#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 2.06 -1.31 12.58 -4.23 -1.26 -4.97 115.64 118.52 2b76 s THR 2 Ca 0.00 -1.86 0.18 0.00 -1.18 0.00 0.00 61.69 58.83 2b76 s THR 2 Cb 0.00 -2.93 0.61 0.00 1.34 0.00 0.00 72.50 71.52 2b76 s THR 2 CO 0.00 0.00 1.52 0.29 -0.54 0.00 0.00 174.62 175.89 2b76 n LYS 3 N -1.12 3.19 -3.82 3.99 5.02 -1.26 -4.93 118.16 119.23 2b76 n LYS 3 Ca -0.04 -2.66 -0.32 0.00 -2.02 0.00 0.00 58.31 53.27 2b76 n LYS 3 Cb 0.66 -1.67 -0.04 0.00 -0.02 0.00 0.00 35.03 33.96 2b76 n LYS 3 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 2b76 s ARG 4 N -1.47 3.51 -0.42 1.97 1.70 -1.26 -5.06 118.95 117.92 2b76 s ARG 4 Ca 0.45 -0.28 0.05 0.00 -0.47 0.00 0.00 55.73 55.48 2b76 s ARG 4 Cb 0.27 -2.98 0.19 0.00 -0.57 0.00 0.00 34.95 31.85 2b76 s ARG 4 CO 0.25 0.57 0.44 1.17 -1.08 0.00 0.00 175.30 176.65 2b76 n LYS 5 N 0.34 0.34 -1.63 3.89 4.81 -1.26 -5.09 118.16 119.55 2b76 n LYS 5 Ca -0.05 -2.98 -0.25 0.00 -0.87 0.00 0.00 58.31 54.16 2b76 n LYS 5 Cb 0.51 -1.56 -0.05 0.00 0.02 0.00 0.00 35.03 33.96 2b76 n LYS 5 CO 0.00 0.00 0.00 -2.14 1.17 0.00 0.00 177.40 176.43 2b76 s PRO 6 N -0.03 1.93 -0.05 1.64 0.02 -1.26 -4.94 135.00 132.31 2b76 s PRO 6 Ca 0.33 0.79 -0.30 0.00 0.02 0.00 0.00 61.00 61.84 2b76 s PRO 6 Cb 0.06 -4.70 -0.03 0.00 0.02 0.00 0.00 34.50 29.84 2b76 s PRO 6 CO -0.17 -3.81 1.23 -0.47 -0.33 0.00 0.00 177.00 173.45 2b76 s TYR 7 N 13.08 3.14 -0.17 6.54 5.04 -1.26 -5.04 117.35 138.68 2b76 s TYR 7 Ca 0.91 1.16 -0.05 0.00 -2.44 0.00 0.00 57.07 56.65 2b76 s TYR 7 Cb -0.14 -3.45 -0.03 0.00 0.35 0.00 0.00 41.96 38.69 2b76 s TYR 7 CO 0.15 -1.47 -0.01 0.08 -1.34 0.00 0.00 175.55 172.96 2b76 s VAL 8 N 2.28 4.05 0.58 3.14 1.01 -1.26 -5.11 120.40 125.08 2b76 s VAL 8 Ca 0.57 -0.30 -0.09 0.00 0.00 0.00 0.00 61.98 62.16 2b76 s VAL 8 Cb -0.25 -2.80 -0.03 0.00 0.00 0.00 0.00 36.38 33.30 2b76 s VAL 8 CO 0.22 0.47 0.95 -0.13 0.00 0.00 0.00 175.10 176.61 2b76 s ARG 9 N 0.55 3.47 0.25 2.72 3.00 -1.26 -5.05 118.95 122.64 2b76 s ARG 9 Ca -0.01 0.50 -0.29 0.00 0.00 0.00 0.00 55.73 55.93 2b76 s ARG 9 Cb -0.14 -2.18 -0.09 0.00 0.00 0.00 0.00 34.95 32.54 2b76 s ARG 9 CO 0.02 -0.50 0.93 -2.14 0.00 0.00 0.00 175.30 173.61 2b76 s PRO 10 N -5.04 4.77 -0.53 3.54 0.02 -1.26 -5.02 135.00 131.48 2b76 s PRO 10 Ca 0.53 1.43 0.04 0.00 0.02 0.00 0.00 61.00 63.01 2b76 s PRO 10 Cb -0.11 -3.17 0.13 0.00 0.02 0.00 0.00 34.50 31.38 2b76 s PRO 10 CO 0.50 0.47 0.27 1.41 -0.33 0.00 0.00 177.00 179.32 2b76 s MET 11 N -1.38 1.99 1.17 5.54 1.75 -1.26 -5.10 119.30 122.01 2b76 s MET 11 Ca 0.43 -2.65 -0.19 0.00 -1.25 0.00 0.00 55.69 52.02 2b76 s MET 11 Cb -0.24 -3.32 0.30 0.00 2.84 0.00 0.00 34.83 34.41 2b76 s MET 11 CO 0.30 -1.12 0.76 2.41 -0.65 0.00 0.00 175.02 176.72 2b76 n THR 12 N 3.06 0.00 0.07 10.11 -1.04 -1.26 -4.95 114.28 120.28 2b76 n THR 12 Ca 0.06 -0.09 0.06 0.00 -2.04 0.00 0.00 64.05 62.04 2b76 n THR 12 Cb 0.32 -0.90 -0.04 0.00 -1.82 0.00 0.00 70.33 67.90 2b76 n THR 12 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 2b76 h SER 13 N -3.15 0.00 0.00 8.00 0.02 -2.06 -3.17 113.55 113.20 2b76 h SER 13 Ca -0.33 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.62 2b76 h SER 13 Cb 1.08 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.62 2b76 h SER 13 CO 0.20 0.26 0.00 0.35 -1.14 0.00 0.00 176.83 176.50 2b76 n THR 14 N -2.78 0.00 -0.17 -2.27 -2.24 -1.26 -4.23 114.28 101.33 2b76 n THR 14 Ca -0.04 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.62 2b76 n THR 14 Cb 0.68 -0.63 -0.09 0.00 -2.10 0.00 0.00 70.33 68.19 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 0.00 -1.56 -0.17 4.78 5.08 -1.91 -1.09 115.95 121.08 2b76 h TRP 15 Ca 0.00 0.08 0.05 0.00 1.08 0.00 0.00 58.89 60.10 2b76 h TRP 15 Cb 0.00 0.74 -0.01 0.00 -3.00 0.00 0.00 29.16 26.89 2b76 h TRP 15 CO 0.00 -0.42 0.18 0.11 -1.28 0.00 0.00 178.44 177.03 2b76 h TRP 16 N -0.30 0.00 0.00 0.12 5.08 -1.88 -1.56 115.95 117.41 2b76 h TRP 16 Ca 0.08 0.00 -0.01 0.00 1.08 0.00 0.00 58.89 60.04 2b76 h TRP 16 Cb 0.50 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 26.66 2b76 h TRP 16 CO -0.77 0.00 -0.06 -0.22 -1.28 0.00 0.00 178.44 176.11 2b76 h LYS 17 N 0.00 0.00 0.00 0.12 3.64 -1.47 -3.05 116.57 115.81 2b76 h LYS 17 Ca 0.08 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 2b76 h LYS 17 Cb 0.45 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.27 2b76 h LYS 17 CO -0.00 0.06 0.00 1.63 -2.27 0.00 0.00 179.45 178.87 2b76 n LYS 18 N -3.26 0.00 -2.14 1.90 4.76 -0.59 -4.84 118.16 113.98 2b76 n LYS 18 Ca -0.01 0.28 -0.41 0.00 -2.87 0.00 0.00 58.31 55.30 2b76 n LYS 18 Cb 0.26 -0.99 -0.03 0.00 -1.84 0.00 0.00 35.03 32.43 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 -2.66 4.41 0.00 -0.35 1.02 -1.26 -4.92 118.68 114.92 2b76 s LEU 19 Ca 0.00 2.51 0.07 0.00 0.02 0.00 0.00 54.13 56.73 2b76 s LEU 19 Cb 0.00 -3.62 0.42 0.00 0.02 0.00 0.00 46.19 43.01 2b76 s LEU 19 CO 0.00 -0.58 0.84 -0.81 0.02 0.00 0.00 176.35 175.82 2b76 n PRO 20 N 2.42 0.43 -0.06 1.29 -0.04 -1.26 -1.40 135.00 136.38 2b76 n PRO 20 Ca 0.06 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.49 2b76 n PRO 20 Cb 0.42 -1.26 -0.12 0.00 -0.04 0.00 0.00 33.50 32.50 2b76 n PRO 20 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 2b76 n PHE 21 N -0.76 0.00 0.08 0.54 -0.00 -1.26 -3.77 117.46 112.29 2b76 n PHE 21 Ca 0.05 0.00 -0.21 0.00 -0.00 0.00 0.00 57.45 57.29 2b76 n PHE 21 Cb 0.02 -0.64 -0.15 0.00 -0.00 0.00 0.00 39.48 38.72 2b76 n PHE 21 CO 0.00 0.00 0.00 1.88 -0.00 0.00 0.00 176.76 178.64 2b76 h TYR 22 N 0.00 0.71 -0.55 -5.13 0.99 -1.47 -2.58 116.97 108.94 2b76 h TYR 22 Ca -0.30 -0.50 0.09 0.00 2.00 0.00 0.00 58.73 60.02 2b76 h TYR 22 Cb 1.61 -0.03 -0.10 0.00 1.00 0.00 0.00 36.73 39.20 2b76 h TYR 22 CO 0.00 1.38 -0.41 0.00 -0.00 0.00 0.00 178.16 179.13 2b76 h ARG 23 N -0.17 -0.22 0.00 4.88 3.08 -1.19 0.26 114.38 121.02 2b76 h ARG 23 Ca -0.17 0.02 -0.02 0.00 0.07 0.00 0.00 59.98 59.87 2b76 h ARG 23 Cb 1.78 0.05 -0.00 0.00 0.08 0.00 0.00 29.97 31.88 2b76 h ARG 23 CO 0.19 -0.15 -0.09 0.35 -1.07 0.00 0.00 179.97 179.20 2b76 h PHE 24 N -0.23 0.00 -0.16 3.04 3.57 -1.65 -1.65 116.94 119.86 2b76 h PHE 24 Ca 0.18 0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.62 2b76 h PHE 24 Cb 0.56 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.30 2b76 h PHE 24 CO -0.68 0.09 -0.15 -0.92 -2.23 0.00 0.00 178.31 174.43 2b76 h TYR 25 N 0.00 0.45 -0.80 0.41 3.20 -0.17 -2.54 116.97 117.52 2b76 h TYR 25 Ca -0.00 -0.13 -0.03 0.00 3.14 0.00 0.00 58.73 61.71 2b76 h TYR 25 Cb 0.18 -0.10 -0.04 0.00 1.54 0.00 0.00 36.73 38.32 2b76 h TYR 25 CO 0.00 0.75 0.38 0.52 -1.64 0.00 0.00 178.16 178.17 2b76 h MET 26 N 0.02 1.14 0.09 1.82 2.86 -0.25 -2.80 114.93 117.82 2b76 h MET 26 Ca 0.03 -0.16 -0.00 0.00 -2.06 0.00 0.00 59.70 57.50 2b76 h MET 26 Cb 0.67 -0.21 -0.01 0.00 0.06 0.00 0.00 31.60 32.12 2b76 h MET 26 CO 0.04 0.88 -0.11 1.25 1.06 0.00 0.00 176.91 180.02 2b76 h LEU 27 N 1.13 -0.30 -1.41 1.22 5.85 -1.07 0.14 115.31 120.87 2b76 h LEU 27 Ca 0.27 0.03 0.46 0.00 0.84 0.00 0.00 57.88 59.48 2b76 h LEU 27 Cb 0.11 0.10 -0.11 0.00 0.37 0.00 0.00 40.66 41.13 2b76 h LEU 27 CO -0.03 -0.14 0.95 -1.14 -0.34 0.00 0.00 178.44 177.74 2b76 n ARG 28 N -2.96 -0.02 0.11 1.25 0.63 -0.98 0.16 116.66 114.84 2b76 n ARG 28 Ca -0.02 1.08 -0.18 0.00 -0.92 0.00 0.00 57.85 57.81 2b76 n ARG 28 Cb 0.10 -2.24 -0.14 0.00 0.45 0.00 0.00 32.46 30.62 2b76 n ARG 28 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 2b76 h GLU 29 N 0.00 0.32 -0.33 -0.14 4.39 -0.70 -2.90 114.58 115.22 2b76 h GLU 29 Ca 0.81 -0.55 0.07 0.00 0.34 0.00 0.00 59.36 60.03 2b76 h GLU 29 Cb 2.82 0.21 -0.02 0.00 -0.10 0.00 0.00 28.75 31.66 2b76 h GLU 29 CO -0.30 1.26 0.23 0.78 -1.16 0.00 0.00 179.01 179.82 2b76 h GLY 30 N 1.32 0.16 0.00 -3.84 0.00 0.41 -2.35 103.07 98.76 2b76 h GLY 30 Ca -0.17 -0.05 0.00 0.00 0.00 0.00 0.00 47.33 47.11 2b76 h GLY 30 CO 0.21 0.04 0.64 2.41 0.00 0.00 0.00 176.54 179.84 2b76 n THR 31 N -4.47 0.00 0.09 4.70 -1.04 -0.56 0.11 114.28 113.12 2b76 n THR 31 Ca 0.04 0.64 -0.23 0.00 -2.04 0.00 0.00 64.05 62.47 2b76 n THR 31 Cb 0.32 -1.44 -0.15 0.00 -1.82 0.00 0.00 70.33 67.25 2b76 n THR 31 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2b76 h ALA 32 N 0.00 0.09 -0.26 2.41 0.00 -1.64 -3.29 119.26 116.57 2b76 h ALA 32 Ca 0.00 -1.07 0.03 0.00 0.00 0.00 0.00 54.91 53.87 2b76 h ALA 32 Cb 1.28 0.36 -0.04 0.00 0.00 0.00 0.00 17.79 19.40 2b76 h ALA 32 CO 0.00 0.96 -0.24 0.28 0.00 0.00 0.00 179.25 180.25 2b76 h VAL 33 N 0.11 0.00 -0.65 0.00 2.07 -0.57 -0.85 116.25 116.36 2b76 h VAL 33 Ca -0.31 0.00 0.05 0.00 0.82 0.00 0.00 66.70 67.26 2b76 h VAL 33 Cb 2.11 0.00 -0.04 0.00 -1.52 0.00 0.00 31.29 31.84 2b76 h VAL 33 CO 0.20 0.00 0.43 1.55 0.02 0.00 0.00 177.57 179.77 2b76 h PRO 34 N -0.11 0.68 0.00 1.57 0.14 -1.75 0.20 132.00 132.72 2b76 h PRO 34 Ca 0.04 -0.04 0.00 0.00 0.14 0.00 0.00 66.00 66.14 2b76 h PRO 34 Cb 0.22 -0.15 0.00 0.00 0.14 0.00 0.00 31.00 31.21 2b76 h PRO 34 CO -0.31 0.45 0.00 0.00 0.14 0.00 0.00 178.00 178.28 2b76 h ALA 35 N 1.64 1.00 0.02 -0.56 0.00 -1.26 0.89 119.26 120.99 2b76 h ALA 35 Ca 0.27 0.00 -0.37 0.00 0.00 0.00 0.00 54.91 54.81 2b76 h ALA 35 Cb 0.19 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 17.93 2b76 h ALA 35 CO -0.08 0.00 -2.09 1.55 0.00 0.00 0.00 179.25 178.63 2b76 n VAL 36 N -2.86 1.56 -0.15 0.00 3.14 0.01 -3.74 118.33 116.29 2b76 n VAL 36 Ca -0.02 -0.35 -0.03 0.00 -2.96 0.00 0.00 64.34 60.98 2b76 n VAL 36 Cb 0.11 -1.83 0.05 0.00 -1.06 0.00 0.00 33.84 31.11 2b76 n VAL 36 CO 0.00 0.00 0.00 -0.25 -6.46 0.00 0.00 176.83 170.12 2b76 h TRP 37 N -0.69 0.05 -0.76 1.45 2.91 -1.08 1.40 115.95 119.23 2b76 h TRP 37 Ca -0.54 0.03 0.09 0.00 1.13 0.00 0.00 58.89 59.60 2b76 h TRP 37 Cb 1.63 0.05 -0.05 0.00 -0.51 0.00 0.00 29.16 30.28 2b76 h TRP 37 CO 0.01 -0.06 0.50 0.35 -1.03 0.00 0.00 178.44 178.20 2b76 h PHE 38 N 0.16 0.73 0.00 2.65 3.57 -1.02 1.04 116.94 124.08 2b76 h PHE 38 Ca 0.24 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.72 2b76 h PHE 38 Cb 0.34 -0.24 -0.01 0.00 2.79 0.00 0.00 35.95 38.83 2b76 h PHE 38 CO -0.27 0.35 -0.18 0.77 -2.23 0.00 0.00 178.31 176.75 2b76 h SER 39 N 0.69 0.00 0.02 0.41 0.02 0.16 -1.43 113.55 113.42 2b76 h SER 39 Ca 0.35 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 61.20 2b76 h SER 39 Cb 0.43 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.98 2b76 h SER 39 CO -0.13 0.18 -0.38 0.40 -1.14 0.00 0.00 176.83 175.77 2b76 h ILE 40 N 0.00 1.55 -0.40 3.27 2.04 0.40 -2.72 117.51 121.65 2b76 h ILE 40 Ca -0.00 -2.12 0.06 0.00 1.00 0.00 0.00 64.86 63.80 2b76 h ILE 40 Cb 0.42 2.89 -0.09 0.00 -0.74 0.00 0.00 36.82 39.30 2b76 h ILE 40 CO 0.02 0.59 -0.48 -0.33 0.00 0.00 0.00 178.15 177.95 2b76 h GLU 41 N -0.47 -0.35 -0.99 2.37 5.08 -0.07 0.38 114.58 120.53 2b76 h GLU 41 Ca -0.05 0.02 0.34 0.00 -1.00 0.00 0.00 59.36 58.67 2b76 h GLU 41 Cb 1.17 0.08 -0.16 0.00 0.50 0.00 0.00 28.75 30.34 2b76 h GLU 41 CO 0.07 -0.23 0.53 -0.07 -1.00 0.00 0.00 179.01 178.31 2b76 h LEU 42 N -0.37 0.41 0.27 1.33 -0.00 -1.35 0.60 115.31 116.20 2b76 h LEU 42 Ca 0.11 0.21 -0.01 0.00 -0.00 0.00 0.00 57.88 58.19 2b76 h LEU 42 Cb 0.60 0.19 0.00 0.00 -0.00 0.00 0.00 40.66 41.45 2b76 h LEU 42 CO -0.58 -0.22 -0.13 0.40 -0.00 0.00 0.00 178.44 177.91 2b76 h ILE 43 N 0.22 0.74 -0.90 1.22 2.04 0.05 0.28 117.51 121.17 2b76 h ILE 43 Ca 0.75 -0.72 0.24 0.00 1.00 0.00 0.00 64.86 66.13 2b76 h ILE 43 Cb 1.78 1.11 -0.16 0.00 -0.74 0.00 0.00 36.82 38.81 2b76 h ILE 43 CO -0.66 0.14 0.08 -0.26 0.00 0.00 0.00 178.15 177.44 2b76 h PHE 44 N -0.77 0.05 -0.25 1.37 -1.00 0.19 0.80 116.94 117.34 2b76 h PHE 44 Ca -0.04 0.06 0.06 0.00 2.81 0.00 0.00 57.97 60.87 2b76 h PHE 44 Cb 0.50 0.12 -0.06 0.00 3.61 0.00 0.00 35.95 40.12 2b76 h PHE 44 CO 0.04 -0.33 -0.18 0.78 -1.61 0.00 0.00 178.31 177.01 2b76 h GLY 45 N 0.08 -0.02 0.74 -1.45 0.00 -0.67 0.25 103.07 102.01 2b76 h GLY 45 Ca 0.54 0.22 0.04 0.00 0.00 0.00 0.00 47.33 48.13 2b76 h GLY 45 CO -0.79 -0.17 0.19 -2.00 0.00 0.00 0.00 176.54 173.77 2b76 h LEU 46 N -0.17 0.26 -0.94 3.11 5.85 0.27 -0.91 115.31 122.78 2b76 h LEU 46 Ca 0.14 0.03 -0.06 0.00 0.84 0.00 0.00 57.88 58.83 2b76 h LEU 46 Cb 0.38 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.38 2b76 h LEU 46 CO -0.35 0.19 -0.28 -0.26 -0.34 0.00 0.00 178.44 177.41 2b76 h PHE 47 N 0.39 0.00 0.13 1.25 0.04 -0.17 -3.21 116.94 115.37 2b76 h PHE 47 Ca 0.18 0.00 -0.22 0.00 2.80 0.00 0.00 57.97 60.73 2b76 h PHE 47 Cb 0.11 0.00 0.02 0.00 2.20 0.00 0.00 35.95 38.29 2b76 h PHE 47 CO -0.11 0.28 -0.96 0.00 -0.60 0.00 0.00 178.31 176.92 2b76 h ALA 48 N 1.72 -0.06 0.00 2.45 0.00 -0.17 -2.00 119.26 121.20 2b76 h ALA 48 Ca -0.00 -0.71 0.00 0.00 0.00 0.00 0.00 54.91 54.20 2b76 h ALA 48 Cb 0.85 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.74 2b76 h ALA 48 CO 0.04 0.47 0.00 -0.11 0.00 0.00 0.00 179.25 179.65 2b76 n LEU 49 N -4.02 1.05 0.00 0.00 0.00 -0.38 -1.85 117.00 111.80 2b76 n LEU 49 Ca -0.14 -0.53 0.00 0.00 0.00 0.00 0.00 56.01 55.35 2b76 n LEU 49 Cb 0.87 -0.23 0.00 0.00 0.00 0.00 0.00 43.42 44.06 2b76 n LEU 49 CO 0.52 0.19 0.00 1.17 0.00 0.00 0.00 177.39 179.27 2b76 n LYS 50 N 0.61 0.00 0.00 1.96 3.00 -1.17 -4.70 118.16 117.85 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 0.19 -0.46 0.06 0.00 0.00 0.00 0.00 35.03 34.82 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 -1.31 0.00 0.00 3.14 5.03 -0.76 -4.90 115.26 116.46 2b76 n ASN 51 Ca 0.00 -0.02 0.00 0.00 0.87 0.00 0.00 54.58 55.43 2b76 n ASN 51 Cb 0.00 -0.04 0.00 0.00 -1.02 0.00 0.00 39.78 38.72 2b76 n ASN 51 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2b76 n GLY 52 N -0.91 0.89 0.41 7.41 0.00 -1.17 -4.67 105.19 107.16 2b76 n GLY 52 Ca 0.01 -1.49 0.32 0.00 0.00 0.00 0.00 46.02 44.87 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 1.26 -0.01 -0.09 1.61 -0.04 -1.26 0.37 135.00 136.84 2b76 n PRO 53 Ca 0.00 0.78 -0.06 0.00 -0.04 0.00 0.00 63.50 64.18 2b76 n PRO 53 Cb 0.00 -1.68 0.00 0.00 -0.04 0.00 0.00 33.50 31.79 2b76 n PRO 53 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2b76 h GLU 54 N 0.00 0.03 -0.00 0.54 4.39 -1.93 -2.94 114.58 114.66 2b76 h GLU 54 Ca 0.62 -0.00 -0.00 0.00 0.34 0.00 0.00 59.36 60.32 2b76 h GLU 54 Cb 2.29 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 30.93 2b76 h GLU 54 CO -0.13 0.02 -0.00 0.00 -1.16 0.00 0.00 179.01 177.73 2b76 h ALA 55 N 1.31 0.00 -0.01 3.43 0.00 -0.36 -3.05 119.26 120.58 2b76 h ALA 55 Ca 0.16 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.76 2b76 h ALA 55 Cb 0.23 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 2b76 h ALA 55 CO -0.32 -0.19 0.33 2.35 0.00 0.00 0.00 179.25 181.43 2b76 h TRP 56 N -0.62 0.00 0.00 0.00 2.91 -1.54 0.69 115.95 117.39 2b76 h TRP 56 Ca -0.00 0.00 -0.15 0.00 1.13 0.00 0.00 58.89 59.87 2b76 h TRP 56 Cb 0.63 0.00 -0.02 0.00 -0.51 0.00 0.00 29.16 29.25 2b76 h TRP 56 CO 0.14 0.00 -0.82 0.00 -1.03 0.00 0.00 178.44 176.74 2b76 h ALA 57 N 1.35 0.58 0.00 2.65 0.00 -1.40 -2.82 119.26 119.62 2b76 h ALA 57 Ca 0.01 -0.69 0.00 0.00 0.00 0.00 0.00 54.91 54.23 2b76 h ALA 57 Cb 0.66 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.42 2b76 h ALA 57 CO -0.00 0.89 -0.37 0.78 0.00 0.00 0.00 179.25 180.55 2b76 h GLY 58 N 3.37 0.00 0.60 0.00 0.00 0.30 -1.69 103.07 105.65 2b76 h GLY 58 Ca -0.04 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.27 2b76 h GLY 58 CO 0.08 0.00 -0.18 -2.75 0.00 0.00 0.00 176.54 173.69 2b76 h PHE 59 N 0.00 -0.47 -0.67 5.60 3.04 -1.03 -2.44 116.94 120.97 2b76 h PHE 59 Ca 0.00 -0.01 0.15 0.00 3.98 0.00 0.00 57.97 62.09 2b76 h PHE 59 Cb 0.98 0.15 -0.04 0.00 2.56 0.00 0.00 35.95 39.60 2b76 h PHE 59 CO 0.00 -0.14 0.46 0.28 -2.02 0.00 0.00 178.31 176.90 2b76 h VAL 60 N -0.91 0.77 -0.33 1.41 2.07 -1.53 0.17 116.25 117.89 2b76 h VAL 60 Ca -0.05 -0.08 -0.01 0.00 0.82 0.00 0.00 66.70 67.37 2b76 h VAL 60 Cb 0.54 0.50 -0.02 0.00 -1.52 0.00 0.00 31.29 30.80 2b76 h VAL 60 CO 0.08 0.04 0.15 0.44 0.02 0.00 0.00 177.57 178.31 2b76 h ASP 61 N 0.24 0.44 -0.56 0.57 3.45 -1.13 0.03 116.42 119.46 2b76 h ASP 61 Ca 0.33 -0.14 0.00 0.00 0.43 0.00 0.00 57.03 57.65 2b76 h ASP 61 Cb 0.94 -0.11 -0.03 0.00 -0.56 0.00 0.00 39.33 39.56 2b76 h ASP 61 CO -0.07 0.46 0.37 0.15 -1.57 0.00 0.00 179.24 178.58 2b76 h PHE 62 N 0.40 0.72 0.00 4.55 3.04 -0.24 0.77 116.94 126.18 2b76 h PHE 62 Ca 0.11 0.01 0.00 0.00 3.98 0.00 0.00 57.97 62.08 2b76 h PHE 62 Cb 0.14 -0.24 0.00 0.00 2.56 0.00 0.00 35.95 38.41 2b76 h PHE 62 CO -0.01 0.46 0.00 -0.07 -2.02 0.00 0.00 178.31 176.67 2b76 h LEU 63 N 0.77 0.00 0.00 0.59 3.38 0.01 -2.92 115.31 117.14 2b76 h LEU 63 Ca 0.21 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.95 2b76 h LEU 63 Cb -0.07 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.64 2b76 h LEU 63 CO -0.04 0.00 -1.20 1.56 0.09 0.00 0.00 178.44 178.85 2b76 h GLN 64 N 0.00 0.00 -6.26 1.13 4.20 0.10 -3.43 115.11 110.85 2b76 h GLN 64 Ca 0.00 0.00 -0.68 0.00 0.06 0.00 0.00 58.65 58.03 2b76 h GLN 64 Cb 0.53 0.00 0.04 0.00 0.30 0.00 0.00 27.48 28.34 2b76 h GLN 64 CO 0.00 0.85 0.74 -1.71 -0.67 0.00 0.00 178.83 178.05 2b76 n ASN 65 N -3.26 2.36 -0.16 1.46 2.85 -0.88 -4.89 115.26 112.74 2b76 n ASN 65 Ca -0.05 1.08 -0.03 0.00 -0.11 0.00 0.00 54.58 55.47 2b76 n ASN 65 Cb 0.97 -1.23 0.03 0.00 1.24 0.00 0.00 39.78 40.79 2b76 n ASN 65 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 2b76 h PRO 66 N 6.30 -0.06 -0.02 1.20 0.13 -1.90 -2.34 132.00 135.31 2b76 h PRO 66 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2b76 h PRO 66 Cb 1.31 0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.45 2b76 h PRO 66 CO 0.88 -0.04 -0.02 0.28 -0.23 0.00 0.00 178.00 178.87 2b76 h VAL 67 N -0.06 0.00 -1.76 1.56 2.07 -1.95 0.26 116.25 116.37 2b76 h VAL 67 Ca 0.24 0.00 0.53 0.00 0.82 0.00 0.00 66.70 68.29 2b76 h VAL 67 Cb 0.44 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 30.11 2b76 h VAL 67 CO -0.56 0.00 1.24 0.40 0.02 0.00 0.00 177.57 178.67 2b76 h ILE 68 N -0.01 0.04 0.00 4.57 1.08 -1.81 0.54 117.51 121.93 2b76 h ILE 68 Ca 0.00 -0.00 -0.06 0.00 -0.39 0.00 0.00 64.86 64.41 2b76 h ILE 68 Cb 0.02 0.03 -0.01 0.00 -3.07 0.00 0.00 36.82 33.79 2b76 h ILE 68 CO -0.02 0.00 -0.49 0.58 -0.69 0.00 0.00 178.15 177.53 2b76 h VAL 69 N 0.01 0.40 0.11 1.67 2.07 0.01 0.31 116.25 120.84 2b76 h VAL 69 Ca 0.90 -1.60 -0.01 0.00 0.82 0.00 0.00 66.70 66.81 2b76 h VAL 69 Cb 3.40 2.11 0.00 0.00 -1.52 0.00 0.00 31.29 35.29 2b76 h VAL 69 CO -0.14 0.23 -0.05 0.40 0.02 0.00 0.00 177.57 178.03 2b76 h ILE 70 N 0.00 0.46 -0.81 4.57 1.08 0.13 -2.85 117.51 120.09 2b76 h ILE 70 Ca -0.02 -1.16 0.16 0.00 -0.39 0.00 0.00 64.86 63.45 2b76 h ILE 70 Cb 1.22 0.83 -0.15 0.00 -3.07 0.00 0.00 36.82 35.65 2b76 h ILE 70 CO 0.03 0.14 -0.22 0.40 -0.69 0.00 0.00 178.15 177.82 2b76 h ILE 71 N -1.00 0.17 0.00 -0.67 2.04 -1.34 0.29 117.51 117.01 2b76 h ILE 71 Ca -0.02 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 65.81 2b76 h ILE 71 Cb 0.35 0.17 -0.00 0.00 -0.74 0.00 0.00 36.82 36.60 2b76 h ILE 71 CO 0.03 0.00 -0.17 0.78 0.00 0.00 0.00 178.15 178.79 2b76 h ASN 72 N -0.01 0.00 -0.15 1.72 -0.26 -0.41 -1.74 115.58 114.74 2b76 h ASN 72 Ca 0.38 0.00 -0.17 0.00 -0.56 0.00 0.00 56.30 55.95 2b76 h ASN 72 Cb 0.60 0.00 0.01 0.00 -1.06 0.00 0.00 38.32 37.86 2b76 h ASN 72 CO -0.84 0.17 -0.59 -0.07 -1.06 0.00 0.00 177.43 175.04 2b76 h LEU 73 N 0.00 0.78 -2.02 1.61 3.38 -0.21 -2.42 115.31 116.43 2b76 h LEU 73 Ca -0.00 -0.62 0.13 0.00 0.09 0.00 0.00 57.88 57.48 2b76 h LEU 73 Cb 0.43 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.94 2b76 h LEU 73 CO 0.02 1.26 0.33 0.40 0.09 0.00 0.00 178.44 180.55 2b76 h ILE 74 N 0.34 0.72 -0.28 1.22 2.04 -0.88 0.49 117.51 121.16 2b76 h ILE 74 Ca -0.03 0.00 -0.11 0.00 1.00 0.00 0.00 64.86 65.71 2b76 h ILE 74 Cb 1.22 0.76 -0.00 0.00 -0.74 0.00 0.00 36.82 38.06 2b76 h ILE 74 CO 0.12 0.00 -0.28 0.74 0.00 0.00 0.00 178.15 178.74 2b76 h THR 75 N 0.00 1.30 -0.84 -0.27 2.02 -0.86 -2.17 112.91 112.09 2b76 h THR 75 Ca 0.21 -1.44 -0.01 0.00 0.77 0.00 0.00 66.41 65.94 2b76 h THR 75 Cb 0.88 1.61 -0.04 0.00 -1.74 0.00 0.00 68.15 68.85 2b76 h THR 75 CO -0.00 0.46 0.48 0.25 0.37 0.00 0.00 175.52 177.07 2b76 h LEU 76 N 0.41 1.04 -0.49 2.58 5.85 0.27 -1.96 115.31 123.01 2b76 h LEU 76 Ca 0.04 -0.09 0.02 0.00 0.84 0.00 0.00 57.88 58.69 2b76 h LEU 76 Cb 0.84 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.58 2b76 h LEU 76 CO 0.07 0.83 0.31 0.00 -0.34 0.00 0.00 178.44 179.30 2b76 h ALA 77 N 1.26 0.63 0.04 1.25 0.00 -0.79 0.65 119.26 122.29 2b76 h ALA 77 Ca 0.30 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.19 2b76 h ALA 77 Cb 0.01 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 17.63 2b76 h ALA 77 CO -0.05 0.02 -0.03 0.00 0.00 0.00 0.00 179.25 179.19 2b76 h ALA 78 N 1.21 -0.84 -0.48 0.00 0.00 -1.07 0.26 119.26 118.35 2b76 h ALA 78 Ca 0.19 -0.01 0.04 0.00 0.00 0.00 0.00 54.91 55.13 2b76 h ALA 78 Cb -0.02 0.22 -0.06 0.00 0.00 0.00 0.00 17.79 17.94 2b76 h ALA 78 CO -0.07 -0.84 -0.28 0.00 0.00 0.00 0.00 179.25 178.06 2b76 n ALA 79 N -2.23 -0.31 -0.28 0.00 0.00 -0.76 0.15 120.51 117.08 2b76 n ALA 79 Ca -0.01 0.41 0.08 0.00 0.00 0.00 0.00 53.44 53.92 2b76 n ALA 79 Cb 0.03 0.06 0.23 0.00 0.00 0.00 0.00 19.45 19.78 2b76 n ALA 79 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2b76 h LEU 80 N 0.00 0.37 0.36 0.00 3.38 -0.64 0.29 115.31 119.07 2b76 h LEU 80 Ca 0.08 0.12 -0.02 0.00 0.09 0.00 0.00 57.88 58.15 2b76 h LEU 80 Cb 0.20 0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.03 2b76 h LEU 80 CO -0.45 0.11 -0.17 0.25 0.09 0.00 0.00 178.44 178.27 2b76 h LEU 81 N 0.49 -0.41 -0.57 1.67 5.85 0.50 0.07 115.31 122.90 2b76 h LEU 81 Ca 0.47 -0.03 0.11 0.00 0.84 0.00 0.00 57.88 59.27 2b76 h LEU 81 Cb 0.76 0.11 -0.08 0.00 0.37 0.00 0.00 40.66 41.81 2b76 h LEU 81 CO -0.43 -0.24 0.10 -0.74 -0.34 0.00 0.00 178.44 176.79 2b76 h HIS 82 N -0.56 0.16 -0.72 1.25 2.76 0.18 0.16 115.15 118.38 2b76 h HIS 82 Ca -0.05 0.04 0.05 0.00 -2.20 0.00 0.00 60.37 58.21 2b76 h HIS 82 Cb 0.42 0.02 -0.05 0.00 1.55 0.00 0.00 27.41 29.34 2b76 h HIS 82 CO -0.03 -0.04 0.42 1.15 -1.30 0.00 0.00 177.93 178.12 2b76 h THR 83 N 0.23 1.01 0.68 6.26 2.02 -0.35 0.14 112.91 122.91 2b76 h THR 83 Ca 0.30 -0.27 -0.03 0.00 0.77 0.00 0.00 66.41 67.17 2b76 h THR 83 Cb 0.44 0.16 0.01 0.00 -1.74 0.00 0.00 68.15 67.01 2b76 h THR 83 CO -0.40 0.14 -0.33 0.50 0.37 0.00 0.00 175.52 175.81 2b76 h LYS 84 N 0.79 -0.88 -0.07 6.66 3.64 0.13 -2.72 116.57 124.12 2b76 h LYS 84 Ca 0.31 0.06 0.02 0.00 -1.27 0.00 0.00 60.65 59.77 2b76 h LYS 84 Cb 0.14 0.20 -0.02 0.00 -0.41 0.00 0.00 32.23 32.15 2b76 h LYS 84 CO -0.16 -0.57 -0.04 1.79 -2.27 0.00 0.00 179.45 178.20 2b76 h THR 85 N -0.98 0.88 -0.77 1.00 1.35 -1.02 -2.67 112.91 110.70 2b76 h THR 85 Ca -0.09 0.00 0.12 0.00 -0.55 0.00 0.00 66.41 65.88 2b76 h THR 85 Cb 0.72 0.88 -0.08 0.00 -1.73 0.00 0.00 68.15 67.94 2b76 h THR 85 CO 0.15 0.00 0.38 -0.25 -0.25 0.00 0.00 175.52 175.55 2b76 h TRP 86 N -0.03 0.67 -0.34 4.73 2.91 -0.78 -0.57 115.95 122.54 2b76 h TRP 86 Ca 0.04 0.03 -0.02 0.00 1.13 0.00 0.00 58.89 60.07 2b76 h TRP 86 Cb 0.10 -0.18 -0.02 0.00 -0.51 0.00 0.00 29.16 28.54 2b76 h TRP 86 CO -0.14 0.20 0.10 0.74 -1.03 0.00 0.00 178.44 178.31 2b76 h PHE 87 N 0.60 0.48 0.00 2.65 0.04 -1.14 -1.69 116.94 117.88 2b76 h PHE 87 Ca 0.40 -0.02 0.00 0.00 2.80 0.00 0.00 57.97 61.15 2b76 h PHE 87 Cb 0.49 -0.15 0.00 0.00 2.20 0.00 0.00 35.95 38.49 2b76 h PHE 87 CO -0.11 0.41 0.00 0.39 -0.60 0.00 0.00 178.31 178.40 2b76 n GLU 88 N -4.37 0.20 -0.12 1.51 1.02 -0.24 -3.90 120.64 114.73 2b76 n GLU 88 Ca 0.02 0.31 -0.22 0.00 -0.02 0.00 0.00 57.16 57.26 2b76 n GLU 88 Cb 0.16 -1.81 -0.12 0.00 -0.02 0.00 0.00 31.44 29.66 2b76 n GLU 88 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2b76 n LEU 89 N -2.17 2.64 -0.25 -4.62 4.77 -0.66 -4.56 117.00 112.15 2b76 n LEU 89 Ca 0.04 0.04 -0.01 0.00 -0.03 0.00 0.00 56.01 56.05 2b76 n LEU 89 Cb 0.31 -0.91 0.05 0.00 -2.33 0.00 0.00 43.42 40.54 2b76 n LEU 89 CO 0.24 0.81 0.67 0.00 -1.33 0.00 0.00 177.39 177.78 2b76 h ALA 90 N -0.26 0.27 -1.15 -1.18 0.00 -1.61 0.52 119.26 115.85 2b76 h ALA 90 Ca -0.58 0.25 0.40 0.00 0.00 0.00 0.00 54.91 54.98 2b76 h ALA 90 Cb 1.82 0.69 -0.15 0.00 0.00 0.00 0.00 17.79 20.15 2b76 h ALA 90 CO -0.16 -0.53 0.69 -1.00 0.00 0.00 0.00 179.25 178.26 2b76 h PRO 91 N -0.06 0.11 -0.46 0.00 0.13 -1.81 0.59 132.00 130.50 2b76 h PRO 91 Ca 0.31 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.44 2b76 h PRO 91 Cb 0.56 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.66 2b76 h PRO 91 CO -0.76 0.07 0.00 1.63 -0.23 0.00 0.00 178.00 178.71 2b76 n LYS 92 N -4.95 0.56 0.00 0.86 5.02 0.18 -1.30 118.16 118.53 2b76 n LYS 92 Ca 0.36 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.65 2b76 n LYS 92 Cb 1.29 -1.23 0.00 0.00 -0.02 0.00 0.00 35.03 35.07 2b76 n LYS 92 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2b76 n ALA 93 N 0.09 1.29 -2.67 7.82 0.00 0.20 -4.99 120.51 122.24 2b76 n ALA 93 Ca 0.00 -0.64 -0.33 0.00 0.00 0.00 0.00 53.44 52.47 2b76 n ALA 93 Cb 0.12 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.44 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 -0.30 2.81 -0.61 0.00 0.00 -0.42 -5.05 121.76 118.20 2b76 s ALA 94 Ca 0.00 -0.91 0.06 0.00 0.00 0.00 0.00 51.96 51.11 2b76 s ALA 94 Cb 0.00 -1.17 0.24 0.00 0.00 0.00 0.00 23.12 22.19 2b76 s ALA 94 CO 0.00 0.47 0.66 -1.71 0.00 0.00 0.00 175.76 175.19 2b76 n ASN 95 N 2.62 3.00 -4.94 0.00 2.85 -1.26 -5.00 115.26 112.53 2b76 n ASN 95 Ca -0.18 -3.27 -0.27 0.00 -0.11 0.00 0.00 54.58 50.76 2b76 n ASN 95 Cb 0.53 -0.68 -0.03 0.00 1.24 0.00 0.00 39.78 40.84 2b76 n ASN 95 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 2b76 s ILE 96 N -2.06 5.28 -0.18 -1.44 1.09 -1.26 -5.03 121.20 117.60 2b76 s ILE 96 Ca 0.37 -0.54 0.00 0.00 -1.10 0.00 0.00 60.65 59.38 2b76 s ILE 96 Cb 0.12 -3.73 0.04 0.00 -1.06 0.00 0.00 42.46 37.83 2b76 s ILE 96 CO -0.06 -0.11 -0.08 -0.63 -0.10 0.00 0.00 174.94 173.96 2b76 s ILE 97 N -1.78 1.36 -0.04 2.92 1.01 -1.26 -1.66 121.20 121.75 2b76 s ILE 97 Ca 0.36 -0.77 0.04 0.00 0.00 0.00 0.00 60.65 60.28 2b76 s ILE 97 Cb -0.11 -1.47 -0.03 0.00 0.01 0.00 0.00 42.46 40.86 2b76 s ILE 97 CO 0.29 0.18 -0.15 0.68 0.00 0.00 0.00 174.94 175.94 2b76 s VAL 98 N 1.53 3.00 0.00 2.92 -7.23 -0.81 -4.92 120.40 114.89 2b76 s VAL 98 Ca 0.00 -0.77 0.00 0.00 -1.81 0.00 0.00 61.98 59.40 2b76 s VAL 98 Cb -0.15 -2.18 0.00 0.00 0.56 0.00 0.00 36.38 34.61 2b76 s VAL 98 CO -0.08 0.57 0.00 0.29 -0.31 0.00 0.00 175.10 175.57 2b76 n LYS 99 N 2.25 0.00 -0.16 4.82 5.02 -1.26 -1.89 118.16 126.94 2b76 n LYS 99 Ca -0.17 0.00 0.06 0.00 -2.02 0.00 0.00 58.31 56.18 2b76 n LYS 99 Cb 0.52 0.00 0.14 0.00 -0.02 0.00 0.00 35.03 35.67 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 2.50 2.73 -4.94 4.39 8.00 -1.26 -5.03 116.55 122.94 2b76 n ASP 100 Ca 0.00 -2.62 -0.19 0.00 0.71 0.00 0.00 54.79 52.69 2b76 n ASP 100 Cb 0.00 -0.32 -0.01 0.00 -0.02 0.00 0.00 41.12 40.77 2b76 n ASP 100 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 2b76 s GLU 101 N -2.09 2.75 -0.27 -1.24 2.02 -0.79 -5.08 118.70 114.00 2b76 s GLU 101 Ca 0.25 -1.32 -0.17 0.00 0.02 0.00 0.00 54.97 53.75 2b76 s GLU 101 Cb 0.20 -2.59 -0.03 0.00 0.10 0.00 0.00 34.13 31.81 2b76 s GLU 101 CO 0.06 -0.15 0.48 0.21 0.02 0.00 0.00 175.26 175.88 2b76 s LYS 102 N -4.20 4.04 0.95 1.61 2.20 -1.26 -1.93 119.74 121.15 2b76 s LYS 102 Ca 0.49 0.24 -0.12 0.00 -0.36 0.00 0.00 55.97 56.22 2b76 s LYS 102 Cb -0.07 -3.66 0.16 0.00 -1.51 0.00 0.00 37.83 32.75 2b76 s LYS 102 CO 0.30 -0.35 1.09 0.00 -0.36 0.00 0.00 175.35 176.04 2b76 s MET 103 N 2.26 0.85 0.35 4.03 0.00 -0.66 -4.95 119.30 121.17 2b76 s MET 103 Ca 0.20 0.69 0.05 0.00 0.00 0.00 0.00 55.69 56.62 2b76 s MET 103 Cb -0.16 -1.77 0.05 0.00 0.00 0.00 0.00 34.83 32.95 2b76 s MET 103 CO 0.09 -2.49 0.40 0.41 0.00 0.00 0.00 175.02 173.43 2b76 n GLY 104 N -1.08 2.33 0.17 3.16 0.00 -1.26 -4.81 105.19 103.70 2b76 n GLY 104 Ca 0.06 -2.22 -0.15 0.00 0.00 0.00 0.00 46.02 43.71 2b76 n GLY 104 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2b76 h PRO 105 N 0.00 0.51 -0.43 1.61 0.13 -1.97 -3.37 132.00 128.47 2b76 h PRO 105 Ca -0.19 -0.53 0.09 0.00 -0.87 0.00 0.00 66.00 64.50 2b76 h PRO 105 Cb 0.78 0.15 -0.08 0.00 0.13 0.00 0.00 31.00 31.98 2b76 h PRO 105 CO 0.28 1.17 -0.09 -0.85 -0.23 0.00 0.00 178.00 178.28 2b76 n GLU 106 N -3.79 -0.04 -0.01 0.86 0.28 -1.26 -1.62 120.64 115.06 2b76 n GLU 106 Ca -0.08 0.67 -0.17 0.00 -0.16 0.00 0.00 57.16 57.42 2b76 n GLU 106 Cb 0.84 -1.02 -0.09 0.00 1.43 0.00 0.00 31.44 32.60 2b76 n GLU 106 CO 0.00 0.00 0.00 -1.35 -0.16 0.00 0.00 177.13 175.62 2b76 h PRO 107 N 0.00 0.60 -0.03 3.44 0.11 -2.02 -3.04 132.00 131.06 2b76 h PRO 107 Ca 0.22 -0.54 -0.01 0.00 0.11 0.00 0.00 66.00 65.78 2b76 h PRO 107 Cb 0.36 0.13 -0.00 0.00 0.11 0.00 0.00 31.00 31.60 2b76 h PRO 107 CO -0.44 1.16 -0.01 0.82 -0.21 0.00 0.00 178.00 179.33 2b76 h ILE 108 N 0.22 1.28 -0.99 4.15 2.04 -1.54 -1.73 117.51 120.94 2b76 h ILE 108 Ca -0.06 -0.85 0.34 0.00 1.00 0.00 0.00 64.86 65.28 2b76 h ILE 108 Cb 1.34 1.79 -0.18 0.00 -0.74 0.00 0.00 36.82 39.04 2b76 h ILE 108 CO 0.14 0.23 0.31 0.40 0.00 0.00 0.00 178.15 179.22 2b76 h ILE 109 N -0.27 0.05 -0.31 -0.67 2.04 -1.59 0.32 117.51 117.08 2b76 h ILE 109 Ca 0.01 -0.01 0.00 0.00 1.00 0.00 0.00 64.86 65.86 2b76 h ILE 109 Cb 0.37 0.01 -0.02 0.00 -0.74 0.00 0.00 36.82 36.44 2b76 h ILE 109 CO 0.00 0.01 0.20 0.11 0.00 0.00 0.00 178.15 178.47 2b76 h LYS 110 N 0.04 0.40 -0.21 2.37 1.57 -1.19 -2.46 116.57 117.09 2b76 h LYS 110 Ca 0.72 -0.02 -0.21 0.00 -1.87 0.00 0.00 60.65 59.27 2b76 h LYS 110 Cb 1.71 -0.09 0.01 0.00 0.08 0.00 0.00 32.23 33.93 2b76 h LYS 110 CO -0.82 0.27 -0.67 0.66 -0.57 0.00 0.00 179.45 178.32 2b76 h SER 111 N 0.41 0.95 -0.28 0.86 4.64 -0.29 -1.06 113.55 118.79 2b76 h SER 111 Ca 0.11 -0.57 0.08 0.00 -0.47 0.00 0.00 61.79 60.94 2b76 h SER 111 Cb -0.05 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 61.76 2b76 h SER 111 CO -0.02 1.37 0.31 -0.07 -0.87 0.00 0.00 176.83 177.54 2b76 h LEU 112 N 0.59 0.00 0.08 5.97 3.38 -1.01 0.14 115.31 124.46 2b76 h LEU 112 Ca -0.02 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.77 2b76 h LEU 112 Cb 1.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.04 2b76 h LEU 112 CO 0.14 0.00 -0.87 -0.50 0.09 0.00 0.00 178.44 177.30 2b76 h TRP 113 N 0.00 0.31 -0.21 1.13 -0.00 -1.06 -2.96 115.95 113.17 2b76 h TRP 113 Ca 0.13 -0.22 0.06 0.00 -0.00 0.00 0.00 58.89 58.85 2b76 h TRP 113 Cb 0.75 -0.01 -0.06 0.00 -0.00 0.00 0.00 29.16 29.83 2b76 h TRP 113 CO 0.00 1.34 -0.20 0.00 -0.00 0.00 0.00 178.44 179.58 2b76 h ALA 114 N -0.06 -0.09 -1.00 1.49 0.00 0.42 0.11 119.26 120.14 2b76 h ALA 114 Ca -0.19 0.07 0.13 0.00 0.00 0.00 0.00 54.91 54.92 2b76 h ALA 114 Cb 1.48 0.42 -0.09 0.00 0.00 0.00 0.00 17.79 19.61 2b76 h ALA 114 CO 0.04 -0.63 0.63 0.28 0.00 0.00 0.00 179.25 179.56 2b76 h VAL 115 N -0.22 0.91 0.13 0.00 2.07 -0.96 0.34 116.25 118.52 2b76 h VAL 115 Ca 0.12 -0.34 -0.01 0.00 0.82 0.00 0.00 66.70 67.30 2b76 h VAL 115 Cb 0.41 -0.16 0.00 0.00 -1.52 0.00 0.00 31.29 30.02 2b76 h VAL 115 CO -0.33 0.18 -0.06 0.74 0.02 0.00 0.00 177.57 178.11 2b76 h THR 116 N 0.98 0.93 -0.47 2.57 2.02 -0.95 -1.17 112.91 116.82 2b76 h THR 116 Ca 0.50 -0.24 0.09 0.00 0.77 0.00 0.00 66.41 67.53 2b76 h THR 116 Cb 0.52 1.09 -0.09 0.00 -1.74 0.00 0.00 68.15 67.93 2b76 h THR 116 CO -0.27 0.06 -0.14 0.58 0.37 0.00 0.00 175.52 176.12 2b76 h VAL 117 N -0.29 0.49 0.11 3.16 2.07 0.19 0.22 116.25 122.19 2b76 h VAL 117 Ca -0.02 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.50 2b76 h VAL 117 Cb 0.23 0.49 0.00 0.00 -1.52 0.00 0.00 31.29 30.50 2b76 h VAL 117 CO 0.03 0.00 -0.05 0.58 0.02 0.00 0.00 177.57 178.15 2b76 h VAL 118 N -0.03 1.03 -0.13 2.57 2.07 -0.43 -2.98 116.25 118.36 2b76 h VAL 118 Ca 0.23 -0.54 0.05 0.00 0.82 0.00 0.00 66.70 67.25 2b76 h VAL 118 Cb 0.37 1.38 -0.05 0.00 -1.52 0.00 0.00 31.29 31.46 2b76 h VAL 118 CO -0.50 0.13 -0.21 0.00 0.02 0.00 0.00 177.57 177.01 2b76 h ALA 119 N 0.47 -0.17 -1.08 1.67 0.00 -0.60 0.12 119.26 119.67 2b76 h ALA 119 Ca -0.01 0.04 0.40 0.00 0.00 0.00 0.00 54.91 55.34 2b76 h ALA 119 Cb 0.32 0.42 -0.16 0.00 0.00 0.00 0.00 17.79 18.37 2b76 h ALA 119 CO 0.02 -0.67 0.63 1.15 0.00 0.00 0.00 179.25 180.38 2b76 h THR 120 N -0.27 0.10 0.00 0.00 2.02 -0.50 0.74 112.91 115.00 2b76 h THR 120 Ca 0.10 -0.03 0.00 0.00 0.77 0.00 0.00 66.41 67.25 2b76 h THR 120 Cb 0.42 -0.01 0.00 0.00 -1.74 0.00 0.00 68.15 66.82 2b76 h THR 120 CO -0.29 0.02 -0.11 0.40 0.37 0.00 0.00 175.52 175.91 2b76 h ILE 121 N 0.10 0.00 -1.00 3.11 2.04 -0.91 -2.26 117.51 118.59 2b76 h ILE 121 Ca 0.82 -0.54 0.29 0.00 1.00 0.00 0.00 64.86 66.43 2b76 h ILE 121 Cb 2.20 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 38.24 2b76 h ILE 121 CO -0.65 0.00 1.08 0.58 0.00 0.00 0.00 178.15 179.16 2b76 h VAL 122 N -0.54 0.08 0.09 1.67 2.07 0.03 0.82 116.25 120.48 2b76 h VAL 122 Ca 0.00 0.00 -0.18 0.00 0.82 0.00 0.00 66.70 67.34 2b76 h VAL 122 Cb 0.11 0.14 0.00 0.00 -1.52 0.00 0.00 31.29 30.02 2b76 h VAL 122 CO 0.00 0.00 -0.90 0.40 0.02 0.00 0.00 177.57 177.09 2b76 h ILE 123 N 0.00 1.34 -0.01 4.57 5.03 0.38 -3.19 117.51 125.63 2b76 h ILE 123 Ca 0.48 -2.41 0.00 0.00 -0.12 0.00 0.00 64.86 62.81 2b76 h ILE 123 Cb 2.63 2.96 -0.00 0.00 -3.03 0.00 0.00 36.82 39.38 2b76 h ILE 123 CO -0.01 0.64 0.02 -0.07 -0.68 0.00 0.00 178.15 178.06 2b76 h LEU 124 N -0.55 0.00 0.00 1.44 3.38 0.12 0.49 115.31 120.20 2b76 h LEU 124 Ca -0.19 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.59 2b76 h LEU 124 Cb 1.51 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.24 2b76 h LEU 124 CO 0.05 0.00 -1.02 0.15 0.09 0.00 0.00 178.44 177.71 2b76 h PHE 125 N 0.00 0.00 0.12 1.13 3.57 -1.23 -2.08 116.94 118.46 2b76 h PHE 125 Ca 0.00 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.50 2b76 h PHE 125 Cb 0.04 0.00 0.00 0.00 2.79 0.00 0.00 35.95 38.78 2b76 h PHE 125 CO 0.00 0.83 -0.06 0.28 -2.23 0.00 0.00 178.31 177.13 2b76 h VAL 126 N 0.00 0.37 0.00 1.41 2.07 -0.92 -2.13 116.25 117.06 2b76 h VAL 126 Ca -0.06 -1.10 -0.02 0.00 0.82 0.00 0.00 66.70 66.34 2b76 h VAL 126 Cb 1.69 0.68 -0.00 0.00 -1.52 0.00 0.00 31.29 32.13 2b76 h VAL 126 CO 0.10 0.12 -0.09 0.00 0.02 0.00 0.00 177.57 177.72 2b76 h ALA 127 N -0.79 1.20 0.00 1.67 0.00 -1.47 -3.35 119.26 116.53 2b76 h ALA 127 Ca -0.02 -0.08 -0.15 0.00 0.00 0.00 0.00 54.91 54.67 2b76 h ALA 127 Cb 0.32 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.06 2b76 h ALA 127 CO 0.03 0.11 -1.86 1.28 0.00 0.00 0.00 179.25 178.80 2b76 n LEU 128 N -3.49 0.00 -0.04 0.00 4.77 -0.78 -4.92 117.00 112.55 2b76 n LEU 128 Ca -0.02 0.00 -0.06 0.00 -0.03 0.00 0.00 56.01 55.91 2b76 n LEU 128 Cb 0.22 0.20 -0.02 0.00 -2.33 0.00 0.00 43.42 41.50 2b76 n LEU 128 CO 0.28 0.20 -0.42 -1.22 -1.33 0.00 0.00 177.39 174.91 2b76 n TYR 129 N -2.32 0.00 0.00 -1.77 4.02 -0.81 -5.05 117.16 111.23 2b76 n TYR 129 Ca -0.15 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.74 2b76 n TYR 129 Cb 0.72 -0.31 0.00 0.00 -0.02 0.00 0.00 39.34 39.74 2b76 n TYR 129 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 176.86 176.76