#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d00 s VAL 2 N 0.00 4.80 0.27 1.12 1.01 -1.26 -5.05 120.40 121.29 2d00 s VAL 2 Ca 0.00 0.64 -0.30 0.00 0.00 0.00 0.00 61.98 62.33 2d00 s VAL 2 Cb 0.00 -3.68 -0.10 0.00 0.00 0.00 0.00 36.38 32.60 2d00 s VAL 2 CO 0.00 -0.33 1.37 -2.84 0.00 0.00 0.00 175.10 173.29 2d00 s PRO 3 N -3.41 4.32 -0.16 2.72 0.02 -1.26 -4.99 135.00 132.24 2d00 s PRO 3 Ca 0.51 2.22 -0.19 0.00 0.02 0.00 0.00 61.00 63.56 2d00 s PRO 3 Cb -0.10 -3.11 -0.03 0.00 0.02 0.00 0.00 34.50 31.27 2d00 s PRO 3 CO 0.25 -0.31 0.54 0.08 -0.33 0.00 0.00 177.00 177.24 2d00 s VAL 4 N -0.39 5.11 -0.24 3.83 1.01 -1.26 -5.03 120.40 123.42 2d00 s VAL 4 Ca 0.55 1.04 -0.09 0.00 0.00 0.00 0.00 61.98 63.49 2d00 s VAL 4 Cb -0.40 -3.87 -0.04 0.00 0.00 0.00 0.00 36.38 32.07 2d00 s VAL 4 CO 0.46 0.22 0.11 -0.60 0.00 0.00 0.00 175.10 175.29 2d00 s ARG 5 N 1.28 3.83 -0.02 2.72 6.06 -1.26 -4.96 118.95 126.60 2d00 s ARG 5 Ca 0.27 -0.39 0.05 0.00 -2.50 0.00 0.00 55.73 53.16 2d00 s ARG 5 Cb -0.16 -3.41 -0.01 0.00 0.06 0.00 0.00 34.95 31.43 2d00 s ARG 5 CO 0.11 -0.08 -0.18 1.41 -2.50 0.00 0.00 175.30 174.06 2d00 s MET 6 N 1.38 1.52 0.29 5.12 -2.45 -1.26 -0.34 119.30 123.55 2d00 s MET 6 Ca 0.06 -0.64 0.11 0.00 -1.25 0.00 0.00 55.69 53.97 2d00 s MET 6 Cb -0.15 -1.44 -0.05 0.00 1.25 0.00 0.00 34.83 34.44 2d00 s MET 6 CO 0.05 0.36 -0.10 0.00 1.05 0.00 0.00 175.02 176.39 2d00 s ALA 7 N -0.34 2.97 -0.09 4.11 0.00 -0.27 -4.32 121.76 123.81 2d00 s ALA 7 Ca 0.05 -1.82 0.00 0.00 0.00 0.00 0.00 51.96 50.20 2d00 s ALA 7 Cb -0.08 -0.45 0.02 0.00 0.00 0.00 0.00 23.12 22.61 2d00 s ALA 7 CO -0.00 0.24 -0.08 0.08 0.00 0.00 0.00 175.76 176.00 2d00 s VAL 8 N -2.45 0.99 -0.25 0.00 1.01 -0.72 -0.38 120.40 118.60 2d00 s VAL 8 Ca 0.31 -0.31 -0.03 0.00 0.00 0.00 0.00 61.98 61.95 2d00 s VAL 8 Cb -0.05 -0.98 0.01 0.00 0.00 0.00 0.00 36.38 35.37 2d00 s VAL 8 CO 0.17 0.35 -0.03 -0.63 0.00 0.00 0.00 175.10 174.97 2d00 s ILE 9 N 1.38 3.22 0.28 2.22 1.01 0.28 0.03 121.20 129.62 2d00 s ILE 9 Ca -0.02 -0.84 -0.01 0.00 0.00 0.00 0.00 60.65 59.79 2d00 s ILE 9 Cb -0.14 -2.61 0.00 0.00 0.01 0.00 0.00 42.46 39.73 2d00 s ILE 9 CO -0.04 0.22 0.38 0.00 0.00 0.00 0.00 174.94 175.49 2d00 n ALA 10 N 4.74 -0.18 -1.32 9.38 0.00 -0.90 -1.31 120.51 130.91 2d00 n ALA 10 Ca -0.16 -1.34 -0.33 0.00 0.00 0.00 0.00 53.44 51.61 2d00 n ALA 10 Cb 0.48 1.08 0.09 0.00 0.00 0.00 0.00 19.45 21.10 2d00 n ALA 10 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 2d00 s ASP 11 N -2.77 4.32 0.24 0.00 -4.77 -1.25 -1.25 116.67 111.19 2d00 s ASP 11 Ca 0.24 2.20 -0.05 0.00 -3.30 0.00 0.00 52.55 51.65 2d00 s ASP 11 Cb -0.01 -2.57 0.44 0.00 -1.09 0.00 0.00 42.92 39.69 2d00 s ASP 11 CO 0.17 -2.17 1.74 -0.65 0.70 0.00 0.00 175.17 174.96 2d00 h PRO 12 N -0.45 0.45 -0.17 2.11 0.11 -1.91 -1.12 132.00 131.04 2d00 h PRO 12 Ca -0.47 -0.03 -0.18 0.00 0.11 0.00 0.00 66.00 65.43 2d00 h PRO 12 Cb 1.27 -0.10 0.01 0.00 0.11 0.00 0.00 31.00 32.29 2d00 h PRO 12 CO 0.50 0.30 -0.61 0.93 -0.21 0.00 0.00 178.00 178.91 2d00 h GLU 13 N 0.47 0.71 -0.24 1.05 5.08 -1.96 -1.80 114.58 117.88 2d00 h GLU 13 Ca 0.40 -0.54 0.05 0.00 -1.00 0.00 0.00 59.36 58.28 2d00 h GLU 13 Cb 0.58 0.10 -0.05 0.00 0.50 0.00 0.00 28.75 29.88 2d00 h GLU 13 CO -0.38 1.16 -0.09 1.15 -1.00 0.00 0.00 179.01 179.85 2d00 h THR 14 N 0.41 0.69 -0.95 1.13 2.02 -1.83 -1.97 112.91 112.41 2d00 h THR 14 Ca -0.03 0.00 0.17 0.00 0.77 0.00 0.00 66.41 67.32 2d00 h THR 14 Cb 1.24 0.69 -0.08 0.00 -1.74 0.00 0.00 68.15 68.25 2d00 h THR 14 CO 0.13 0.00 0.60 0.00 0.37 0.00 0.00 175.52 176.62 2d00 h ALA 15 N 1.18 1.82 -0.31 6.16 0.00 -1.20 -2.02 119.26 124.89 2d00 h ALA 15 Ca 0.12 0.04 -0.08 0.00 0.00 0.00 0.00 54.91 54.99 2d00 h ALA 15 Cb 0.23 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2d00 h ALA 15 CO -0.28 -0.11 -0.14 1.96 0.00 0.00 0.00 179.25 180.68 2d00 h GLN 16 N 0.70 0.54 -0.24 0.00 4.20 -0.62 -1.92 115.11 117.77 2d00 h GLN 16 Ca 0.50 -0.17 -0.17 0.00 0.06 0.00 0.00 58.65 58.87 2d00 h GLN 16 Cb 0.84 -0.05 -0.00 0.00 0.30 0.00 0.00 27.48 28.57 2d00 h GLN 16 CO -0.26 0.67 -0.53 0.78 -0.67 0.00 0.00 178.83 178.82 2d00 h GLY 17 N 0.95 0.77 0.74 3.46 0.00 -0.72 -1.93 103.07 106.34 2d00 h GLY 17 Ca 0.09 -0.88 0.06 0.00 0.00 0.00 0.00 47.33 46.59 2d00 h GLY 17 CO 0.03 0.79 0.50 0.74 0.00 0.00 0.00 176.54 178.60 2d00 h PHE 18 N 0.54 0.92 -0.46 5.60 0.04 -0.98 -2.46 116.94 120.14 2d00 h PHE 18 Ca 0.01 0.03 -0.05 0.00 2.80 0.00 0.00 57.97 60.76 2d00 h PHE 18 Cb 1.10 -0.30 -0.02 0.00 2.20 0.00 0.00 35.95 38.94 2d00 h PHE 18 CO 0.06 0.47 0.09 0.00 -0.60 0.00 0.00 178.31 178.33 2d00 h ARG 19 N 0.92 0.75 0.00 1.51 3.08 -1.19 -0.59 114.38 118.86 2d00 h ARG 19 Ca 0.35 -0.19 -0.00 0.00 0.07 0.00 0.00 59.98 60.20 2d00 h ARG 19 Cb 0.14 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.10 2d00 h ARG 19 CO -0.16 0.76 -0.02 -0.07 -1.07 0.00 0.00 179.97 179.40 2d00 h LEU 20 N 0.62 0.00 -1.17 3.04 3.38 -1.20 -1.32 115.31 118.66 2d00 h LEU 20 Ca 0.14 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.11 2d00 h LEU 20 Cb 0.36 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.11 2d00 h LEU 20 CO 0.01 0.02 0.00 0.00 0.09 0.00 0.00 178.44 178.56 2d00 n ALA 21 N -2.48 2.46 -0.60 1.53 0.00 -0.94 -4.93 120.51 115.54 2d00 n ALA 21 Ca -0.03 -0.56 0.00 0.00 0.00 0.00 0.00 53.44 52.85 2d00 n ALA 21 Cb 0.11 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.56 2d00 n ALA 21 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2d00 n GLY 22 N 1.03 0.67 3.86 0.00 0.00 -0.50 -5.05 105.19 105.20 2d00 n GLY 22 Ca 0.12 -0.31 -0.21 0.00 0.00 0.00 0.00 46.02 45.61 2d00 n GLY 22 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2d00 s LEU 23 N 0.00 3.73 -1.13 0.99 1.43 -0.24 -4.99 118.68 118.47 2d00 s LEU 23 Ca 0.00 -0.37 -0.13 0.00 -1.03 0.00 0.00 54.13 52.60 2d00 s LEU 23 Cb 0.00 -2.33 0.20 0.00 0.03 0.00 0.00 46.19 44.09 2d00 s LEU 23 CO 0.00 -0.24 1.27 -0.70 0.23 0.00 0.00 176.35 176.90 2d00 s GLU 24 N -3.96 4.04 0.02 1.70 2.12 -1.26 -3.41 118.70 117.94 2d00 s GLU 24 Ca 0.38 -2.67 -0.15 0.00 0.36 0.00 0.00 54.97 52.89 2d00 s GLU 24 Cb -0.07 -4.86 -0.06 0.00 0.26 0.00 0.00 34.13 29.40 2d00 s GLU 24 CO 0.26 -1.59 0.44 0.20 -0.54 0.00 0.00 175.26 174.03 2d00 s GLY 25 N 2.45 2.51 -0.10 -1.50 0.00 -1.26 -1.75 107.32 107.67 2d00 s GLY 25 Ca 0.37 -0.18 0.02 0.00 0.00 0.00 0.00 44.72 44.93 2d00 s GLY 25 CO -0.04 0.19 -0.14 -0.19 0.00 0.00 0.00 173.10 172.92 2d00 s TYR 26 N -1.10 1.80 0.15 1.90 2.02 0.10 -4.85 117.35 117.37 2d00 s TYR 26 Ca 0.25 -0.80 -0.27 0.00 -0.37 0.00 0.00 57.07 55.88 2d00 s TYR 26 Cb -0.17 -1.31 -0.07 0.00 -0.40 0.00 0.00 41.96 40.00 2d00 s TYR 26 CO 0.15 -0.42 0.83 0.20 -1.57 0.00 0.00 175.55 174.74 2d00 s GLY 27 N 0.95 2.95 -0.01 0.71 0.00 -1.26 -2.12 107.32 108.53 2d00 s GLY 27 Ca -0.08 0.43 0.00 0.00 0.00 0.00 0.00 44.72 45.07 2d00 s GLY 27 CO -0.00 1.05 -0.00 0.00 0.00 0.00 0.00 173.10 174.15 2d00 s ALA 28 N -0.80 0.12 -1.61 3.20 0.00 -0.38 -4.89 121.76 117.40 2d00 s ALA 28 Ca 0.39 0.06 0.15 0.00 0.00 0.00 0.00 51.96 52.56 2d00 s ALA 28 Cb -0.23 -0.11 0.28 0.00 0.00 0.00 0.00 23.12 23.06 2d00 s ALA 28 CO 0.27 -0.02 1.18 0.43 0.00 0.00 0.00 175.76 177.63 2d00 n SER 29 N 3.44 2.81 -3.73 0.00 7.64 -1.26 -3.93 113.62 118.60 2d00 n SER 29 Ca -0.18 -1.83 -0.09 0.00 1.01 0.00 0.00 58.87 57.78 2d00 n SER 29 Cb 0.56 -0.17 -0.03 0.00 -1.01 0.00 0.00 64.21 63.57 2d00 n SER 29 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2d00 s SER 30 N -1.14 -0.32 0.22 6.43 1.04 -1.26 -5.01 113.70 113.66 2d00 s SER 30 Ca 0.26 -0.45 -0.07 0.00 0.48 0.00 0.00 55.95 56.16 2d00 s SER 30 Cb 0.15 0.64 0.19 0.00 0.10 0.00 0.00 66.02 67.10 2d00 s SER 30 CO 0.21 -1.15 1.81 0.00 0.98 0.00 0.00 173.24 175.09 2d00 h ALA 31 N 2.08 1.10 0.00 5.32 0.00 -1.90 -1.21 119.26 124.65 2d00 h ALA 31 Ca -0.26 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.40 2d00 h ALA 31 Cb 1.27 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.71 2d00 h ALA 31 CO 0.32 0.67 -0.39 1.49 0.00 0.00 0.00 179.25 181.33 2d00 h GLU 32 N 1.21 0.00 -0.46 0.00 4.57 -1.95 -1.08 114.58 116.86 2d00 h GLU 32 Ca 0.29 0.00 -0.12 0.00 -1.18 0.00 0.00 59.36 58.35 2d00 h GLU 32 Cb 0.14 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.71 2d00 h GLU 32 CO -0.03 0.39 -0.19 1.49 -1.18 0.00 0.00 179.01 179.49 2d00 h GLU 33 N 0.00 0.92 -0.16 1.92 4.81 -1.81 -1.58 114.58 118.68 2d00 h GLU 33 Ca -0.00 -0.37 -0.00 0.00 -0.13 0.00 0.00 59.36 58.85 2d00 h GLU 33 Cb 1.19 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.52 2d00 h GLU 33 CO 0.05 1.03 0.08 0.00 -0.73 0.00 0.00 179.01 179.44 2d00 h ALA 34 N 0.97 0.20 -0.84 2.92 0.00 -0.98 -2.45 119.26 119.09 2d00 h ALA 34 Ca 0.11 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 2d00 h ALA 34 Cb 0.74 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.43 2d00 h ALA 34 CO 0.06 -0.26 0.52 0.37 0.00 0.00 0.00 179.25 179.95 2d00 h GLN 35 N 0.14 1.13 -0.53 0.00 5.75 -1.18 -1.76 115.11 118.66 2d00 h GLN 35 Ca 0.05 -0.09 0.07 0.00 -0.15 0.00 0.00 58.65 58.54 2d00 h GLN 35 Cb 0.09 -0.24 -0.06 0.00 1.07 0.00 0.00 27.48 28.33 2d00 h GLN 35 CO -0.01 0.78 0.20 1.03 -2.65 0.00 0.00 178.83 178.18 2d00 h SER 36 N 1.16 0.21 -0.23 -0.69 0.87 -1.10 -2.14 113.55 111.64 2d00 h SER 36 Ca 0.30 0.06 -0.11 0.00 -1.23 0.00 0.00 61.79 60.81 2d00 h SER 36 Cb -0.07 0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 61.91 2d00 h SER 36 CO -0.06 0.15 -0.24 -0.07 -0.53 0.00 0.00 176.83 176.08 2d00 h LEU 37 N 0.39 0.71 -0.63 2.23 3.38 -1.17 -0.82 115.31 119.40 2d00 h LEU 37 Ca 0.26 -0.26 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 2d00 h LEU 37 Cb 0.27 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 40.80 2d00 h LEU 37 CO -0.25 0.93 0.22 -0.07 0.09 0.00 0.00 178.44 179.36 2d00 h LEU 38 N 0.61 0.91 -0.66 1.67 3.38 -1.12 -1.25 115.31 118.85 2d00 h LEU 38 Ca 0.08 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 57.85 2d00 h LEU 38 Cb 0.73 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 41.21 2d00 h LEU 38 CO 0.06 0.86 0.38 -0.08 0.09 0.00 0.00 178.44 179.75 2d00 h GLU 39 N 0.91 0.91 -0.57 1.13 4.57 -1.02 0.77 114.58 121.27 2d00 h GLU 39 Ca 0.21 -0.10 -0.01 0.00 -1.18 0.00 0.00 59.36 58.29 2d00 h GLU 39 Cb 0.26 -0.18 -0.03 0.00 -0.16 0.00 0.00 28.75 28.64 2d00 h GLU 39 CO -0.01 0.67 0.33 1.15 -1.18 0.00 0.00 179.01 179.97 2d00 h THR 40 N 0.90 1.18 -0.50 0.32 2.02 -0.64 0.01 112.91 116.19 2d00 h THR 40 Ca 0.24 -0.43 -0.13 0.00 0.77 0.00 0.00 66.41 66.86 2d00 h THR 40 Cb 0.01 0.42 -0.01 0.00 -1.74 0.00 0.00 68.15 66.82 2d00 h THR 40 CO -0.04 0.19 -0.18 -0.07 0.37 0.00 0.00 175.52 175.79 2d00 h LEU 41 N 0.77 1.03 -0.26 2.58 3.38 -1.07 -0.25 115.31 121.48 2d00 h LEU 41 Ca 0.20 -0.38 -0.00 0.00 0.09 0.00 0.00 57.88 57.79 2d00 h LEU 41 Cb 0.01 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.47 2d00 h LEU 41 CO -0.04 1.18 0.16 0.58 0.09 0.00 0.00 178.44 180.41 2d00 h VAL 42 N 0.87 1.09 -0.71 1.22 2.07 -0.64 -2.32 116.25 117.83 2d00 h VAL 42 Ca 0.12 -0.20 -0.06 0.00 0.82 0.00 0.00 66.70 67.39 2d00 h VAL 42 Cb 0.76 0.75 -0.03 0.00 -1.52 0.00 0.00 31.29 31.24 2d00 h VAL 42 CO 0.06 0.09 0.22 -0.08 0.02 0.00 0.00 177.57 177.87 2d00 h GLU 43 N 0.34 1.10 -0.30 1.57 4.57 -0.89 -2.80 114.58 118.17 2d00 h GLU 43 Ca 0.09 -0.23 0.03 0.00 -1.18 0.00 0.00 59.36 58.07 2d00 h GLU 43 Cb -0.00 -0.16 -0.03 0.00 -0.16 0.00 0.00 28.75 28.40 2d00 h GLU 43 CO -0.02 0.94 0.12 0.00 -1.18 0.00 0.00 179.01 178.86 2d00 h ARG 44 N 1.05 0.25 0.00 1.92 3.08 -0.74 -3.48 114.38 116.47 2d00 h ARG 44 Ca 0.23 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.26 2d00 h ARG 44 Cb 0.30 -0.06 0.00 0.00 0.08 0.00 0.00 29.97 30.30 2d00 h ARG 44 CO -0.01 0.16 0.00 0.41 -1.07 0.00 0.00 179.97 179.47 2d00 n GLY 45 N -1.20 0.48 0.11 0.04 0.00 -0.90 -5.02 105.19 98.70 2d00 n GLY 45 Ca -0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.87 2d00 n GLY 45 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2d00 h GLY 46 N 0.00 0.30 -4.88 -0.02 0.00 -1.87 -3.48 103.07 93.12 2d00 h GLY 46 Ca 0.00 -0.71 -0.53 0.00 0.00 0.00 0.00 47.33 46.09 2d00 h GLY 46 CO 0.00 0.62 0.97 -0.19 0.00 0.00 0.00 176.54 177.94 2d00 s TYR 47 N -2.76 2.55 -0.26 5.60 2.02 -1.26 -4.74 117.35 118.50 2d00 s TYR 47 Ca -0.04 0.40 0.18 0.00 -0.37 0.00 0.00 57.07 57.25 2d00 s TYR 47 Cb 0.08 -3.94 0.15 0.00 -0.40 0.00 0.00 41.96 37.85 2d00 s TYR 47 CO 0.87 -3.70 1.47 0.00 -1.57 0.00 0.00 175.55 172.62 2d00 h ALA 48 N 8.04 0.78 -2.33 3.71 0.00 -1.06 -3.48 119.26 124.94 2d00 h ALA 48 Ca -0.42 -0.29 -0.06 0.00 0.00 0.00 0.00 54.91 54.13 2d00 h ALA 48 Cb 1.20 -0.04 -0.23 0.00 0.00 0.00 0.00 17.79 18.73 2d00 h ALA 48 CO 0.92 0.39 -0.07 -1.17 0.00 0.00 0.00 179.25 179.33 2d00 s LEU 49 N -6.31 -0.33 -0.26 0.00 2.96 -1.21 -5.07 118.68 108.46 2d00 s LEU 49 Ca 0.05 1.19 0.01 0.00 -0.22 0.00 0.00 54.13 55.15 2d00 s LEU 49 Cb 0.07 1.96 0.07 0.00 0.50 0.00 0.00 46.19 48.78 2d00 s LEU 49 CO 0.72 -0.21 -0.01 -0.69 -1.32 0.00 0.00 176.35 174.85 2d00 s VAL 50 N 0.75 1.50 -0.15 1.68 1.01 -1.26 -1.12 120.40 122.82 2d00 s VAL 50 Ca -0.04 -1.40 -0.24 0.00 0.00 0.00 0.00 61.98 60.31 2d00 s VAL 50 Cb -0.05 -1.89 -0.02 0.00 0.00 0.00 0.00 36.38 34.42 2d00 s VAL 50 CO -0.06 -0.28 0.75 0.00 0.00 0.00 0.00 175.10 175.52 2d00 s ALA 51 N 1.37 3.47 -0.05 5.51 0.00 0.49 -4.98 121.76 127.57 2d00 s ALA 51 Ca -0.01 -0.01 0.06 0.00 0.00 0.00 0.00 51.96 52.00 2d00 s ALA 51 Cb -0.19 -3.10 -0.01 0.00 0.00 0.00 0.00 23.12 19.83 2d00 s ALA 51 CO -0.10 -0.48 -0.23 0.08 0.00 0.00 0.00 175.76 175.03 2d00 s VAL 52 N 1.73 1.92 0.14 0.00 1.01 -1.26 -0.55 120.40 123.38 2d00 s VAL 52 Ca 0.36 -0.99 -0.31 0.00 0.00 0.00 0.00 61.98 61.03 2d00 s VAL 52 Cb -0.17 -1.63 -0.11 0.00 0.00 0.00 0.00 36.38 34.48 2d00 s VAL 52 CO 0.14 0.54 1.81 -0.62 0.00 0.00 0.00 175.10 176.97 2d00 s ASP 53 N -0.14 6.41 0.47 3.32 -1.08 -0.43 -4.84 116.67 120.38 2d00 s ASP 53 Ca -0.03 2.79 0.31 0.00 -0.52 0.00 0.00 52.55 55.10 2d00 s ASP 53 Cb -0.13 -2.57 1.41 0.00 -1.46 0.00 0.00 42.92 40.16 2d00 s ASP 53 CO 0.03 -1.00 1.72 -0.33 0.52 0.00 0.00 175.17 176.11 2d00 h GLU 54 N 8.25 0.14 0.00 4.34 5.08 -1.92 -1.57 114.58 128.89 2d00 h GLU 54 Ca -0.45 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 57.90 2d00 h GLU 54 Cb 1.21 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 30.43 2d00 h GLU 54 CO 0.95 0.09 0.00 0.00 -1.00 0.00 0.00 179.01 179.05 2d00 h ALA 55 N 1.48 1.00 -0.61 3.43 0.00 -2.00 -2.54 119.26 120.02 2d00 h ALA 55 Ca 0.68 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.59 2d00 h ALA 55 Cb 2.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 20.08 2d00 h ALA 55 CO -0.20 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.33 2d00 n LEU 56 N -2.98 3.68 -3.39 0.00 4.77 -0.59 -4.76 117.00 113.73 2d00 n LEU 56 Ca -0.01 -1.92 -0.27 0.00 -0.03 0.00 0.00 56.01 53.79 2d00 n LEU 56 Cb 0.19 -0.40 -0.10 0.00 -2.33 0.00 0.00 43.42 40.78 2d00 n LEU 56 CO 0.23 0.90 -0.31 -0.11 -1.33 0.00 0.00 177.39 176.77 2d00 n LEU 57 N 1.41 -0.32 -0.34 2.23 7.94 -0.96 -4.35 117.00 122.61 2d00 n LEU 57 Ca 0.21 -4.43 0.06 0.00 -1.11 0.00 0.00 56.01 50.75 2d00 n LEU 57 Cb 0.58 0.51 0.22 0.00 0.53 0.00 0.00 43.42 45.26 2d00 n LEU 57 CO 0.15 1.87 1.20 -0.65 -1.11 0.00 0.00 177.39 178.85 2d00 h PRO 58 N 5.49 0.89 -2.17 1.96 0.11 -1.86 -3.39 132.00 133.03 2d00 h PRO 58 Ca 0.25 -0.05 -0.36 0.00 0.11 0.00 0.00 66.00 65.95 2d00 h PRO 58 Cb 0.90 -0.20 -0.33 0.00 0.11 0.00 0.00 31.00 31.48 2d00 h PRO 58 CO 0.39 0.59 -0.66 0.34 -0.21 0.00 0.00 178.00 178.45 2d00 s ASP 59 N -5.65 1.76 0.49 -2.05 -1.08 -1.26 -5.06 116.67 103.83 2d00 s ASP 59 Ca -0.12 -0.98 0.21 0.00 -0.52 0.00 0.00 52.55 51.15 2d00 s ASP 59 Cb 0.21 0.43 1.26 0.00 -1.46 0.00 0.00 42.92 43.37 2d00 s ASP 59 CO 0.80 -0.37 2.05 -0.65 0.52 0.00 0.00 175.17 177.52 2d00 h PRO 60 N 8.03 0.00 -0.00 4.34 0.11 -2.00 -1.60 132.00 140.88 2d00 h PRO 60 Ca -0.10 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 65.83 2d00 h PRO 60 Cb 1.06 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.16 2d00 h PRO 60 CO 0.32 0.14 -0.81 0.93 -0.21 0.00 0.00 178.00 178.37 2d00 h GLU 61 N 0.00 0.10 -0.70 1.05 5.08 -1.98 -1.98 114.58 116.15 2d00 h GLU 61 Ca -0.00 -0.10 -0.04 0.00 -1.00 0.00 0.00 59.36 58.22 2d00 h GLU 61 Cb 0.30 0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.55 2d00 h GLU 61 CO 0.02 0.85 0.28 -0.09 -1.00 0.00 0.00 179.01 179.07 2d00 h ARG 62 N 0.06 1.03 -0.31 2.33 2.43 -1.93 -1.54 114.38 116.44 2d00 h ARG 62 Ca -0.02 -0.17 -0.00 0.00 -0.81 0.00 0.00 59.98 58.98 2d00 h ARG 62 Cb 1.42 -0.17 -0.02 0.00 -0.42 0.00 0.00 29.97 30.78 2d00 h ARG 62 CO 0.11 0.83 0.20 0.00 -1.51 0.00 0.00 179.97 179.60 2d00 h ALA 63 N 1.30 0.40 -0.58 2.80 0.00 -0.98 0.67 119.26 122.87 2d00 h ALA 63 Ca 0.24 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.06 2d00 h ALA 63 Cb 0.19 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 2d00 h ALA 63 CO -0.02 -0.11 0.19 0.28 0.00 0.00 0.00 179.25 179.59 2d00 h VAL 64 N 0.41 1.24 -0.65 0.00 2.07 -1.40 -2.06 116.25 115.85 2d00 h VAL 64 Ca 0.11 -0.78 -0.05 0.00 0.82 0.00 0.00 66.70 66.80 2d00 h VAL 64 Cb -0.01 0.66 -0.03 0.00 -1.52 0.00 0.00 31.29 30.40 2d00 h VAL 64 CO -0.02 0.30 0.20 -0.08 0.02 0.00 0.00 177.57 177.98 2d00 h GLU 65 N 0.80 1.01 -0.75 1.57 4.81 -0.92 -1.16 114.58 119.95 2d00 h GLU 65 Ca 0.19 -0.22 -0.02 0.00 -0.13 0.00 0.00 59.36 59.18 2d00 h GLU 65 Cb 0.26 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.46 2d00 h GLU 65 CO -0.01 0.89 0.40 0.00 -0.73 0.00 0.00 179.01 179.56 2d00 h ARG 66 N 0.94 1.05 -0.61 1.92 3.08 -0.75 -0.93 114.38 119.07 2d00 h ARG 66 Ca 0.21 -0.13 0.10 0.00 0.07 0.00 0.00 59.98 60.23 2d00 h ARG 66 Cb 0.30 -0.20 -0.07 0.00 0.08 0.00 0.00 29.97 30.08 2d00 h ARG 66 CO -0.01 0.79 0.21 -0.07 -1.07 0.00 0.00 179.97 179.82 2d00 h LEU 67 N 1.03 0.19 0.05 3.04 3.38 -0.99 -2.69 115.31 119.32 2d00 h LEU 67 Ca 0.26 0.08 -0.28 0.00 0.09 0.00 0.00 57.88 58.04 2d00 h LEU 67 Cb 0.05 0.08 0.02 0.00 0.09 0.00 0.00 40.66 40.90 2d00 h LEU 67 CO -0.04 0.11 -1.16 0.24 0.09 0.00 0.00 178.44 177.68 2d00 h MET 68 N 0.38 0.56 -0.38 1.13 2.86 -1.06 -3.40 114.93 115.02 2d00 h MET 68 Ca 0.31 -0.72 -0.29 0.00 -2.06 0.00 0.00 59.70 56.94 2d00 h MET 68 Cb 0.40 0.23 -0.30 0.00 0.06 0.00 0.00 31.60 31.99 2d00 h MET 68 CO -0.32 1.31 -0.81 -2.13 1.06 0.00 0.00 176.91 176.01 2d00 n ARG 69 N -3.77 2.24 0.00 1.72 0.63 -0.37 -4.69 116.66 112.43 2d00 n ARG 69 Ca -0.11 -3.53 0.00 0.00 -0.92 0.00 0.00 57.85 53.28 2d00 n ARG 69 Cb 0.95 -1.68 0.00 0.00 0.45 0.00 0.00 32.46 32.17 2d00 n ARG 69 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2d00 n GLY 70 N -0.66 0.00 3.71 5.14 0.00 -1.02 -4.82 105.19 107.54 2d00 n GLY 70 Ca 0.25 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.93 2d00 n GLY 70 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2d00 s ARG 71 N -0.44 1.85 -0.19 1.61 1.70 -1.26 -4.91 118.95 117.30 2d00 s ARG 71 Ca 0.00 1.82 -0.29 0.00 -0.47 0.00 0.00 55.73 56.78 2d00 s ARG 71 Cb 0.00 -1.79 -0.00 0.00 -0.57 0.00 0.00 34.95 32.58 2d00 s ARG 71 CO 0.00 -2.07 1.14 -0.51 -1.08 0.00 0.00 175.30 172.78 2d00 s ASP 72 N -2.00 7.04 0.15 -2.89 1.01 -1.26 -5.02 116.67 113.70 2d00 s ASP 72 Ca 0.75 1.54 -0.10 0.00 0.71 0.00 0.00 52.55 55.44 2d00 s ASP 72 Cb -0.30 -2.54 -0.06 0.00 1.01 0.00 0.00 42.92 41.02 2d00 s ASP 72 CO 0.48 -0.69 0.48 -0.76 0.21 0.00 0.00 175.17 174.89 2d00 s LEU 73 N 3.22 4.29 0.04 1.23 1.43 -1.26 -5.08 118.68 122.55 2d00 s LEU 73 Ca 0.49 0.88 -0.36 0.00 -1.03 0.00 0.00 54.13 54.11 2d00 s LEU 73 Cb -0.18 -3.29 -0.15 0.00 0.03 0.00 0.00 46.19 42.59 2d00 s LEU 73 CO 0.11 0.07 1.50 -2.65 0.23 0.00 0.00 176.35 175.61 2d00 n PRO 74 N 0.49 1.48 -1.66 1.29 -0.02 -1.26 -5.02 135.00 130.31 2d00 n PRO 74 Ca -0.04 0.54 -0.38 0.00 -2.02 0.00 0.00 63.50 61.60 2d00 n PRO 74 Cb 0.52 -2.23 0.05 0.00 -0.02 0.00 0.00 33.50 31.82 2d00 n PRO 74 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2d00 n VAL 75 N 3.22 3.84 -3.96 -1.45 0.31 -1.26 -4.99 118.33 114.04 2d00 n VAL 75 Ca 0.19 -0.50 -0.29 0.00 -0.01 0.00 0.00 64.34 63.73 2d00 n VAL 75 Cb 0.22 -1.30 -0.16 0.00 -0.91 0.00 0.00 33.84 31.68 2d00 n VAL 75 CO 0.00 0.00 0.00 -0.22 -1.32 0.00 0.00 176.83 175.29 2d00 s LEU 76 N -2.54 1.82 -0.33 7.52 2.96 -1.26 -5.09 118.68 121.76 2d00 s LEU 76 Ca 0.75 -0.67 0.02 0.00 -0.22 0.00 0.00 54.13 54.02 2d00 s LEU 76 Cb -0.42 -1.08 0.10 0.00 0.50 0.00 0.00 46.19 45.29 2d00 s LEU 76 CO 0.47 -0.13 0.07 -0.22 -1.32 0.00 0.00 176.35 175.21 2d00 s LEU 77 N 1.52 3.82 0.16 -0.68 2.96 -1.26 -5.09 118.68 120.11 2d00 s LEU 77 Ca 0.01 -1.97 -0.31 0.00 -0.22 0.00 0.00 54.13 51.65 2d00 s LEU 77 Cb -0.15 -1.34 -0.09 0.00 0.50 0.00 0.00 46.19 45.11 2d00 s LEU 77 CO -0.09 -0.39 1.43 -2.16 -1.32 0.00 0.00 176.35 173.82 2d00 s PRO 78 N 1.16 4.30 -0.03 0.98 0.04 -1.26 -5.02 135.00 135.18 2d00 s PRO 78 Ca 0.11 2.18 0.05 0.00 0.04 0.00 0.00 61.00 63.37 2d00 s PRO 78 Cb -0.18 -3.20 -0.01 0.00 0.04 0.00 0.00 34.50 31.15 2d00 s PRO 78 CO -0.14 -0.45 -0.16 0.42 0.04 0.00 0.00 177.00 176.71 2d00 s ILE 79 N 0.80 1.31 -0.11 0.56 -1.09 -1.26 -5.12 121.20 116.29 2d00 s ILE 79 Ca 0.64 -0.68 -0.21 0.00 -2.23 0.00 0.00 60.65 58.17 2d00 s ILE 79 Cb -0.39 -1.12 -0.04 0.00 -1.58 0.00 0.00 42.46 39.34 2d00 s ILE 79 CO 0.34 0.38 0.58 0.00 -1.23 0.00 0.00 174.94 175.01 2d00 s ALA 80 N -0.15 3.43 -0.37 9.38 0.00 -1.26 -4.54 121.76 128.24 2d00 s ALA 80 Ca 0.01 -0.08 -0.01 0.00 0.00 0.00 0.00 51.96 51.89 2d00 s ALA 80 Cb -0.09 -2.81 0.00 0.00 0.00 0.00 0.00 23.12 20.22 2d00 s ALA 80 CO 0.01 -0.12 0.31 0.41 0.00 0.00 0.00 175.76 176.37 2d00 n GLY 81 N 3.28 0.27 0.20 0.00 0.00 -1.26 -4.97 105.19 102.72 2d00 n GLY 81 Ca -0.04 -0.33 0.01 0.00 0.00 0.00 0.00 46.02 45.67 2d00 n GLY 81 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2d00 h LEU 82 N -0.63 0.13 -1.71 0.99 3.38 -2.04 -2.87 115.31 112.57 2d00 h LEU 82 Ca -0.18 -0.04 0.16 0.00 0.09 0.00 0.00 57.88 57.91 2d00 h LEU 82 Cb 1.10 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 41.77 2d00 h LEU 82 CO 0.15 0.45 0.49 0.11 0.09 0.00 0.00 178.44 179.74 2d00 h LYS 83 N 0.12 0.27 0.00 1.13 1.57 -1.97 -1.99 116.57 115.70 2d00 h LYS 83 Ca 0.02 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2d00 h LYS 83 Cb 0.62 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.87 2d00 h LYS 83 CO 0.04 0.18 0.00 0.39 -0.57 0.00 0.00 179.45 179.50 2d00 n GLU 84 N -4.44 0.31 0.00 3.15 1.02 -1.08 -2.96 120.64 116.64 2d00 n GLU 84 Ca 0.14 0.09 0.14 0.00 -0.02 0.00 0.00 57.16 57.51 2d00 n GLU 84 Cb 0.60 -1.50 0.70 0.00 -0.02 0.00 0.00 31.44 31.21 2d00 n GLU 84 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2d00 n ALA 85 N -1.27 2.40 -0.11 0.62 0.00 -0.75 -3.35 120.51 118.05 2d00 n ALA 85 Ca 0.10 -0.12 -0.15 0.00 0.00 0.00 0.00 53.44 53.27 2d00 n ALA 85 Cb 0.16 -1.47 -0.12 0.00 0.00 0.00 0.00 19.45 18.01 2d00 n ALA 85 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2d00 n PHE 86 N -1.36 0.00 1.39 0.00 0.99 -1.15 -3.74 117.46 113.58 2d00 n PHE 86 Ca 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.56 2d00 n PHE 86 Cb 0.27 -0.94 0.00 0.00 -1.00 0.00 0.00 39.48 37.81 2d00 n PHE 86 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2d00 n GLN 87 N -3.06 0.71 0.00 -1.08 10.64 -1.21 -3.92 117.38 119.46 2d00 n GLN 87 Ca -0.40 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 54.77 2d00 n GLN 87 Cb 1.01 -1.02 0.00 0.00 -0.86 0.00 0.00 30.24 29.37 2d00 n GLN 87 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2d00 n GLY 88 N 0.21 0.92 0.21 2.61 0.00 -1.23 -5.08 105.19 102.82 2d00 n GLY 88 Ca 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.49 2d00 n GLY 88 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2d00 n HIS 89 N 0.00 0.00 -2.82 1.61 8.25 -1.25 -5.01 115.22 115.99 2d00 n HIS 89 Ca 0.00 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.35 2d00 n HIS 89 Cb 0.00 0.12 0.05 0.00 1.12 0.00 0.00 29.99 31.29 2d00 n HIS 89 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 2d00 n ASP 90 N 0.00 -1.93 -0.30 0.41 2.03 -1.26 -5.02 116.55 110.47 2d00 n ASP 90 Ca 0.00 -3.46 0.12 0.00 0.52 0.00 0.00 54.79 51.98 2d00 n ASP 90 Cb 0.53 1.43 0.27 0.00 -0.72 0.00 0.00 41.12 42.63 2d00 n ASP 90 CO 0.00 0.00 0.00 0.58 -1.92 0.00 0.00 177.20 175.86 2d00 h VAL 91 N 2.68 0.25 -0.87 5.18 2.07 -1.92 -0.45 116.25 123.18 2d00 h VAL 91 Ca -0.08 -0.05 0.11 0.00 0.82 0.00 0.00 66.70 67.51 2d00 h VAL 91 Cb 1.05 0.10 -0.06 0.00 -1.52 0.00 0.00 31.29 30.85 2d00 h VAL 91 CO 0.25 0.03 0.56 1.05 0.02 0.00 0.00 177.57 179.48 2d00 h GLU 92 N 0.14 0.78 0.05 1.57 4.11 -1.96 0.30 114.58 119.57 2d00 h GLU 92 Ca 0.54 -0.05 -0.36 0.00 0.07 0.00 0.00 59.36 59.57 2d00 h GLU 92 Cb 1.10 -0.18 -0.05 0.00 0.50 0.00 0.00 28.75 30.12 2d00 h GLU 92 CO -0.72 0.51 -2.14 0.41 0.07 0.00 0.00 179.01 177.15 2d00 n GLY 93 N -1.42 -0.66 0.41 1.06 0.00 -0.28 -2.32 105.19 101.98 2d00 n GLY 93 Ca 0.15 -0.21 0.21 0.00 0.00 0.00 0.00 46.02 46.17 2d00 n GLY 93 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2d00 h TYR 94 N 0.03 0.43 0.12 1.61 3.20 -1.15 -0.65 116.97 120.56 2d00 h TYR 94 Ca -0.46 0.01 -0.29 0.00 3.14 0.00 0.00 58.73 61.14 2d00 h TYR 94 Cb 2.03 -0.13 0.03 0.00 1.54 0.00 0.00 36.73 40.20 2d00 h TYR 94 CO 0.04 0.11 -1.20 1.98 -1.64 0.00 0.00 178.16 177.45 2d00 h MET 95 N 0.32 0.60 -0.68 1.82 4.05 -0.95 -1.58 114.93 118.51 2d00 h MET 95 Ca 0.45 -0.81 0.08 0.00 -0.28 0.00 0.00 59.70 59.15 2d00 h MET 95 Cb 1.25 0.27 -0.06 0.00 -0.80 0.00 0.00 31.60 32.25 2d00 h MET 95 CO -0.14 1.37 0.35 -0.09 0.23 0.00 0.00 176.91 178.62 2d00 h ARG 96 N 0.22 0.60 -0.27 0.39 2.43 -1.06 -2.02 114.38 114.68 2d00 h ARG 96 Ca -0.18 -0.04 -0.14 0.00 -0.81 0.00 0.00 59.98 58.81 2d00 h ARG 96 Cb 1.88 -0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 31.29 2d00 h ARG 96 CO 0.23 0.40 -0.36 1.49 -1.51 0.00 0.00 179.97 180.22 2d00 h GLU 97 N 0.62 0.72 -0.25 0.20 4.57 -1.13 -1.18 114.58 118.14 2d00 h GLU 97 Ca 0.33 -0.41 -0.06 0.00 -1.18 0.00 0.00 59.36 58.04 2d00 h GLU 97 Cb 0.29 0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.90 2d00 h GLU 97 CO -0.24 1.04 -0.09 1.25 -1.18 0.00 0.00 179.01 179.79 2d00 h LEU 98 N 0.46 0.38 0.23 1.64 6.46 -1.02 0.59 115.31 124.06 2d00 h LEU 98 Ca 0.03 -0.08 -0.31 0.00 -0.12 0.00 0.00 57.88 57.40 2d00 h LEU 98 Cb 0.94 -0.10 0.04 0.00 -0.73 0.00 0.00 40.66 40.81 2d00 h LEU 98 CO 0.08 0.51 -1.35 0.58 -0.62 0.00 0.00 178.44 177.64 2d00 h VAL 99 N 0.38 1.32 -0.51 1.05 2.07 -1.36 -2.34 116.25 116.87 2d00 h VAL 99 Ca 0.08 -2.66 0.04 0.00 0.82 0.00 0.00 66.70 64.98 2d00 h VAL 99 Cb 0.39 3.07 -0.04 0.00 -1.52 0.00 0.00 31.29 33.19 2d00 h VAL 99 CO 0.02 0.79 0.26 -0.09 0.02 0.00 0.00 177.57 178.57 2d00 h ARG 100 N 0.06 0.50 -0.66 1.57 2.43 -1.09 -2.09 114.38 115.09 2d00 h ARG 100 Ca -0.24 -0.03 0.14 0.00 -0.81 0.00 0.00 59.98 59.05 2d00 h ARG 100 Cb 2.07 -0.11 -0.11 0.00 -0.42 0.00 0.00 29.97 31.39 2d00 h ARG 100 CO 0.25 0.33 -0.02 -0.22 -1.51 0.00 0.00 179.97 178.81 2d00 h LYS 101 N 0.51 0.10 0.00 0.20 3.64 0.33 0.38 116.57 121.73 2d00 h LYS 101 Ca 0.22 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.60 2d00 h LYS 101 Cb 0.12 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 2d00 h LYS 101 CO -0.15 0.06 0.00 2.41 -2.27 0.00 0.00 179.45 179.50 2d00 n THR 102 N -5.32 0.00 0.22 1.00 -1.04 -0.89 -4.35 114.28 103.89 2d00 n THR 102 Ca 0.10 0.34 0.07 0.00 -2.04 0.00 0.00 64.05 62.51 2d00 n THR 102 Cb 0.39 -0.71 0.50 0.00 -1.82 0.00 0.00 70.33 68.69 2d00 n THR 102 CO 0.00 0.00 0.00 0.16 -0.64 0.00 0.00 175.07 174.59 2d00 h ILE 103 N 0.00 0.98 -2.96 12.58 3.07 -1.40 -3.48 117.51 126.29 2d00 h ILE 103 Ca 0.00 -0.93 0.00 0.00 1.55 0.00 0.00 64.86 65.48 2d00 h ILE 103 Cb 0.00 1.53 -0.01 0.00 -0.27 0.00 0.00 36.82 38.07 2d00 h ILE 103 CO 0.00 0.25 -0.26 0.61 -1.05 0.00 0.00 178.15 177.70 2d00 n GLY 104 N -0.57 -3.41 0.00 0.16 0.00 0.13 -5.08 105.19 96.42 2d00 n GLY 104 Ca -0.02 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.80 2d00 n GLY 104 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2d00 n PHE 105 N 0.35 0.00 -2.41 1.61 7.35 -1.25 -5.01 117.46 118.10 2d00 n PHE 105 Ca -0.04 0.00 -0.38 0.00 -0.76 0.00 0.00 57.45 56.27 2d00 n PHE 105 Cb 0.07 0.00 -0.02 0.00 0.35 0.00 0.00 39.48 39.87 2d00 n PHE 105 CO 0.00 0.00 0.00 0.34 -0.76 0.00 0.00 176.76 176.34 2d00 s ASP 106 N 0.00 6.23 0.42 -2.13 2.15 -1.26 -3.77 116.67 118.31 2d00 s ASP 106 Ca 0.00 -2.05 -0.25 0.00 0.43 0.00 0.00 52.55 50.68 2d00 s ASP 106 Cb 0.00 -2.58 -0.08 0.00 -0.30 0.00 0.00 42.92 39.96 2d00 s ASP 106 CO 0.00 -1.80 1.20 0.27 -0.17 0.00 0.00 175.17 174.67 2d00 s ILE 107 N 6.43 2.98 -1.21 4.11 -4.36 -1.26 -4.89 121.20 123.00 2d00 s ILE 107 Ca 0.58 0.82 -0.20 0.00 -0.26 0.00 0.00 60.65 61.58 2d00 s ILE 107 Cb 0.02 -3.45 -0.03 0.00 1.25 0.00 0.00 42.46 40.25 2d00 s ILE 107 CO 0.07 0.06 1.88 0.29 0.24 0.00 0.00 174.94 177.48 2d00 n LYS 108 N -0.07 2.28 0.00 0.37 4.76 -1.26 -5.03 118.16 119.21 2d00 n LYS 108 Ca 0.05 -2.74 0.15 0.00 -2.87 0.00 0.00 58.31 52.90 2d00 n LYS 108 Cb 0.46 -3.55 0.77 0.00 -1.84 0.00 0.00 35.03 30.88 2d00 n LYS 108 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31