 0.00 58.31 56.25 2b76 n LYS 99 Cb 0.56 0.00 0.09 0.00 -0.02 0.00 0.00 35.03 35.66 2b76 n LYS 99 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2b76 n ASP 100 N 5.18 1.65 -4.94 4.39 9.92 -1.26 -5.03 116.55 126.45 2b76 n ASP 100 Ca 0.00 -2.69 -0.20 0.00 -0.53 0.00 0.00 54.79 51.37 2b76 n ASP 100 Cb 0.00 -0.34 -0.02 0.00 -0.64 0.00 0.00 41.12 40.13 2b76 n ASP 100 CO 0.00 0.00 0.00 -1.61 0.13 0.00 0.00 177.20 175.72 2b76 s GLU 101 N -1.94 3.07 -0.50 -1.24 2.02 -0.44 -5.09 118.70 114.58 2b76 s GLU 101 Ca 0.21 -1.03 -0.17 0.00 0.02 0.00 0.00 54.97 53.99 2b76 s GLU 101 Cb 0.18 -2.74 0.07 0.00 0.10 0.00 0.00 34.13 31.75 2b76 s GLU 101 CO 0.02 0.16 0.52 0.21 0.02 0.00 0.00 175.26 176.19 2b76 s LYS 102 N -4.08 3.04 0.56 1.61 2.47 -1.26 -2.34 119.74 119.74 2b76 s LYS 102 Ca 0.41 -1.20 -0.19 0.00 -1.56 0.00 0.00 55.97 53.43 2b76 s LYS 102 Cb -0.08 -4.15 -0.08 0.00 -1.46 0.00 0.00 37.83 32.06 2b76 s LYS 102 CO 0.29 -1.18 0.69 -0.12 0.16 0.00 0.00 175.35 175.19 2b76 n MET 103 N 5.68 0.68 -3.32 4.03 0.00 -0.96 -5.00 117.12 118.24 2b76 n MET 103 Ca -0.10 0.26 -0.22 0.00 -0.00 0.00 0.00 57.70 57.64 2b76 n MET 103 Cb 0.44 -1.85 0.05 0.00 0.00 0.00 0.00 33.22 31.86 2b76 n MET 103 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 2b76 s GLY 104 N -1.15 1.92 -0.01 -5.12 0.00 -1.26 -4.84 107.32 96.86 2b76 s GLY 104 Ca 0.70 -1.87 -0.22 0.00 0.00 0.00 0.00 44.72 43.32 2b76 s GLY 104 CO 0.53 -1.80 1.00 -0.56 0.00 0.00 0.00 173.10 172.27 2b76 h PRO 105 N 0.29 -0.52 -0.17 2.90 0.13 -1.97 -3.37 132.00 129.30 2b76 h PRO 105 Ca -0.31 0.04 0.03 0.00 -0.87 0.00 0.00 66.00 64.89 2b76 h PRO 105 Cb 1.30 0.12 -0.03 0.00 0.13 0.00 0.00 31.00 32.51 2b76 h PRO 105 CO 0.45 -0.22 -0.04 0.39 -0.23 0.00 0.00 178.00 178.35 2b76 n GLU 106 N -5.16 -0.02 0.02 0.86 1.02 -1.26 -0.62 120.64 115.48 2b76 n GLU 106 Ca -0.09 0.27 -0.15 0.00 -0.02 0.00 0.00 57.16 57.16 2b76 n GLU 106 Cb 0.28 -0.40 -0.05 0.00 -0.02 0.00 0.00 31.44 31.25 2b76 n GLU 106 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 2b76 h PRO 107 N 0.00 0.61 0.62 3.49 0.13 -2.02 -3.03 132.00 131.81 2b76 h PRO 107 Ca 0.08 -0.55 -0.03 0.00 -0.87 0.00 0.00 66.00 64.63 2b76 h PRO 107 Cb 0.13 0.13 0.01 0.00 0.13 0.00 0.00 31.00 31.40 2b76 h PRO 107 CO -0.18 1.17 -0.30 0.82 -0.23 0.00 0.00 178.00 179.29 2b76 h ILE 108 N 0.40 0.37 -1.12 -3.56 2.04 -1.09 -2.55 117.51 111.99 2b76 h ILE 108 Ca -0.07 -0.09 0.34 0.00 1.00 0.00 0.00 64.86 66.04 2b76 h ILE 108 Cb 1.46 0.40 -0.13 0.00 -0.74 0.00 0.00 36.82 37.82 2b76 h ILE 108 CO 0.16 0.01 0.70 0.40 0.00 0.00 0.00 178.15 179.42 2b76 h ILE 109 N -0.90 0.30 -0.08 -0.67 2.04 -1.66 0.45 117.51 116.99 2b76 h ILE 109 Ca -0.09 -0.09 0.04 0.00 1.00 0.00 0.00 64.86 65.72 2b76 h ILE 109 Cb 0.66 0.02 -0.05 0.00 -0.74 0.00 0.00 36.82 36.71 2b76 h ILE 109 CO 0.14 0.05 -0.20 0.50 0.00 0.00 0.00 178.15 178.64 2b76 h LYS 110 N 0.26 -0.27 0.00 2.37 3.64 -1.32 -2.51 116.57 118.75 2b76 h LYS 110 Ca 0.72 0.02 -0.19 0.00 -1.27 0.00 0.00 60.65 59.93 2b76 h LYS 110 Cb 1.94 0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 33.79 2b76 h LYS 110 CO -0.45 -0.18 -0.90 1.03 -2.27 0.00 0.00 179.45 176.68 2b76 h SER 111 N -0.28 0.00 0.01 4.20 0.87 -0.11 -1.60 113.55 116.65 2b76 h SER 111 Ca 0.08 -0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.64 2b76 h SER 111 Cb 0.40 -0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.36 2b76 h SER 111 CO -0.24 0.90 -0.00 -0.07 -0.53 0.00 0.00 176.83 176.89 2b76 h LEU 112 N 0.00 0.00 0.14 2.23 3.38 -1.24 0.36 115.31 120.17 2b76 h LEU 112 Ca -0.01 0.00 -0.29 0.00 0.09 0.00 0.00 57.88 57.67 2b76 h LEU 112 Cb 1.60 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.35 2b76 h LEU 112 CO 0.12 0.00 -1.48 -0.50 0.09 0.00 0.00 178.44 176.67 2b76 h TRP 113 N 0.00 0.53 -0.29 1.13 4.06 -1.26 -3.17 115.95 116.95 2b76 h TRP 113 Ca -0.00 -0.39 0.07 0.00 2.06 0.00 0.00 58.89 60.63 2b76 h TRP 113 Cb 0.01 -0.02 -0.08 0.00 -1.00 0.00 0.00 29.16 28.07 2b76 h TRP 113 CO 0.00 1.58 -0.29 0.00 -3.56 0.00 0.00 178.44 176.17 2b76 h ALA 114 N 0.00 -0.18 -0.90 1.49 0.00 -0.27 0.16 119.26 119.56 2b76 h ALA 114 Ca -0.31 0.08 0.07 0.00 0.00 0.00 0.00 54.91 54.75 2b76 h ALA 114 Cb 1.85 0.60 -0.06 0.00 0.00 0.00 0.00 17.79 20.18 2b76 h ALA 114 CO 0.10 -0.71 0.57 0.28 0.00 0.00 0.00 179.25 179.49 2b76 h VAL 115 N -0.27 1.05 -0.28 0.00 2.07 -0.47 -0.60 116.25 117.75 2b76 h VAL 115 Ca 0.15 -0.35 -0.02 0.00 0.82 0.00 0.00 66.70 67.29 2b76 h VAL 115 Cb 0.51 -0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.20 2b76 h VAL 115 CO -0.44 0.19 0.08 0.74 0.02 0.00 0.00 177.57 178.16 2b76 h THR 116 N 1.03 1.20 -0.79 2.57 2.02 -1.15 -0.64 112.91 117.15 2b76 h THR 116 Ca 0.40 -0.66 -0.03 0.00 0.77 0.00 0.00 66.41 66.88 2b76 h THR 116 Cb 0.18 1.11 -0.04 0.00 -1.74 0.00 0.00 68.15 67.66 2b76 h THR 116 CO -0.18 0.22 0.36 1.62 0.37 0.00 0.00 175.52 177.91 2b76 h VAL 117 N 0.29 1.25 0.86 3.16 3.04 -0.21 0.93 116.25 125.57 2b76 h VAL 117 Ca 0.09 -0.73 -0.04 0.00 -1.01 0.00 0.00 66.70 65.01 2b76 h VAL 117 Cb 0.26 0.26 0.01 0.00 -2.01 0.00 0.00 31.29 29.80 2b76 h VAL 117 CO -0.00 0.31 -0.42 0.58 -1.01 0.00 0.00 177.57 177.03 2b76 h VAL 118 N 1.13 0.00 -0.44 1.51 2.07 -0.97 -2.68 116.25 116.87 2b76 h VAL 118 Ca 0.27 -0.01 0.08 0.00 0.82 0.00 0.00 66.70 67.85 2b76 h VAL 118 Cb 0.14 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 29.85 2b76 h VAL 118 CO -0.03 0.00 0.06 0.00 0.02 0.00 0.00 177.57 177.62 2b76 h ALA 119 N -1.45 0.46 -1.03 1.67 0.00 -1.02 0.04 119.26 117.94 2b76 h ALA 119 Ca -0.12 0.10 0.28 0.00 0.00 0.00 0.00 54.91 55.18 2b76 h ALA 119 Cb 0.89 0.16 -0.13 0.00 0.00 0.00 0.00 17.79 18.71 2b76 h ALA 119 CO 0.19 -0.34 0.62 1.15 0.00 0.00 0.00 179.25 180.87 2b76 h THR 120 N 0.18 0.45 0.00 0.00 2.02 -0.78 0.31 112.91 115.09 2b76 h THR 120 Ca 0.22 -0.16 0.00 0.00 0.77 0.00 0.00 66.41 67.24 2b76 h THR 120 Cb 0.29 -0.04 0.00 0.00 -1.74 0.00 0.00 68.15 66.66 2b76 h THR 120 CO -0.31 0.08 0.00 -0.38 0.37 0.00 0.00 175.52 175.28 2b76 n ILE 121 N -4.87 0.00 -0.66 3.11 5.41 -0.15 -2.04 119.36 120.15 2b76 n ILE 121 Ca 0.28 0.87 0.50 0.00 1.00 0.00 0.00 62.75 65.40 2b76 n ILE 121 Cb 0.87 -1.80 0.77 0.00 -0.71 0.00 0.00 39.64 38.77 2b76 n ILE 121 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07 2b76 n VAL 122 N -1.82 -0.01 0.04 1.39 0.31 -0.32 0.15 118.33 118.08 2b76 n VAL 122 Ca 0.00 1.41 -0.22 0.00 -0.01 0.00 0.00 64.34 65.52 2b76 n VAL 122 Cb 0.00 -2.35 -0.14 0.00 -0.91 0.00 0.00 33.84 30.43 2b76 n VAL 122 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 2b76 h ILE 123 N 0.00 0.91 0.00 2.52 1.08 -0.49 -3.01 117.51 118.52 2b76 h ILE 123 Ca 0.89 -2.45 -0.01 0.00 -0.39 0.00 0.00 64.86 62.90 2b76 h ILE 123 Cb 3.53 2.70 -0.00 0.00 -3.07 0.00 0.00 36.82 39.98 2b76 h ILE 123 CO -0.02 0.82 -0.04 -0.07 -0.69 0.00 0.00 178.15 178.14 2b76 h LEU 124 N -0.02 0.00 0.00 1.44 3.38 0.20 0.35 115.31 120.66 2b76 h LEU 124 Ca -0.35 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.52 2b76 h LEU 124 Cb 1.99 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 42.72 2b76 h LEU 124 CO 0.13 0.04 -0.65 0.15 0.09 0.00 0.00 178.44 178.20 2b76 h PHE 125 N 0.00 0.00 0.50 1.13 3.57 -1.37 -2.00 116.94 118.77 2b76 h PHE 125 Ca -0.00 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.47 2b76 h PHE 125 Cb 0.09 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.83 2b76 h PHE 125 CO 0.00 0.43 -0.24 0.28 -2.23 0.00 0.00 178.31 176.55 2b76 h VAL 126 N 0.00 0.18 -0.43 1.41 2.07 -0.83 -2.87 116.25 115.79 2b76 h VAL 126 Ca -0.03 -0.51 0.04 0.00 0.82 0.00 0.00 66.70 67.02 2b76 h VAL 126 Cb 1.36 0.28 -0.02 0.00 -1.52 0.00 0.00 31.29 31.38 2b76 h VAL 126 CO 0.05 0.04 0.28 0.00 0.02 0.00 0.00 177.57 177.96 2b76 h ALA 127 N -0.97 1.85 0.00 1.67 0.00 -1.37 -3.32 119.26 117.12 2b76 h ALA 127 Ca -0.07 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.75 2b76 h ALA 127 Cb 0.58 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.24 2b76 h ALA 127 CO 0.11 0.09 -1.71 1.28 0.00 0.00 0.00 179.25 179.02 2b76 n LEU 128 N -4.48 0.00 -0.07 0.00 4.77 -0.75 -4.84 117.00 111.63 2b76 n LEU 128 Ca 0.05 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 55.93 2b76 n LEU 128 Cb 0.17 0.09 -0.07 0.00 -2.33 0.00 0.00 43.42 41.29 2b76 n LEU 128 CO 0.35 0.09 -0.97 -1.22 -1.33 0.00 0.00 177.39 174.32 2b76 n TYR 129 N -2.13 0.00 0.00 -1.77 4.01 -1.09 -5.05 117.16 111.13 2b76 n TYR 129 Ca -0.08 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.66 2b76 n TYR 129 Cb 0.53 -0.55 0.00 0.00 -0.31 0.00 0.00 39.34 39.01 2b76 n TYR 129 CO 0.00 0.00 0.00 0.91 -0.46 0.00 0.00 176.86 177.31