#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1of6 s ALA 19 N 0.00 3.07 -0.49 4.61 0.00 -1.26 -5.00 121.76 122.69 1of6 s ALA 19 Ca 0.00 1.00 -0.12 0.00 0.00 0.00 0.00 51.96 52.84 1of6 s ALA 19 Cb 0.00 -3.40 0.12 0.00 0.00 0.00 0.00 23.12 19.83 1of6 s ALA 19 CO 0.00 -0.66 0.40 -2.00 0.00 0.00 0.00 175.76 173.50 1of6 s GLU 20 N -2.49 2.71 0.11 0.00 2.12 -1.26 -5.06 118.70 114.83 1of6 s GLU 20 Ca 0.61 -1.69 0.01 0.00 0.36 0.00 0.00 54.97 54.26 1of6 s GLU 20 Cb -0.31 -4.06 -0.04 0.00 0.26 0.00 0.00 34.13 29.97 1of6 s GLU 20 CO 0.39 -1.21 -0.03 -1.21 -0.54 0.00 0.00 175.26 172.66 1of6 s GLU 21 N 1.47 0.87 -1.77 4.30 2.02 -1.26 -4.90 118.70 119.42 1of6 s GLU 21 Ca 0.04 -1.37 0.00 0.00 0.02 0.00 0.00 54.97 53.66 1of6 s GLU 21 Cb -0.27 -0.07 0.00 0.00 0.10 0.00 0.00 34.13 33.89 1of6 s GLU 21 CO 0.01 -0.10 0.00 -0.25 0.02 0.00 0.00 175.26 174.95 1of6 n ASP 22 N -0.07 -5.56 0.08 -0.19 9.92 -1.26 -4.85 116.55 114.63 1of6 n ASP 22 Ca -0.10 0.10 0.12 0.00 -0.53 0.00 0.00 54.79 54.38 1of6 n ASP 22 Cb 0.62 -4.64 0.46 0.00 -0.64 0.00 0.00 41.12 36.91 1of6 n ASP 22 CO 0.00 0.00 0.00 1.33 0.13 0.00 0.00 177.20 178.66 1of6 n VAL 23 N -3.64 0.61 -1.12 2.53 0.24 -1.26 -2.52 118.33 113.18 1of6 n VAL 23 Ca -0.22 -0.03 0.09 0.00 -2.04 0.00 0.00 64.34 62.14 1of6 n VAL 23 Cb 0.67 -0.79 0.13 0.00 -1.47 0.00 0.00 33.84 32.38 1of6 n VAL 23 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1of6 n ARG 24 N -2.05 1.21 -3.66 7.34 1.74 -1.26 -4.95 116.66 115.02 1of6 n ARG 24 Ca 0.05 -2.46 -0.38 0.00 -0.77 0.00 0.00 57.85 54.28 1of6 n ARG 24 Cb 0.33 -1.43 -0.12 0.00 -1.02 0.00 0.00 32.46 30.22 1of6 n ARG 24 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1of6 s ILE 25 N -2.67 4.75 0.17 0.55 -1.09 -1.05 -4.96 121.20 116.90 1of6 s ILE 25 Ca 0.30 -0.16 0.03 0.00 -2.23 0.00 0.00 60.65 58.59 1of6 s ILE 25 Cb 0.26 -3.31 -0.14 0.00 -1.58 0.00 0.00 42.46 37.69 1of6 s ILE 25 CO 0.03 0.20 1.40 -0.07 -1.23 0.00 0.00 174.94 175.27 1of6 h LEU 26 N 8.33 0.22 0.00 2.97 3.38 -1.93 -3.49 115.31 124.79 1of6 h LEU 26 Ca -0.35 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.45 1of6 h LEU 26 Cb 1.17 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.85 1of6 h LEU 26 CO 0.59 0.97 0.00 0.61 0.09 0.00 0.00 178.44 180.70 1of6 n GLY 27 N 0.83 0.66 3.23 0.83 0.00 -1.26 -5.11 105.19 104.37 1of6 n GLY 27 Ca -0.03 -0.94 -0.35 0.00 0.00 0.00 0.00 46.02 44.70 1of6 n GLY 27 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1of6 s TYR 28 N -2.00 3.13 0.07 1.61 2.02 -1.26 -5.10 117.35 115.82 1of6 s TYR 28 Ca 0.00 -1.48 -0.07 0.00 -0.37 0.00 0.00 57.07 55.16 1of6 s TYR 28 Cb 0.00 -2.12 -0.05 0.00 -0.40 0.00 0.00 41.96 39.39 1of6 s TYR 28 CO 0.00 -0.71 0.34 -0.51 -1.57 0.00 0.00 175.55 173.10 1of6 s ASP 29 N 1.35 6.53 0.43 2.29 1.01 -1.26 -5.06 116.67 121.97 1of6 s ASP 29 Ca -0.00 0.62 -0.24 0.00 0.71 0.00 0.00 52.55 53.64 1of6 s ASP 29 Cb -0.17 -2.11 -0.08 0.00 1.01 0.00 0.00 42.92 41.57 1of6 s ASP 29 CO -0.02 0.16 1.19 -2.16 0.21 0.00 0.00 175.17 174.55 1of6 s PRO 30 N -2.12 3.88 -0.10 8.23 0.04 -1.26 -5.02 135.00 138.65 1of6 s PRO 30 Ca 0.34 1.86 0.02 0.00 0.04 0.00 0.00 61.00 63.26 1of6 s PRO 30 Cb -0.13 -2.55 0.01 0.00 0.04 0.00 0.00 34.50 31.87 1of6 s PRO 30 CO 0.20 -0.48 -0.16 -1.17 0.04 0.00 0.00 177.00 175.43 1of6 s LEU 31 N -2.76 1.77 0.38 -3.56 2.96 -1.26 -4.90 118.68 111.31 1of6 s LEU 31 Ca 0.60 -0.43 -0.27 0.00 -0.22 0.00 0.00 54.13 53.82 1of6 s LEU 31 Cb -0.31 -1.10 -0.10 0.00 0.50 0.00 0.00 46.19 45.19 1of6 s LEU 31 CO 0.38 0.04 1.34 0.00 -1.32 0.00 0.00 176.35 176.79 1of6 s ALA 32 N 0.83 3.39 0.64 5.97 0.00 -1.26 -4.99 121.76 126.34 1of6 s ALA 32 Ca -0.10 1.31 -0.11 0.00 0.00 0.00 0.00 51.96 53.06 1of6 s ALA 32 Cb -0.16 -3.51 -0.03 0.00 0.00 0.00 0.00 23.12 19.43 1of6 s ALA 32 CO 0.01 -0.82 1.04 -1.54 0.00 0.00 0.00 175.76 174.45 1of6 s SER 33 N -0.55 6.03 0.28 0.00 1.04 -1.26 -4.86 113.70 114.38 1of6 s SER 33 Ca 0.54 1.33 -0.04 0.00 0.48 0.00 0.00 55.95 58.26 1of6 s SER 33 Cb -0.40 -2.32 0.37 0.00 0.10 0.00 0.00 66.02 63.76 1of6 s SER 33 CO 0.53 -0.98 1.94 -0.65 0.98 0.00 0.00 173.24 175.06 1of6 h PRO 34 N -0.38 1.19 -0.74 4.02 0.11 -1.82 -2.49 132.00 131.89 1of6 h PRO 34 Ca -0.44 -0.07 -0.03 0.00 0.11 0.00 0.00 66.00 65.56 1of6 h PRO 34 Cb 1.21 -0.27 -0.03 0.00 0.11 0.00 0.00 31.00 32.01 1of6 h PRO 34 CO 0.62 0.79 0.33 0.00 -0.21 0.00 0.00 178.00 179.53 1of6 h ALA 35 N 1.43 1.17 -0.49 -0.75 0.00 -1.38 -0.09 119.26 119.17 1of6 h ALA 35 Ca 0.35 -0.17 -0.13 0.00 0.00 0.00 0.00 54.91 54.96 1of6 h ALA 35 Cb -0.10 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.38 1of6 h ALA 35 CO -0.08 0.61 -0.19 1.25 0.00 0.00 0.00 179.25 180.84 1of6 h LEU 36 N 1.07 1.01 -0.54 0.00 5.85 -1.71 -2.43 115.31 118.56 1of6 h LEU 36 Ca 0.25 -0.37 -0.16 0.00 0.84 0.00 0.00 57.88 58.44 1of6 h LEU 36 Cb 0.15 -0.28 -0.01 0.00 0.37 0.00 0.00 40.66 40.90 1of6 h LEU 36 CO -0.03 1.16 -0.63 -0.07 -0.34 0.00 0.00 178.44 178.53 1of6 h LEU 37 N 0.86 0.43 -1.67 2.25 -0.00 -1.10 -1.33 115.31 114.74 1of6 h LEU 37 Ca 0.12 -0.25 -0.04 0.00 -0.00 0.00 0.00 57.88 57.71 1of6 h LEU 37 Cb 0.76 -0.13 -0.01 0.00 -0.00 0.00 0.00 40.66 41.29 1of6 h LEU 37 CO 0.06 0.95 -0.18 1.56 -0.00 0.00 0.00 178.44 180.84 1of6 h GLN 38 N 0.28 0.00 0.01 1.13 4.20 -0.87 -1.14 115.11 118.71 1of6 h GLN 38 Ca -0.01 0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.69 1of6 h GLN 38 Cb 1.17 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.95 1of6 h GLN 38 CO 0.11 0.18 -0.04 0.28 -0.67 0.00 0.00 178.83 178.68 1of6 h VAL 39 N 0.00 1.77 0.00 -0.54 2.07 -1.35 -3.29 116.25 114.91 1of6 h VAL 39 Ca -0.00 -2.31 -0.01 0.00 0.82 0.00 0.00 66.70 65.20 1of6 h VAL 39 Cb 0.45 3.33 -0.00 0.00 -1.52 0.00 0.00 31.29 33.55 1of6 h VAL 39 CO 0.02 0.60 -0.07 1.56 0.02 0.00 0.00 177.57 179.70 1of6 h GLN 40 N -0.94 0.00 -2.37 1.57 4.20 -1.15 -3.32 115.11 113.09 1of6 h GLN 40 Ca -0.01 0.00 -0.59 0.00 0.06 0.00 0.00 58.65 58.11 1of6 h GLN 40 Cb 1.01 0.00 -0.39 0.00 0.30 0.00 0.00 27.48 28.40 1of6 h GLN 40 CO 0.01 0.07 -0.95 -0.89 -0.67 0.00 0.00 178.83 176.40 1of6 n ILE 41 N -3.82 -0.80 -2.57 2.54 5.41 -0.44 -5.08 119.36 114.61 1of6 n ILE 41 Ca -0.02 -3.69 -0.34 0.00 1.00 0.00 0.00 62.75 59.70 1of6 n ILE 41 Cb 0.17 -1.76 -0.04 0.00 -0.71 0.00 0.00 39.64 37.30 1of6 n ILE 41 CO 0.00 0.00 0.00 -2.84 0.00 0.00 0.00 176.55 173.71 1of6 s PRO 42 N -0.33 3.87 0.18 0.38 0.02 -1.24 -4.68 135.00 133.20 1of6 s PRO 42 Ca 0.33 1.36 -0.30 0.00 0.02 0.00 0.00 61.00 62.41 1of6 s PRO 42 Cb 0.05 -2.14 -0.08 0.00 0.02 0.00 0.00 34.50 32.36 1of6 s PRO 42 CO -0.18 -0.37 1.02 0.00 -0.33 0.00 0.00 177.00 177.13 1of6 s ALA 43 N -1.96 3.33 0.62 -1.55 0.00 -1.26 -5.02 121.76 115.91 1of6 s ALA 43 Ca 0.66 0.70 -0.14 0.00 0.00 0.00 0.00 51.96 53.18 1of6 s ALA 43 Cb -0.16 -3.29 -0.03 0.00 0.00 0.00 0.00 23.12 19.64 1of6 s ALA 43 CO 0.20 -0.05 1.05 0.95 0.00 0.00 0.00 175.76 177.91 1of6 s THR 44 N -0.48 4.00 0.26 0.00 -4.23 -1.26 -4.90 115.64 109.04 1of6 s THR 44 Ca 0.46 0.84 -0.01 0.00 -1.18 0.00 0.00 61.69 61.80 1of6 s THR 44 Cb -0.27 -3.45 0.25 0.00 1.34 0.00 0.00 72.50 70.37 1of6 s THR 44 CO 0.33 -0.67 1.71 -0.65 -0.54 0.00 0.00 174.62 174.80 1of6 h PRO 45 N 0.09 0.38 -0.41 3.99 0.11 -2.00 -1.49 132.00 132.67 1of6 h PRO 45 Ca -0.46 -0.02 0.06 0.00 0.11 0.00 0.00 66.00 65.69 1of6 h PRO 45 Cb 1.21 -0.09 -0.05 0.00 0.11 0.00 0.00 31.00 32.18 1of6 h PRO 45 CO 0.58 0.25 0.11 1.15 -0.21 0.00 0.00 178.00 179.88 1of6 h THR 46 N 0.39 0.83 -0.22 -1.15 2.02 -1.92 -2.02 112.91 110.85 1of6 h THR 46 Ca 0.47 -0.09 0.05 0.00 0.77 0.00 0.00 66.41 67.62 1of6 h THR 46 Cb 0.81 0.55 -0.06 0.00 -1.74 0.00 0.00 68.15 67.71 1of6 h THR 46 CO -0.48 0.05 -0.16 0.28 0.37 0.00 0.00 175.52 175.58 1of6 h SER 47 N 0.26 -0.51 -0.85 4.18 0.02 -1.42 0.18 113.55 115.40 1of6 h SER 47 Ca 0.20 0.11 0.02 0.00 -0.84 0.00 0.00 61.79 61.27 1of6 h SER 47 Cb 0.21 0.26 -0.04 0.00 0.14 0.00 0.00 62.40 62.97 1of6 h SER 47 CO -0.23 -0.20 0.56 -0.07 -1.14 0.00 0.00 176.83 175.75 1of6 h LEU 48 N -0.15 0.96 -0.06 5.07 3.38 -1.36 -1.01 115.31 122.12 1of6 h LEU 48 Ca 0.13 -0.02 -0.24 0.00 0.09 0.00 0.00 57.88 57.83 1of6 h LEU 48 Cb 0.34 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1of6 h LEU 48 CO -0.31 0.68 -1.06 -0.08 0.09 0.00 0.00 178.44 177.76 1of6 h GLU 49 N 1.13 0.32 -0.28 1.13 4.57 -1.00 -1.40 114.58 119.06 1of6 h GLU 49 Ca 0.32 -0.42 -0.01 0.00 -1.18 0.00 0.00 59.36 58.07 1of6 h GLU 49 Cb -0.09 0.14 -0.01 0.00 -0.16 0.00 0.00 28.75 28.62 1of6 h GLU 49 CO -0.08 1.13 0.13 1.15 -1.18 0.00 0.00 179.01 180.16 1of6 h THR 50 N 0.15 1.15 -0.27 0.32 2.02 -0.49 0.19 112.91 115.99 1of6 h THR 50 Ca -0.10 -0.44 0.02 0.00 0.77 0.00 0.00 66.41 66.66 1of6 h THR 50 Cb 1.73 0.93 -0.02 0.00 -1.74 0.00 0.00 68.15 69.05 1of6 h THR 50 CO 0.18 0.16 0.13 0.00 0.37 0.00 0.00 175.52 176.36 1of6 h ALA 51 N 0.99 0.32 -0.72 6.16 0.00 -1.16 -0.67 119.26 124.17 1of6 h ALA 51 Ca 0.10 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1of6 h ALA 51 Cb 0.13 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.83 1of6 h ALA 51 CO -0.01 -0.26 0.40 0.87 0.00 0.00 0.00 179.25 180.25 1of6 h LYS 52 N 0.28 1.01 -0.33 0.00 1.57 -1.14 -2.51 116.57 115.45 1of6 h LYS 52 Ca 0.11 -0.12 -0.04 0.00 -1.87 0.00 0.00 60.65 58.73 1of6 h LYS 52 Cb 0.03 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 32.12 1of6 h LYS 52 CO -0.07 0.75 0.07 -0.09 -0.57 0.00 0.00 179.45 179.54 1of6 h ARG 53 N 1.00 0.55 -0.61 3.15 2.43 -0.68 -2.40 114.38 117.81 1of6 h ARG 53 Ca 0.25 -0.14 0.04 0.00 -0.81 0.00 0.00 59.98 59.32 1of6 h ARG 53 Cb 0.04 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.49 1of6 h ARG 53 CO -0.04 0.62 0.41 0.78 -1.51 0.00 0.00 179.97 180.22 1of6 h GLY 54 N 0.39 0.81 0.70 2.80 0.00 -0.84 -1.54 103.07 105.38 1of6 h GLY 54 Ca 0.10 -0.28 -0.01 0.00 0.00 0.00 0.00 47.33 47.15 1of6 h GLY 54 CO 0.00 0.23 -0.11 3.21 0.00 0.00 0.00 176.54 179.88 1of6 h ARG 55 N 0.70 -0.30 -0.45 4.80 3.08 -1.28 -0.86 114.38 120.07 1of6 h ARG 55 Ca 0.25 0.02 0.08 0.00 0.07 0.00 0.00 59.98 60.40 1of6 h ARG 55 Cb 0.12 0.07 -0.07 0.00 0.08 0.00 0.00 29.97 30.17 1of6 h ARG 55 CO -0.07 0.00 0.01 0.00 -1.07 0.00 0.00 179.97 178.85 1of6 h ARG 56 N -0.62 0.12 -0.60 0.04 3.08 -1.11 0.32 114.38 115.62 1of6 h ARG 56 Ca -0.03 -0.01 -0.06 0.00 0.07 0.00 0.00 59.98 59.95 1of6 h ARG 56 Cb 0.44 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.44 1of6 h ARG 56 CO 0.05 0.08 0.14 0.93 -1.07 0.00 0.00 179.97 180.10 1of6 h GLU 57 N 0.13 0.93 -0.31 0.04 5.08 -1.31 -1.71 114.58 117.43 1of6 h GLU 57 Ca 0.22 -0.20 -0.11 0.00 -1.00 0.00 0.00 59.36 58.27 1of6 h GLU 57 Cb 0.32 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 1of6 h GLU 57 CO -0.36 0.83 -0.22 0.00 -1.00 0.00 0.00 179.01 178.26 1of6 h ALA 58 N 1.26 0.45 -0.37 3.43 0.00 -0.56 -2.72 119.26 120.74 1of6 h ALA 58 Ca 0.19 -0.37 0.06 0.00 0.00 0.00 0.00 54.91 54.79 1of6 h ALA 58 Cb 0.33 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 17.96 1of6 h ALA 58 CO 0.00 0.41 0.05 0.82 0.00 0.00 0.00 179.25 180.53 1of6 h ILE 59 N 0.46 0.78 -0.16 0.00 2.04 -0.67 -0.86 117.51 119.10 1of6 h ILE 59 Ca 0.06 -0.06 -0.08 0.00 1.00 0.00 0.00 64.86 65.79 1of6 h ILE 59 Cb 0.77 0.61 -0.01 0.00 -0.74 0.00 0.00 36.82 37.45 1of6 h ILE 59 CO 0.06 0.03 -0.24 0.44 0.00 0.00 0.00 178.15 178.44 1of6 h ASP 60 N 0.16 0.28 0.04 1.72 3.32 -1.29 -2.16 116.42 118.48 1of6 h ASP 60 Ca 0.18 -0.08 -0.00 0.00 0.02 0.00 0.00 57.03 57.14 1of6 h ASP 60 Cb 0.22 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.70 1of6 h ASP 60 CO -0.25 0.52 -0.02 0.40 -1.72 0.00 0.00 179.24 178.17 1of6 h ILE 61 N 0.26 1.33 0.00 0.35 2.04 -1.12 -0.24 117.51 120.12 1of6 h ILE 61 Ca 0.04 -1.72 -0.07 0.00 1.00 0.00 0.00 64.86 64.11 1of6 h ILE 61 Cb 0.57 2.39 -0.01 0.00 -0.74 0.00 0.00 36.82 39.02 1of6 h ILE 61 CO 0.04 0.40 -0.32 0.16 0.00 0.00 0.00 178.15 178.43 1of6 h ILE 62 N -0.88 0.97 -0.13 -0.67 3.07 -1.14 -2.13 117.51 116.60 1of6 h ILE 62 Ca -0.00 -1.23 0.00 0.00 1.55 0.00 0.00 64.86 65.18 1of6 h ILE 62 Cb 0.70 1.71 0.00 0.00 -0.27 0.00 0.00 36.82 38.96 1of6 h ILE 62 CO 0.01 0.32 0.00 0.35 -1.05 0.00 0.00 178.15 177.77 1of6 n THR 63 N -3.77 0.16 -0.54 0.16 -2.24 -0.82 -0.47 114.28 106.78 1of6 n THR 63 Ca -0.01 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.52 1of6 n THR 63 Cb 0.41 0.17 0.00 0.00 -2.10 0.00 0.00 70.33 68.81 1of6 n THR 63 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1of6 n GLY 64 N 1.01 1.70 0.00 3.38 0.00 -0.80 -4.89 105.19 105.59 1of6 n GLY 64 Ca 0.15 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.28 1of6 n GLY 64 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1of6 n LYS 65 N -2.00 0.73 -3.71 1.61 5.02 -0.25 -4.63 118.16 114.93 1of6 n LYS 65 Ca 0.00 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.17 1of6 n LYS 65 Cb 0.00 -1.50 -0.13 0.00 -0.02 0.00 0.00 35.03 33.38 1of6 n LYS 65 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1of6 s ASP 66 N -2.00 -0.24 -0.01 4.39 2.15 -0.35 -4.94 116.67 115.67 1of6 s ASP 66 Ca 0.35 0.60 0.17 0.00 0.43 0.00 0.00 52.55 54.09 1of6 s ASP 66 Cb 0.16 0.51 0.50 0.00 -0.30 0.00 0.00 42.92 43.79 1of6 s ASP 66 CO 0.27 -0.18 1.41 -0.90 -0.17 0.00 0.00 175.17 175.60 1of6 n ASP 67 N 4.37 3.09 -4.76 -0.34 5.75 -1.26 -4.42 116.55 118.98 1of6 n ASP 67 Ca -0.23 -2.05 -0.31 0.00 -0.01 0.00 0.00 54.79 52.20 1of6 n ASP 67 Cb 0.53 -0.39 0.10 0.00 -1.03 0.00 0.00 41.12 40.33 1of6 n ASP 67 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 1of6 s ARG 68 N -1.33 2.02 -0.16 0.11 0.52 -1.26 -4.98 118.95 113.87 1of6 s ARG 68 Ca 0.38 1.00 -0.07 0.00 -0.52 0.00 0.00 55.73 56.51 1of6 s ARG 68 Cb 0.20 -1.88 -0.04 0.00 0.52 0.00 0.00 34.95 33.75 1of6 s ARG 68 CO 0.24 -1.76 0.09 0.08 0.02 0.00 0.00 175.30 173.97 1of6 s VAL 69 N -2.95 5.03 -0.17 3.52 1.01 -0.97 -4.87 120.40 121.00 1of6 s VAL 69 Ca 0.61 0.04 -0.18 0.00 0.00 0.00 0.00 61.98 62.46 1of6 s VAL 69 Cb -0.17 -3.24 -0.04 0.00 0.00 0.00 0.00 36.38 32.94 1of6 s VAL 69 CO 0.56 0.51 0.50 -0.22 0.00 0.00 0.00 175.10 176.45 1of6 s LEU 70 N -0.11 4.19 -0.20 3.92 2.96 0.38 -1.99 118.68 127.83 1of6 s LEU 70 Ca 0.08 0.70 0.01 0.00 -0.22 0.00 0.00 54.13 54.71 1of6 s LEU 70 Cb -0.12 -2.69 0.03 0.00 0.50 0.00 0.00 46.19 43.91 1of6 s LEU 70 CO 0.01 -0.12 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.05 1of6 s VAL 71 N 1.30 2.09 -0.40 1.68 1.01 0.04 -0.85 120.40 125.27 1of6 s VAL 71 Ca 0.24 -1.11 -0.16 0.00 0.00 0.00 0.00 61.98 60.96 1of6 s VAL 71 Cb -0.15 -1.96 0.01 0.00 0.00 0.00 0.00 36.38 34.28 1of6 s VAL 71 CO 0.10 0.40 0.35 -0.63 0.00 0.00 0.00 175.10 175.32 1of6 s ILE 72 N 1.24 5.19 -0.02 2.22 -1.09 -0.55 -0.66 121.20 127.54 1of6 s ILE 72 Ca 0.02 -0.40 -0.01 0.00 -2.23 0.00 0.00 60.65 58.03 1of6 s ILE 72 Cb -0.15 -3.92 0.01 0.00 -1.58 0.00 0.00 42.46 36.82 1of6 s ILE 72 CO -0.11 -0.28 0.04 0.54 -1.23 0.00 0.00 174.94 173.90 1of6 s VAL 73 N 1.89 -0.01 -5.00 2.92 0.11 -0.52 -1.10 120.40 118.68 1of6 s VAL 73 Ca 0.08 0.05 0.00 0.00 -2.93 0.00 0.00 61.98 59.18 1of6 s VAL 73 Cb -0.18 -0.07 0.00 0.00 -1.53 0.00 0.00 36.38 34.60 1of6 s VAL 73 CO 0.12 0.02 0.00 0.61 -3.33 0.00 0.00 175.10 172.52 1of6 n GLY 74 N 3.33 -1.12 3.42 6.54 0.00 -0.82 -1.61 105.19 114.93 1of6 n GLY 74 Ca -0.16 -1.51 -0.33 0.00 0.00 0.00 0.00 46.02 44.03 1of6 n GLY 74 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1of6 n PRO 75 N -0.75 -0.53 0.07 1.61 -0.02 0.26 -1.03 135.00 134.61 1of6 n PRO 75 Ca 0.00 -0.11 -0.13 0.00 -2.02 0.00 0.00 63.50 61.24 1of6 n PRO 75 Cb 0.00 -1.88 -0.08 0.00 -0.02 0.00 0.00 33.50 31.52 1of6 n PRO 75 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1of6 s SER 77 N -5.23 0.21 -0.38 0.00 1.04 -1.26 -4.55 113.70 103.53 1of6 s SER 77 Ca -0.14 -0.66 -0.09 0.00 0.48 0.00 0.00 55.95 55.54 1of6 s SER 77 Cb 0.04 0.26 0.05 0.00 0.10 0.00 0.00 66.02 66.48 1of6 s SER 77 CO 0.65 -0.61 0.19 -0.63 0.98 0.00 0.00 173.24 173.82 1of6 s ILE 78 N -3.31 4.19 -1.66 -1.02 -1.09 -0.22 -4.88 121.20 113.21 1of6 s ILE 78 Ca 0.01 -1.13 0.16 0.00 -2.23 0.00 0.00 60.65 57.46 1of6 s ILE 78 Cb 0.03 -3.43 0.04 0.00 -1.58 0.00 0.00 42.46 37.52 1of6 s ILE 78 CO -0.08 -0.31 0.91 0.00 -1.23 0.00 0.00 174.94 174.23 1of6 n HIS 79 N 4.91 0.00 -3.57 3.97 1.44 -1.26 -4.57 115.22 116.13 1of6 n HIS 79 Ca -0.11 0.00 -0.23 0.00 -2.01 0.00 0.00 57.72 55.36 1of6 n HIS 79 Cb 0.45 0.00 -0.16 0.00 0.12 0.00 0.00 29.99 30.40 1of6 n HIS 79 CO 0.00 0.00 0.00 0.34 -2.81 0.00 0.00 176.34 173.87 1of6 s ASP 80 N -1.74 2.00 0.38 4.39 2.15 -1.26 -4.97 116.67 117.60 1of6 s ASP 80 Ca 0.15 -0.47 0.09 0.00 0.43 0.00 0.00 52.55 52.76 1of6 s ASP 80 Cb 0.13 -0.03 0.74 0.00 -0.30 0.00 0.00 42.92 43.47 1of6 s ASP 80 CO 0.34 -0.34 1.89 -0.07 -0.17 0.00 0.00 175.17 176.82 1of6 h LEU 81 N 8.38 0.22 0.41 -1.34 4.07 -1.98 -0.94 115.31 124.14 1of6 h LEU 81 Ca -0.16 -0.05 -0.02 0.00 0.08 0.00 0.00 57.88 57.73 1of6 h LEU 81 Cb 1.15 -0.06 0.00 0.00 1.08 0.00 0.00 40.66 42.84 1of6 h LEU 81 CO 0.29 0.41 -0.19 -0.08 -1.08 0.00 0.00 178.44 177.78 1of6 h GLU 82 N 0.22 -0.52 -0.97 1.13 4.57 -2.00 -2.07 114.58 114.93 1of6 h GLU 82 Ca 0.04 0.04 0.21 0.00 -1.18 0.00 0.00 59.36 58.47 1of6 h GLU 82 Cb 0.43 0.12 -0.09 0.00 -0.16 0.00 0.00 28.75 29.05 1of6 h GLU 82 CO 0.03 -0.35 0.62 0.00 -1.18 0.00 0.00 179.01 178.13 1of6 h ALA 83 N -1.64 2.00 -0.12 2.92 0.00 -2.00 -1.65 119.26 118.77 1of6 h ALA 83 Ca -0.06 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1of6 h ALA 83 Cb 0.42 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1of6 h ALA 83 CO 0.09 -0.34 0.07 0.00 0.00 0.00 0.00 179.25 179.07 1of6 h ALA 84 N 1.62 0.15 -0.92 0.00 0.00 -1.13 -1.67 119.26 117.31 1of6 h ALA 84 Ca 0.54 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.44 1of6 h ALA 84 Cb 1.13 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.84 1of6 h ALA 84 CO -0.28 -0.37 0.56 0.37 0.00 0.00 0.00 179.25 179.52 1of6 h GLN 85 N 0.15 1.25 -0.37 0.00 5.75 -0.56 0.48 115.11 121.80 1of6 h GLN 85 Ca 0.05 -0.11 -0.05 0.00 -0.15 0.00 0.00 58.65 58.39 1of6 h GLN 85 Cb -0.00 -0.26 -0.01 0.00 1.07 0.00 0.00 27.48 28.27 1of6 h GLN 85 CO -0.03 0.87 0.05 1.49 -2.65 0.00 0.00 178.83 178.57 1of6 h GLU 86 N 1.27 0.62 -0.11 1.69 4.81 -1.37 -1.68 114.58 119.81 1of6 h GLU 86 Ca 0.33 -0.17 0.03 0.00 -0.13 0.00 0.00 59.36 59.42 1of6 h GLU 86 Cb -0.06 -0.07 -0.04 0.00 0.63 0.00 0.00 28.75 29.22 1of6 h GLU 86 CO -0.06 0.70 -0.11 -0.92 -0.73 0.00 0.00 179.01 177.89 1of6 h TYR 87 N 0.46 -0.26 -0.67 0.92 5.03 -1.09 -1.23 116.97 120.13 1of6 h TYR 87 Ca 0.11 0.02 0.03 0.00 2.58 0.00 0.00 58.73 61.47 1of6 h TYR 87 Cb 0.38 0.13 -0.04 0.00 1.55 0.00 0.00 36.73 38.76 1of6 h TYR 87 CO 0.03 -0.16 0.44 0.00 -1.32 0.00 0.00 178.16 177.15 1of6 h ALA 88 N 0.95 1.60 -0.07 1.82 0.00 -0.58 -0.57 119.26 122.41 1of6 h ALA 88 Ca 0.08 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1of6 h ALA 88 Cb 0.24 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 1of6 h ALA 88 CO -0.19 0.33 -0.03 -0.07 0.00 0.00 0.00 179.25 179.29 1of6 h LEU 89 N 0.82 0.15 -1.61 0.00 -0.00 -0.59 -0.07 115.31 114.02 1of6 h LEU 89 Ca 0.26 -0.40 0.05 0.00 -0.00 0.00 0.00 57.88 57.79 1of6 h LEU 89 Cb 0.03 -0.04 -0.03 0.00 -0.00 0.00 0.00 40.66 40.63 1of6 h LEU 89 CO -0.07 0.52 0.34 0.03 -0.00 0.00 0.00 178.44 179.25 1of6 h ARG 90 N -0.22 0.48 -0.01 1.13 3.08 -0.90 -2.18 114.38 115.76 1of6 h ARG 90 Ca 0.02 -0.03 -0.25 0.00 0.07 0.00 0.00 59.98 59.78 1of6 h ARG 90 Cb 0.46 -0.11 0.02 0.00 0.08 0.00 0.00 29.97 30.41 1of6 h ARG 90 CO 0.01 0.32 -1.00 1.25 -1.07 0.00 0.00 179.97 179.48 1of6 h LEU 91 N 0.50 0.83 -0.56 3.04 5.85 -0.55 -1.31 115.31 123.10 1of6 h LEU 91 Ca 0.21 -0.65 -0.08 0.00 0.84 0.00 0.00 57.88 58.19 1of6 h LEU 91 Cb 0.22 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 40.97 1of6 h LEU 91 CO -0.06 1.45 0.02 0.50 -0.34 0.00 0.00 178.44 180.02 1of6 h LYS 92 N 0.37 0.97 0.57 1.25 1.63 -0.96 0.19 116.57 120.59 1of6 h LYS 92 Ca -0.11 -0.30 -0.02 0.00 -0.85 0.00 0.00 60.65 59.36 1of6 h LYS 92 Cb 1.65 -0.09 -0.01 0.00 -0.60 0.00 0.00 32.23 33.18 1of6 h LYS 92 CO 0.19 0.96 -0.38 -0.22 -3.45 0.00 0.00 179.45 176.56 1of6 h LYS 93 N 0.85 -0.86 -1.00 1.90 3.64 -1.30 -0.98 116.57 118.82 1of6 h LYS 93 Ca 0.16 0.06 0.21 0.00 -1.27 0.00 0.00 60.65 59.81 1of6 h LYS 93 Cb 0.51 0.20 -0.10 0.00 -0.41 0.00 0.00 32.23 32.43 1of6 h LYS 93 CO 0.02 -0.58 0.62 1.25 -2.27 0.00 0.00 179.45 178.49 1of6 h LEU 94 N -0.90 0.67 -0.16 5.20 5.85 -1.12 -2.24 115.31 122.62 1of6 h LEU 94 Ca -0.08 0.09 0.01 0.00 0.84 0.00 0.00 57.88 58.74 1of6 h LEU 94 Cb 0.73 -0.03 -0.01 0.00 0.37 0.00 0.00 40.66 41.72 1of6 h LEU 94 CO 0.06 0.22 0.08 -1.28 -0.34 0.00 0.00 178.44 177.17 1of6 h SER 95 N 0.64 0.12 -0.82 1.25 0.87 -0.19 -0.39 113.55 115.03 1of6 h SER 95 Ca 0.57 0.01 0.09 0.00 -1.23 0.00 0.00 61.79 61.23 1of6 h SER 95 Cb 1.06 -0.02 -0.07 0.00 -0.44 0.00 0.00 62.40 62.93 1of6 h SER 95 CO -0.35 0.09 0.47 0.44 -0.53 0.00 0.00 176.83 176.95 1of6 h ASP 96 N 0.17 0.69 -0.78 6.23 3.32 -0.57 0.25 116.42 125.73 1of6 h ASP 96 Ca 0.07 0.04 -0.03 0.00 0.02 0.00 0.00 57.03 57.13 1of6 h ASP 96 Cb 0.01 -0.09 -0.04 0.00 0.22 0.00 0.00 39.33 39.44 1of6 h ASP 96 CO -0.05 0.40 0.38 -0.08 -1.72 0.00 0.00 179.24 178.18 1of6 h GLU 97 N 0.81 1.12 -0.73 3.56 4.81 -1.32 -3.25 114.58 119.57 1of6 h GLU 97 Ca 0.39 -0.16 0.00 0.00 -0.13 0.00 0.00 59.36 59.45 1of6 h GLU 97 Cb 0.32 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.50 1of6 h GLU 97 CO -0.23 0.87 0.00 1.28 -0.73 0.00 0.00 179.01 180.20 1of6 n LEU 98 N -4.37 4.09 0.00 1.64 4.77 -0.19 -4.65 117.00 118.30 1of6 n LEU 98 Ca 0.07 -2.05 0.06 0.00 -0.03 0.00 0.00 56.01 54.06 1of6 n LEU 98 Cb 0.13 -0.51 0.26 0.00 -2.33 0.00 0.00 43.42 40.98 1of6 n LEU 98 CO 0.39 0.97 0.68 2.29 -1.33 0.00 0.00 177.39 180.39 1of6 n LYS 99 N 1.60 0.04 0.21 3.23 2.85 -0.01 -1.28 118.16 124.80 1of6 n LYS 99 Ca 0.25 0.27 0.10 0.00 -1.05 0.00 0.00 58.31 57.88 1of6 n LYS 99 Cb 0.67 -1.50 0.34 0.00 -0.65 0.00 0.00 35.03 33.88 1of6 n LYS 99 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 177.40 178.13 1of6 h GLY 100 N 2.01 0.00 0.00 2.58 0.00 -1.87 -3.39 103.07 102.41 1of6 h GLY 100 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 47.28 1of6 h GLY 100 CO 0.00 0.00 -1.18 1.22 0.00 0.00 0.00 176.54 176.58 1of6 n ASP 101 N -3.26 4.11 -4.29 0.19 8.00 -0.40 -4.85 116.55 116.05 1of6 n ASP 101 Ca 0.01 -0.01 -0.30 0.00 0.71 0.00 0.00 54.79 55.21 1of6 n ASP 101 Cb 0.50 0.30 -0.16 0.00 -0.02 0.00 0.00 41.12 41.74 1of6 n ASP 101 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1of6 s LEU 102 N -4.62 2.06 -0.33 0.64 1.43 -0.54 -2.28 118.68 115.04 1of6 s LEU 102 Ca -0.03 -0.46 -0.12 0.00 -1.03 0.00 0.00 54.13 52.50 1of6 s LEU 102 Cb 0.01 -1.25 -0.01 0.00 0.03 0.00 0.00 46.19 44.97 1of6 s LEU 102 CO 0.09 0.29 0.21 -0.55 0.23 0.00 0.00 176.35 176.62 1of6 s SER 103 N -0.65 5.86 -0.14 2.29 0.15 -0.84 -4.20 113.70 116.16 1of6 s SER 103 Ca 0.10 -0.51 -0.04 0.00 0.70 0.00 0.00 55.95 56.19 1of6 s SER 103 Cb -0.09 -2.08 -0.03 0.00 -1.71 0.00 0.00 66.02 62.10 1of6 s SER 103 CO -0.01 -0.24 0.01 -0.63 1.20 0.00 0.00 173.24 173.57 1of6 s ILE 104 N 1.67 4.32 -0.06 6.45 1.01 -1.26 -0.78 121.20 132.55 1of6 s ILE 104 Ca 0.05 -0.21 0.03 0.00 0.00 0.00 0.00 60.65 60.51 1of6 s ILE 104 Cb -0.17 -2.89 0.01 0.00 0.01 0.00 0.00 42.46 39.42 1of6 s ILE 104 CO 0.09 0.52 -0.13 -0.63 0.00 0.00 0.00 174.94 174.78 1of6 s ILE 105 N -0.02 1.19 0.22 2.92 1.01 0.17 -4.46 121.20 122.23 1of6 s ILE 105 Ca 0.03 -0.52 -0.30 0.00 0.00 0.00 0.00 60.65 59.87 1of6 s ILE 105 Cb -0.13 -1.07 -0.09 0.00 0.01 0.00 0.00 42.46 41.18 1of6 s ILE 105 CO 0.02 0.36 0.99 -0.32 0.00 0.00 0.00 174.94 175.99 1of6 s MET 106 N 0.58 4.77 -0.20 2.79 -2.45 -0.24 -1.43 119.30 123.10 1of6 s MET 106 Ca -0.13 1.57 -0.29 0.00 -1.25 0.00 0.00 55.69 55.59 1of6 s MET 106 Cb -0.15 -3.28 -0.03 0.00 1.25 0.00 0.00 34.83 32.62 1of6 s MET 106 CO 0.04 0.37 1.72 1.03 1.05 0.00 0.00 175.02 179.22 1of6 s ARG 107 N -0.98 3.74 -0.61 4.11 0.52 -0.63 -1.89 118.95 123.21 1of6 s ARG 107 Ca 0.43 1.78 0.06 0.00 -0.52 0.00 0.00 55.73 57.48 1of6 s ARG 107 Cb -0.27 -4.09 0.29 0.00 0.52 0.00 0.00 34.95 31.40 1of6 s ARG 107 CO 0.34 -1.36 0.84 0.00 0.02 0.00 0.00 175.30 175.13 1of6 n ALA 108 N 8.76 4.34 -2.60 2.13 0.00 0.31 -4.22 120.51 129.22 1of6 n ALA 108 Ca 0.20 -4.74 -0.31 0.00 0.00 0.00 0.00 53.44 48.59 1of6 n ALA 108 Cb 0.45 -0.83 -0.05 0.00 0.00 0.00 0.00 19.45 19.03 1of6 n ALA 108 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1of6 s TYR 109 N -2.92 3.46 -0.02 0.00 1.51 -1.26 -4.40 117.35 113.73 1of6 s TYR 109 Ca 0.44 0.63 0.09 0.00 -1.01 0.00 0.00 57.07 57.21 1of6 s TYR 109 Cb 0.21 -2.07 -0.13 0.00 -0.11 0.00 0.00 41.96 39.86 1of6 s TYR 109 CO -0.07 0.36 0.18 1.28 -1.11 0.00 0.00 175.55 176.19 1of6 n LEU 110 N -0.11 0.00 -3.89 -1.29 4.32 -1.26 -1.06 117.00 113.71 1of6 n LEU 110 Ca -0.02 0.00 -0.09 0.00 -0.02 0.00 0.00 56.01 55.88 1of6 n LEU 110 Cb 0.52 0.02 -0.07 0.00 -1.62 0.00 0.00 43.42 42.27 1of6 n LEU 110 CO 0.48 0.02 -0.02 -1.61 -1.22 0.00 0.00 177.39 175.04 1of6 s GLU 111 N -2.57 1.06 -0.05 3.23 2.02 -1.26 -0.06 118.70 121.07 1of6 s GLU 111 Ca -0.03 -1.05 0.06 0.00 0.02 0.00 0.00 54.97 53.96 1of6 s GLU 111 Cb 0.05 0.38 -0.02 0.00 0.10 0.00 0.00 34.13 34.65 1of6 s GLU 111 CO 0.36 -0.38 -0.21 0.21 0.02 0.00 0.00 175.26 175.25 1of6 s LYS 112 N -3.91 2.47 -0.46 1.61 2.20 -1.26 -4.83 119.74 115.54 1of6 s LYS 112 Ca 0.12 -0.84 -0.43 0.00 -0.36 0.00 0.00 55.97 54.46 1of6 s LYS 112 Cb 0.03 -2.22 -0.18 0.00 -1.51 0.00 0.00 37.83 33.95 1of6 s LYS 112 CO -0.05 0.49 1.68 -2.30 -0.36 0.00 0.00 175.35 174.81 1of6 n PRO 113 N 2.66 0.00 -1.34 4.03 -0.02 -1.26 -4.98 135.00 134.09 1of6 n PRO 113 Ca -0.17 0.00 -0.29 0.00 -2.02 0.00 0.00 63.50 61.02 1of6 n PRO 113 Cb 0.52 -1.39 0.18 0.00 -0.02 0.00 0.00 33.50 32.78 1of6 n PRO 113 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1of6 s ARG 114 N 3.86 0.27 0.00 -0.52 1.81 -1.26 -5.14 118.95 117.98 1of6 s ARG 114 Ca 1.03 0.21 0.00 0.00 -1.72 0.00 0.00 55.73 55.25 1of6 s ARG 114 Cb -1.39 -1.75 0.00 0.00 -0.45 0.00 0.00 34.95 31.36 1of6 s ARG 114 CO 0.70 -2.77 0.00 0.28 -0.68 0.00 0.00 175.30 172.83 1of6 n VAL 117 N -4.15 0.00 0.00 3.52 0.31 -1.26 -5.25 118.33 111.51 1of6 n VAL 117 Ca 0.08 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.41 1of6 n VAL 117 Cb 0.59 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.52 1of6 n VAL 117 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1of6 n GLY 118 N 0.00 3.12 3.64 2.92 0.00 -1.26 -5.06 105.19 108.56 1of6 n GLY 118 Ca 0.00 -1.97 -0.46 0.00 0.00 0.00 0.00 46.02 43.59 1of6 n GLY 118 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 173.32 175.19 1of6 n TRP 119 N -1.20 1.93 1.99 1.61 -0.00 -1.26 -4.90 117.44 115.60 1of6 n TRP 119 Ca 0.00 0.49 0.16 0.00 -0.00 0.00 0.00 57.50 58.15 1of6 n TRP 119 Cb 0.00 -2.42 0.93 0.00 -0.00 0.00 0.00 31.31 29.83 1of6 n TRP 119 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 177.69 179.32 1of6 n LYS 120 N 2.07 1.02 0.00 5.87 5.02 -1.26 -4.77 118.16 126.11 1of6 n LYS 120 Ca 0.13 -0.02 0.00 0.00 -2.02 0.00 0.00 58.31 56.40 1of6 n LYS 120 Cb 0.29 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.80 1of6 n LYS 120 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1of6 n GLY 121 N 1.00 -0.01 0.27 0.72 0.00 -1.26 -4.35 105.19 101.57 1of6 n GLY 121 Ca 0.24 -1.83 0.02 0.00 0.00 0.00 0.00 46.02 44.45 1of6 n GLY 121 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1of6 h LEU 122 N 0.00 0.40 -0.07 0.99 5.85 -0.72 0.44 115.31 122.20 1of6 h LEU 122 Ca 0.00 -0.06 -0.07 0.00 0.84 0.00 0.00 57.88 58.59 1of6 h LEU 122 Cb 0.00 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 40.93 1of6 h LEU 122 CO 0.00 0.45 -0.21 0.40 -0.34 0.00 0.00 178.44 178.74 1of6 h ILE 123 N 0.43 1.42 0.13 4.05 2.04 -1.77 -3.05 117.51 120.77 1of6 h ILE 123 Ca 0.10 -1.58 -0.28 0.00 1.00 0.00 0.00 64.86 64.09 1of6 h ILE 123 Cb 0.25 2.27 0.00 0.00 -0.74 0.00 0.00 36.82 38.60 1of6 h ILE 123 CO 0.00 0.45 -1.31 0.78 0.00 0.00 0.00 178.15 178.08 1of6 h ASN 124 N -0.22 0.42 -1.65 1.72 2.35 -1.69 -3.34 115.58 113.17 1of6 h ASN 124 Ca -0.01 -0.47 -0.48 0.00 -0.55 0.00 0.00 56.30 54.79 1of6 h ASN 124 Cb 0.84 -0.14 -0.35 0.00 0.05 0.00 0.00 38.32 38.72 1of6 h ASN 124 CO 0.05 1.38 -1.03 -0.67 -1.65 0.00 0.00 177.43 175.50 1of6 n ASP 125 N -3.51 -0.12 0.30 5.81 2.03 0.12 -1.76 116.55 119.42 1of6 n ASP 125 Ca -0.10 -2.93 0.19 0.00 0.52 0.00 0.00 54.79 52.47 1of6 n ASP 125 Cb 1.03 -0.19 0.93 0.00 -0.72 0.00 0.00 41.12 42.16 1of6 n ASP 125 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1of6 h PRO 126 N 3.62 0.00 -0.01 -0.67 0.13 -1.67 -1.25 132.00 132.14 1of6 h PRO 126 Ca 0.04 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.17 1of6 h PRO 126 Cb 0.94 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.07 1of6 h PRO 126 CO 0.44 0.03 -0.13 -0.25 -0.23 0.00 0.00 178.00 177.85 1of6 n ASP 127 N -3.22 0.97 -3.74 1.44 8.00 -1.26 -4.97 116.55 113.77 1of6 n ASP 127 Ca -0.01 -0.99 -0.26 0.00 0.71 0.00 0.00 54.79 54.23 1of6 n ASP 127 Cb 0.19 0.04 0.05 0.00 -0.02 0.00 0.00 41.12 41.38 1of6 n ASP 127 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1of6 n VAL 128 N -0.51 -2.98 -1.53 2.53 0.31 -0.47 -4.57 118.33 111.12 1of6 n VAL 128 Ca 0.15 -0.10 0.05 0.00 -0.01 0.00 0.00 64.34 64.44 1of6 n VAL 128 Cb 0.32 -3.55 0.08 0.00 -0.91 0.00 0.00 33.84 29.78 1of6 n VAL 128 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 1of6 n ASN 129 N -2.95 1.26 -3.22 4.52 2.04 -1.26 -4.04 115.26 111.61 1of6 n ASN 129 Ca -0.03 -2.60 -0.23 0.00 -0.44 0.00 0.00 54.58 51.27 1of6 n ASN 129 Cb 0.57 -0.33 0.03 0.00 -2.53 0.00 0.00 39.78 37.52 1of6 n ASN 129 CO 0.00 0.00 0.00 -3.20 -0.44 0.00 0.00 177.26 173.62 1of6 n ASN 130 N -0.75 -5.36 -4.71 0.53 5.15 -1.26 -5.02 115.26 103.84 1of6 n ASN 130 Ca 0.09 -0.36 -0.29 0.00 -0.60 0.00 0.00 54.58 53.42 1of6 n ASN 130 Cb 0.68 -4.34 -0.09 0.00 -0.53 0.00 0.00 39.78 35.51 1of6 n ASN 130 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 1of6 s THR 131 N -3.12 1.75 -0.16 -0.44 -4.23 -1.26 -5.15 115.64 103.04 1of6 s THR 131 Ca 0.37 -1.91 -0.01 0.00 -1.18 0.00 0.00 61.69 58.96 1of6 s THR 131 Cb -0.18 -2.66 -0.01 0.00 1.34 0.00 0.00 72.50 70.99 1of6 s THR 131 CO 0.46 0.00 -0.11 -0.36 -0.54 0.00 0.00 174.62 174.07 1of6 s PHE 132 N -2.75 2.85 -0.49 3.99 0.08 -1.26 -4.12 117.98 116.29 1of6 s PHE 132 Ca 0.26 -0.80 0.06 0.00 0.12 0.00 0.00 56.93 56.57 1of6 s PHE 132 Cb 0.05 -1.92 0.21 0.00 -0.57 0.00 0.00 43.02 40.79 1of6 s PHE 132 CO 0.14 -0.35 0.74 -1.71 -0.10 0.00 0.00 175.22 173.94 1of6 n ASN 133 N 3.96 -2.67 -0.23 1.36 2.85 -0.72 -5.03 115.26 114.78 1of6 n ASN 133 Ca -0.18 -3.01 -0.05 0.00 -0.11 0.00 0.00 54.58 51.22 1of6 n ASN 133 Cb 0.52 1.39 0.10 0.00 1.24 0.00 0.00 39.78 43.03 1of6 n ASN 133 CO 0.00 0.00 0.00 0.40 -2.11 0.00 0.00 177.26 175.55 1of6 h ILE 134 N 3.88 1.25 -0.44 -1.44 2.04 -1.77 -1.96 117.51 119.08 1of6 h ILE 134 Ca -0.01 -0.88 -0.01 0.00 1.00 0.00 0.00 64.86 64.96 1of6 h ILE 134 Cb 1.04 0.50 -0.02 0.00 -0.74 0.00 0.00 36.82 37.60 1of6 h ILE 134 CO 0.21 0.34 0.23 0.78 0.00 0.00 0.00 178.15 179.71 1of6 h ASN 135 N 1.02 0.55 -0.50 1.72 2.35 -1.90 0.11 115.58 118.93 1of6 h ASN 135 Ca 0.22 -0.10 -0.00 0.00 -0.55 0.00 0.00 56.30 55.87 1of6 h ASN 135 Cb 0.30 -0.14 -0.03 0.00 0.05 0.00 0.00 38.32 38.50 1of6 h ASN 135 CO -0.01 0.50 0.30 0.50 -1.65 0.00 0.00 177.43 177.08 1of6 h LYS 136 N 0.57 0.69 -0.33 0.81 3.64 -1.85 -2.47 116.57 117.62 1of6 h LYS 136 Ca 0.15 -0.06 -0.18 0.00 -1.27 0.00 0.00 60.65 59.30 1of6 h LYS 136 Cb 0.08 -0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 31.75 1of6 h LYS 136 CO -0.02 0.49 -0.48 0.78 -2.27 0.00 0.00 179.45 177.95 1of6 h GLY 137 N 0.75 1.00 1.09 5.01 0.00 -0.57 0.18 103.07 110.53 1of6 h GLY 137 Ca 0.19 -1.10 -0.14 0.00 0.00 0.00 0.00 47.33 46.27 1of6 h GLY 137 CO -0.03 0.99 -0.30 1.41 0.00 0.00 0.00 176.54 178.61 1of6 h LEU 138 N 0.72 0.97 0.20 3.11 3.38 -0.78 -0.35 115.31 122.56 1of6 h LEU 138 Ca 0.04 -0.44 0.01 0.00 0.09 0.00 0.00 57.88 57.58 1of6 h LEU 138 Cb 1.08 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 41.52 1of6 h LEU 138 CO 0.11 1.20 -0.43 -0.61 0.09 0.00 0.00 178.44 178.80 1of6 h GLN 139 N 0.75 -0.69 -0.77 1.13 4.15 -1.26 -0.42 115.11 118.00 1of6 h GLN 139 Ca 0.08 0.05 0.11 0.00 0.77 0.00 0.00 58.65 59.66 1of6 h GLN 139 Cb 0.88 0.16 -0.08 0.00 0.21 0.00 0.00 27.48 28.65 1of6 h GLN 139 CO 0.08 -0.46 0.39 0.77 -1.93 0.00 0.00 178.83 177.67 1of6 h SER 140 N -0.72 0.49 -0.13 -0.69 0.02 -0.51 -0.03 113.55 111.98 1of6 h SER 140 Ca 0.00 0.07 -0.01 0.00 -0.84 0.00 0.00 61.79 61.02 1of6 h SER 140 Cb 0.71 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 63.24 1of6 h SER 140 CO -0.20 0.25 0.06 0.00 -1.14 0.00 0.00 176.83 175.80 1of6 h ALA 141 N 1.48 0.17 -0.47 3.77 0.00 -0.93 0.35 119.26 123.63 1of6 h ALA 141 Ca 0.39 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 55.20 1of6 h ALA 141 Cb 0.47 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.18 1of6 h ALA 141 CO -0.30 -0.26 0.22 -0.09 0.00 0.00 0.00 179.25 178.82 1of6 h ARG 142 N 0.08 0.67 0.20 0.00 2.43 -0.78 -0.52 114.38 116.46 1of6 h ARG 142 Ca 0.05 -0.10 -0.01 0.00 -0.81 0.00 0.00 59.98 59.11 1of6 h ARG 142 Cb 0.14 -0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 29.57 1of6 h ARG 142 CO -0.00 0.58 -0.12 0.37 -1.51 0.00 0.00 179.97 179.28 1of6 h GLN 143 N 0.61 -0.29 -0.70 0.20 5.75 -0.86 0.46 115.11 120.29 1of6 h GLN 143 Ca 0.16 0.02 0.15 0.00 -0.15 0.00 0.00 58.65 58.83 1of6 h GLN 143 Cb 0.13 0.07 -0.13 0.00 1.07 0.00 0.00 27.48 28.62 1of6 h GLN 143 CO -0.02 -0.19 -0.11 1.25 -2.65 0.00 0.00 178.83 177.11 1of6 h LEU 144 N -0.30 -0.53 -0.71 -2.39 5.85 -0.25 0.31 115.31 117.30 1of6 h LEU 144 Ca -0.02 0.20 -0.09 0.00 0.84 0.00 0.00 57.88 58.80 1of6 h LEU 144 Cb 0.25 0.39 -0.02 0.00 0.37 0.00 0.00 40.66 41.65 1of6 h LEU 144 CO 0.03 -0.21 -0.03 -0.26 -0.34 0.00 0.00 178.44 177.63 1of6 h PHE 145 N 0.04 1.06 0.02 1.25 -1.00 -0.21 -1.61 116.94 116.49 1of6 h PHE 145 Ca 0.35 -0.18 -0.00 0.00 2.81 0.00 0.00 57.97 60.95 1of6 h PHE 145 Cb 0.57 -0.28 0.00 0.00 3.61 0.00 0.00 35.95 39.85 1of6 h PHE 145 CO -0.50 0.96 -0.01 0.28 -1.61 0.00 0.00 178.31 177.42 1of6 h VAL 146 N 0.89 0.99 -0.90 -0.55 2.07 -0.49 -1.81 116.25 116.44 1of6 h VAL 146 Ca 0.16 -0.03 0.05 0.00 0.82 0.00 0.00 66.70 67.69 1of6 h VAL 146 Cb 0.55 1.01 -0.05 0.00 -1.52 0.00 0.00 31.29 31.28 1of6 h VAL 146 CO 0.03 0.01 0.59 0.78 0.02 0.00 0.00 177.57 179.00 1of6 h ASN 147 N -0.05 0.95 0.00 0.57 2.35 -0.48 0.23 115.58 119.16 1of6 h ASN 147 Ca -0.00 -0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.74 1of6 h ASN 147 Cb 0.04 -0.21 0.00 0.00 0.05 0.00 0.00 38.32 38.20 1of6 h ASN 147 CO 0.01 0.64 -0.00 -0.07 -1.65 0.00 0.00 177.43 176.35 1of6 h LEU 148 N 1.09 -0.00 -1.37 1.61 3.38 -1.27 -3.18 115.31 115.57 1of6 h LEU 148 Ca 0.37 -0.83 -0.06 0.00 0.09 0.00 0.00 57.88 57.45 1of6 h LEU 148 Cb 0.09 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 1of6 h LEU 148 CO -0.12 0.84 -0.27 0.71 0.09 0.00 0.00 178.44 179.69 1of6 h THR 149 N -0.85 0.84 0.00 0.22 1.35 -1.10 -3.02 112.91 110.35 1of6 h THR 149 Ca -0.00 -1.07 -0.00 0.00 -0.55 0.00 0.00 66.41 64.79 1of6 h THR 149 Cb 0.84 1.65 -0.00 0.00 -1.73 0.00 0.00 68.15 68.90 1of6 h THR 149 CO 0.00 0.26 -0.00 -1.13 -0.25 0.00 0.00 175.52 174.40 1of6 h ASN 150 N 0.00 0.00 -0.46 5.36 -1.24 -0.51 -0.98 115.58 117.74 1of6 h ASN 150 Ca -0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 1of6 h ASN 150 Cb 0.62 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.67 1of6 h ASN 150 CO 0.03 0.00 0.00 2.30 -1.29 0.00 0.00 177.43 178.48 1of6 n ILE 151 N -3.24 0.61 -0.29 2.57 -5.35 -1.14 -4.75 119.36 107.77 1of6 n ILE 151 Ca -0.03 -0.69 0.00 0.00 -0.27 0.00 0.00 62.75 61.76 1of6 n ILE 151 Cb 0.09 0.53 0.00 0.00 -1.74 0.00 0.00 39.64 38.52 1of6 n ILE 151 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1of6 n GLY 152 N 1.39 0.83 3.32 3.28 0.00 -0.37 -5.06 105.19 108.59 1of6 n GLY 152 Ca 0.19 -0.21 -0.37 0.00 0.00 0.00 0.00 46.02 45.63 1of6 n GLY 152 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1of6 s LEU 153 N 0.00 3.75 0.76 0.99 2.96 -1.22 -4.97 118.68 120.96 1of6 s LEU 153 Ca 0.00 -0.74 -0.11 0.00 -0.22 0.00 0.00 54.13 53.07 1of6 s LEU 153 Cb 0.00 -1.85 0.05 0.00 0.50 0.00 0.00 46.19 44.89 1of6 s LEU 153 CO 0.00 -0.18 1.09 -2.84 -1.32 0.00 0.00 176.35 173.09 1of6 s PRO 154 N 1.47 2.34 0.13 0.98 0.02 -1.26 -3.60 135.00 135.08 1of6 s PRO 154 Ca 0.02 1.12 0.02 0.00 0.02 0.00 0.00 61.00 62.18 1of6 s PRO 154 Cb -0.17 -1.91 -0.04 0.00 0.02 0.00 0.00 34.50 32.40 1of6 s PRO 154 CO 0.01 -1.57 -0.04 0.96 -0.33 0.00 0.00 177.00 176.04 1of6 s ILE 155 N -2.93 0.67 -0.00 2.83 -4.36 -1.26 -1.08 121.20 115.06 1of6 s ILE 155 Ca 0.61 -1.95 0.00 0.00 -0.26 0.00 0.00 60.65 59.04 1of6 s ILE 155 Cb -0.17 -1.87 0.00 0.00 1.25 0.00 0.00 42.46 41.68 1of6 s ILE 155 CO 0.56 -0.70 0.00 -0.83 0.24 0.00 0.00 174.94 174.21 1of6 s GLY 156 N -3.10 0.03 0.16 6.27 0.00 -0.79 -0.50 107.32 109.39 1of6 s GLY 156 Ca 0.17 0.03 0.00 0.00 0.00 0.00 0.00 44.72 44.92 1of6 s GLY 156 CO -0.01 0.08 0.04 -0.45 0.00 0.00 0.00 173.10 172.77 1of6 s SER 157 N 0.14 0.72 0.24 1.64 0.15 -0.88 -0.53 113.70 115.18 1of6 s SER 157 Ca -0.01 -1.22 -0.30 0.00 0.70 0.00 0.00 55.95 55.12 1of6 s SER 157 Cb -0.02 0.22 -0.09 0.00 -1.71 0.00 0.00 66.02 64.42 1of6 s SER 157 CO -0.00 -0.68 1.01 -0.70 1.20 0.00 0.00 173.24 174.07 1of6 s GLU 158 N -4.00 4.75 -0.41 5.44 2.12 -1.26 -1.38 118.70 123.95 1of6 s GLU 158 Ca 0.26 1.63 -0.21 0.00 0.36 0.00 0.00 54.97 57.01 1of6 s GLU 158 Cb 0.07 -3.25 0.02 0.00 0.26 0.00 0.00 34.13 31.23 1of6 s GLU 158 CO 0.04 0.35 0.65 -1.64 -0.54 0.00 0.00 175.26 174.12 1of6 s MET 159 N -1.15 3.43 -0.14 4.30 -1.94 0.24 -4.82 119.30 119.21 1of6 s MET 159 Ca 0.43 -0.21 0.13 0.00 -1.71 0.00 0.00 55.69 54.34 1of6 s MET 159 Cb -0.28 -3.90 -0.24 0.00 2.01 0.00 0.00 34.83 32.42 1of6 s MET 159 CO 0.36 -0.92 0.29 1.28 -0.01 0.00 0.00 175.02 176.01 1of6 n LEU 160 N 6.22 0.72 0.00 -0.03 7.99 -1.26 -4.81 117.00 125.83 1of6 n LEU 160 Ca -0.01 0.16 -0.01 0.00 -0.01 0.00 0.00 56.01 56.14 1of6 n LEU 160 Cb 0.48 0.17 0.01 0.00 -0.11 0.00 0.00 43.42 43.97 1of6 n LEU 160 CO 0.52 0.51 0.20 -0.90 -1.51 0.00 0.00 177.39 176.21 1of6 n ASP 161 N -2.94 -0.47 -0.52 -1.43 5.68 -1.26 -5.05 116.55 110.55 1of6 n ASP 161 Ca -0.28 -1.26 0.14 0.00 -0.50 0.00 0.00 54.79 52.88 1of6 n ASP 161 Cb 1.10 0.77 0.44 0.00 -1.14 0.00 0.00 41.12 42.29 1of6 n ASP 161 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1of6 n THR 162 N -0.18 0.00 -0.07 2.12 -2.24 -1.26 -4.43 114.28 108.22 1of6 n THR 162 Ca -0.01 -0.27 -0.15 0.00 -2.27 0.00 0.00 64.05 61.35 1of6 n THR 162 Cb 0.15 0.64 -0.05 0.00 -2.10 0.00 0.00 70.33 68.97 1of6 n THR 162 CO 0.00 0.00 0.00 -0.38 -0.57 0.00 0.00 175.07 174.12 1of6 n ILE 163 N 0.25 1.04 -0.34 2.28 5.41 -1.26 -4.43 119.36 122.31 1of6 n ILE 163 Ca 0.17 -0.12 0.11 0.00 1.00 0.00 0.00 62.75 63.92 1of6 n ILE 163 Cb 0.39 -1.81 0.31 0.00 -0.71 0.00 0.00 39.64 37.82 1of6 n ILE 163 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 176.55 177.32 1of6 h SER 164 N -0.61 0.79 0.30 4.38 4.64 -1.99 -1.49 113.55 119.58 1of6 h SER 164 Ca -0.32 0.07 -0.02 0.00 -0.47 0.00 0.00 61.79 61.05 1of6 h SER 164 Cb 1.18 -0.08 -0.00 0.00 -0.31 0.00 0.00 62.40 63.19 1of6 h SER 164 CO -0.20 0.35 -0.10 -0.65 -0.87 0.00 0.00 176.83 175.37 1of6 h PRO 165 N 0.81 0.00 0.00 4.77 0.11 -1.84 -2.56 132.00 133.30 1of6 h PRO 165 Ca 0.53 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.64 1of6 h PRO 165 Cb 0.76 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.87 1of6 h PRO 165 CO -0.31 0.10 0.00 1.96 -0.21 0.00 0.00 178.00 179.54 1of6 h GLN 166 N 0.00 0.00 0.00 1.05 1.08 -1.54 -0.76 115.11 114.94 1of6 h GLN 166 Ca -0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 1of6 h GLN 166 Cb 0.27 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.70 1of6 h GLN 166 CO 0.01 0.00 -0.54 0.66 -0.95 0.00 0.00 178.83 178.01 1of6 n TYR 167 N -2.89 0.10 0.00 2.96 4.02 -0.96 -4.56 117.16 115.82 1of6 n TYR 167 Ca -0.02 0.03 0.00 0.00 -0.01 0.00 0.00 57.90 57.90 1of6 n TYR 167 Cb 0.09 -0.32 0.00 0.00 -0.02 0.00 0.00 39.34 39.09 1of6 n TYR 167 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 1of6 n LEU 168 N -1.62 0.00 0.25 7.72 4.77 -0.94 -4.85 117.00 122.34 1of6 n LEU 168 Ca 0.05 -0.07 0.14 0.00 -0.03 0.00 0.00 56.01 56.10 1of6 n LEU 168 Cb 0.36 0.00 0.57 0.00 -2.33 0.00 0.00 43.42 42.02 1of6 n LEU 168 CO 0.35 0.00 0.91 0.00 -1.33 0.00 0.00 177.39 177.32 1of6 h ALA 169 N 0.00 1.01 0.00 -1.18 0.00 -1.40 -2.49 119.26 115.21 1of6 h ALA 169 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1of6 h ALA 169 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1of6 h ALA 169 CO 0.00 0.12 0.00 0.38 0.00 0.00 0.00 179.25 179.75 1of6 h ASP 170 N 0.00 0.00 -0.01 0.00 2.03 -1.92 -3.09 116.42 113.44 1of6 h ASP 170 Ca -0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 1of6 h ASP 170 Cb 0.63 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.13 1of6 h ASP 170 CO 0.01 0.00 -0.40 0.18 -1.03 0.00 0.00 179.24 178.00 1of6 n LEU 171 N -2.86 1.04 -4.79 0.15 4.77 -0.94 -4.73 117.00 109.64 1of6 n LEU 171 Ca -0.02 -0.65 -0.36 0.00 -0.03 0.00 0.00 56.01 54.95 1of6 n LEU 171 Cb 0.11 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.13 1of6 n LEU 171 CO 0.19 0.22 -0.17 -0.69 -1.33 0.00 0.00 177.39 175.61 1of6 s VAL 172 N -1.85 5.44 -0.31 4.08 1.01 -1.17 -4.54 120.40 123.07 1of6 s VAL 172 Ca 0.08 0.22 0.20 0.00 0.00 0.00 0.00 61.98 62.48 1of6 s VAL 172 Cb 0.10 -3.45 -0.29 0.00 0.00 0.00 0.00 36.38 32.74 1of6 s VAL 172 CO 0.40 0.51 0.57 -1.20 0.00 0.00 0.00 175.10 175.39 1of6 n SER 173 N 2.90 0.49 -3.69 3.32 7.64 0.34 -4.86 113.62 119.76 1of6 n SER 173 Ca -0.17 -0.30 -0.11 0.00 1.01 0.00 0.00 58.87 59.30 1of6 n SER 173 Cb 0.53 1.65 -0.10 0.00 -1.01 0.00 0.00 64.21 65.28 1of6 n SER 173 CO 0.00 0.00 0.00 0.12 -3.01 0.00 0.00 175.04 172.15 1of6 s PHE 174 N -3.26 -0.66 0.07 1.43 5.36 -1.07 -4.25 117.98 115.59 1of6 s PHE 174 Ca -0.03 1.43 0.07 0.00 -0.96 0.00 0.00 56.93 57.44 1of6 s PHE 174 Cb 0.14 0.31 -0.04 0.00 -0.34 0.00 0.00 43.02 43.09 1of6 s PHE 174 CO 0.85 -0.35 -0.13 0.20 -1.46 0.00 0.00 175.22 174.32 1of6 s GLY 175 N 1.18 1.71 0.05 13.12 0.00 -0.51 -2.08 107.32 120.78 1of6 s GLY 175 Ca -0.07 -1.21 0.08 0.00 0.00 0.00 0.00 44.72 43.51 1of6 s GLY 175 CO -0.11 -1.14 -0.22 0.00 0.00 0.00 0.00 173.10 171.62 1of6 s ALA 176 N -1.08 1.89 -0.23 3.20 0.00 -0.48 -0.71 121.76 124.36 1of6 s ALA 176 Ca 0.18 -1.12 -0.05 0.00 0.00 0.00 0.00 51.96 50.97 1of6 s ALA 176 Cb -0.11 -0.37 -0.02 0.00 0.00 0.00 0.00 23.12 22.62 1of6 s ALA 176 CO 0.10 0.43 -0.01 0.42 0.00 0.00 0.00 175.76 176.70 1of6 s ILE 177 N -0.81 3.68 0.90 0.00 -1.09 0.06 -0.59 121.20 123.35 1of6 s ILE 177 Ca 0.09 -0.39 -0.12 0.00 -2.23 0.00 0.00 60.65 58.00 1of6 s ILE 177 Cb -0.09 -2.69 0.13 0.00 -1.58 0.00 0.00 42.46 38.23 1of6 s ILE 177 CO 0.02 0.40 1.13 -0.83 -1.23 0.00 0.00 174.94 174.43 1of6 s GLY 178 N 1.46 1.58 0.50 6.18 0.00 -1.26 -1.84 107.32 113.93 1of6 s GLY 178 Ca 0.05 -0.48 0.25 0.00 0.00 0.00 0.00 44.72 44.54 1of6 s GLY 178 CO -0.01 0.07 1.91 0.00 0.00 0.00 0.00 173.10 175.07 1of6 h ALA 179 N -1.48 2.53 0.00 3.20 0.00 -1.82 0.34 119.26 122.03 1of6 h ALA 179 Ca -0.50 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1of6 h ALA 179 Cb 1.33 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.14 1of6 h ALA 179 CO 0.61 -0.76 -0.37 0.54 0.00 0.00 0.00 179.25 179.27 1of6 n ARG 180 N -4.38 0.18 -0.00 0.00 1.74 -1.26 -3.76 116.66 109.19 1of6 n ARG 180 Ca 0.16 0.08 0.00 0.00 -0.77 0.00 0.00 57.85 57.32 1of6 n ARG 180 Cb 0.77 -1.64 0.00 0.00 -1.02 0.00 0.00 32.46 30.56 1of6 n ARG 180 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1of6 n THR 181 N -1.92 0.01 -0.16 0.55 -2.24 0.01 -4.71 114.28 105.83 1of6 n THR 181 Ca 0.05 -0.51 0.22 0.00 -2.27 0.00 0.00 64.05 61.55 1of6 n THR 181 Cb 0.40 1.00 0.62 0.00 -2.10 0.00 0.00 70.33 70.25 1of6 n THR 181 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 1of6 h THR 182 N 0.03 0.66 0.00 4.28 2.02 -1.38 -0.71 112.91 117.80 1of6 h THR 182 Ca 0.00 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 67.12 1of6 h THR 182 Cb 0.01 0.47 0.00 0.00 -1.74 0.00 0.00 68.15 66.89 1of6 h THR 182 CO 0.00 0.03 -0.10 -0.62 0.37 0.00 0.00 175.52 175.20 1of6 n GLU 183 N -4.39 0.07 -2.55 6.66 1.02 -1.26 -4.74 120.64 115.44 1of6 n GLU 183 Ca 0.16 0.05 -0.42 0.00 -0.02 0.00 0.00 57.16 56.93 1of6 n GLU 183 Cb 0.75 -1.57 -0.03 0.00 -0.02 0.00 0.00 31.44 30.58 1of6 n GLU 183 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1of6 s SER 184 N -3.36 7.19 0.06 1.62 0.15 -0.28 -4.92 113.70 114.16 1of6 s SER 184 Ca 0.13 1.83 -0.26 0.00 0.70 0.00 0.00 55.95 58.34 1of6 s SER 184 Cb 0.17 -2.57 -0.17 0.00 -1.71 0.00 0.00 66.02 61.74 1of6 s SER 184 CO 0.58 -0.41 1.60 -0.61 1.20 0.00 0.00 173.24 175.59 1of6 h GLN 185 N 6.93 -0.27 -0.93 5.44 5.75 -1.89 -2.05 115.11 128.09 1of6 h GLN 185 Ca -0.39 0.02 0.27 0.00 -0.15 0.00 0.00 58.65 58.40 1of6 h GLN 185 Cb 1.20 0.06 -0.15 0.00 1.07 0.00 0.00 27.48 29.66 1of6 h GLN 185 CO 0.80 -0.10 0.30 1.25 -2.65 0.00 0.00 178.83 178.43 1of6 h LEU 186 N -0.37 0.07 -0.29 -2.39 6.46 -1.96 0.11 115.31 116.94 1of6 h LEU 186 Ca -0.03 0.21 -0.17 0.00 -0.12 0.00 0.00 57.88 57.77 1of6 h LEU 186 Cb 0.29 0.27 -0.02 0.00 -0.73 0.00 0.00 40.66 40.46 1of6 h LEU 186 CO 0.05 -0.21 -0.81 0.45 -0.62 0.00 0.00 178.44 177.30 1of6 h HIS 187 N 0.18 0.00 -0.23 1.25 3.86 -1.78 -1.01 115.15 117.42 1of6 h HIS 187 Ca 0.62 0.00 -0.19 0.00 -1.16 0.00 0.00 60.37 59.64 1of6 h HIS 187 Cb 1.35 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.82 1of6 h HIS 187 CO -0.22 0.81 -0.60 0.00 0.86 0.00 0.00 177.93 178.78 1of6 h ARG 188 N 0.00 0.82 -0.47 2.45 3.08 -0.60 -1.96 114.38 117.70 1of6 h ARG 188 Ca -0.01 -0.57 -0.03 0.00 0.07 0.00 0.00 59.98 59.44 1of6 h ARG 188 Cb 1.49 0.09 -0.02 0.00 0.08 0.00 0.00 29.97 31.60 1of6 h ARG 188 CO 0.11 1.19 0.18 0.93 -1.07 0.00 0.00 179.97 181.31 1of6 h GLU 189 N 0.58 0.70 -0.43 0.04 5.08 -0.77 -2.48 114.58 117.29 1of6 h GLU 189 Ca -0.01 -0.13 -0.01 0.00 -1.00 0.00 0.00 59.36 58.21 1of6 h GLU 189 Cb 1.22 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 30.33 1of6 h GLU 189 CO 0.13 0.64 0.23 1.25 -1.00 0.00 0.00 179.01 180.26 1of6 h LEU 190 N 0.61 0.55 -2.08 1.33 5.85 -1.15 -1.08 115.31 119.34 1of6 h LEU 190 Ca 0.15 -0.10 -0.02 0.00 0.84 0.00 0.00 57.88 58.76 1of6 h LEU 190 Cb 0.20 -0.14 -0.00 0.00 0.37 0.00 0.00 40.66 41.09 1of6 h LEU 190 CO -0.01 0.49 -0.08 0.00 -0.34 0.00 0.00 178.44 178.50 1of6 h ALA 191 N 1.08 1.26 0.00 1.25 0.00 -1.22 0.24 119.26 121.87 1of6 h ALA 191 Ca 0.15 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1of6 h ALA 191 Cb 0.07 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1of6 h ALA 191 CO -0.02 0.10 0.00 0.66 0.00 0.00 0.00 179.25 179.98 1of6 h SER 192 N 0.00 0.00 -0.25 0.00 4.64 -0.72 -3.13 113.55 114.08 1of6 h SER 192 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1of6 h SER 192 Cb 0.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.35 1of6 h SER 192 CO 0.01 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.58 1of6 n GLY 193 N -0.09 2.62 3.85 -0.77 0.00 0.07 -1.68 105.19 109.19 1of6 n GLY 193 Ca 0.01 -0.28 -0.37 0.00 0.00 0.00 0.00 46.02 45.38 1of6 n GLY 193 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1of6 s LEU 194 N -0.98 4.42 0.00 0.99 1.43 -1.18 -4.95 118.68 118.40 1of6 s LEU 194 Ca 0.17 0.81 0.00 0.00 -1.03 0.00 0.00 54.13 54.09 1of6 s LEU 194 Cb 0.09 -2.62 0.00 0.00 0.03 0.00 0.00 46.19 43.69 1of6 s LEU 194 CO 0.12 0.29 0.63 -1.20 0.23 0.00 0.00 176.35 176.42 1of6 n SER 195 N 1.55 0.27 -3.86 2.29 7.64 -1.26 -4.82 113.62 115.44 1of6 n SER 195 Ca -0.13 -1.53 -0.09 0.00 1.01 0.00 0.00 58.87 58.13 1of6 n SER 195 Cb 0.53 -0.14 -0.05 0.00 -1.01 0.00 0.00 64.21 63.54 1of6 n SER 195 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 1of6 s PHE 196 N -1.64 0.13 0.38 1.43 -0.12 -1.26 -5.07 117.98 111.82 1of6 s PHE 196 Ca 0.00 -0.48 -0.28 0.00 -0.05 0.00 0.00 56.93 56.12 1of6 s PHE 196 Cb 0.00 0.22 -0.11 0.00 -0.63 0.00 0.00 43.02 42.50 1of6 s PHE 196 CO 0.00 -0.87 1.43 -2.30 -0.05 0.00 0.00 175.22 173.43 1of6 n PRO 197 N -0.31 2.48 -4.34 1.99 -0.02 -1.26 -4.81 135.00 128.74 1of6 n PRO 197 Ca -0.08 0.87 -0.32 0.00 -2.02 0.00 0.00 63.50 61.96 1of6 n PRO 197 Cb 0.62 -2.58 -0.16 0.00 -0.02 0.00 0.00 33.50 31.36 1of6 n PRO 197 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1of6 s VAL 198 N -1.12 1.94 -0.09 -1.45 1.01 -0.86 -1.43 120.40 118.39 1of6 s VAL 198 Ca 0.55 -0.88 -0.17 0.00 0.00 0.00 0.00 61.98 61.48 1of6 s VAL 198 Cb -0.49 -1.75 -0.05 0.00 0.00 0.00 0.00 36.38 34.09 1of6 s VAL 198 CO 0.63 0.52 0.43 -0.83 0.00 0.00 0.00 175.10 175.85 1of6 s GLY 199 N 1.12 2.39 -0.23 4.51 0.00 0.12 -1.18 107.32 114.05 1of6 s GLY 199 Ca -0.00 -0.23 -0.04 0.00 0.00 0.00 0.00 44.72 44.44 1of6 s GLY 199 CO -0.08 0.55 -0.02 -1.36 0.00 0.00 0.00 173.10 172.19 1of6 s PHE 200 N 0.13 2.99 0.50 1.90 0.08 0.19 -0.76 117.98 123.02 1of6 s PHE 200 Ca 0.24 -0.93 -0.19 0.00 0.12 0.00 0.00 56.93 56.17 1of6 s PHE 200 Cb -0.15 -2.13 -0.08 0.00 -0.57 0.00 0.00 43.02 40.09 1of6 s PHE 200 CO 0.10 -0.55 1.02 0.15 -0.10 0.00 0.00 175.22 175.84 1of6 s LYS 201 N 1.48 3.81 0.68 0.44 1.02 -0.77 -1.34 119.74 125.06 1of6 s LYS 201 Ca 0.05 1.21 -0.13 0.00 0.02 0.00 0.00 55.97 57.12 1of6 s LYS 201 Cb -0.15 -2.11 0.00 0.00 -0.52 0.00 0.00 37.83 35.06 1of6 s LYS 201 CO -0.02 -0.41 1.08 0.54 -0.92 0.00 0.00 175.35 175.62 1of6 s ASN 202 N -2.39 5.23 0.55 2.83 4.22 -0.81 -4.46 114.94 120.12 1of6 s ASN 202 Ca 0.64 1.81 -0.20 0.00 -2.14 0.00 0.00 52.86 52.96 1of6 s ASN 202 Cb -0.14 -2.52 -0.06 0.00 1.28 0.00 0.00 41.25 39.81 1of6 s ASN 202 CO 0.24 -1.54 1.06 0.61 -2.04 0.00 0.00 177.10 175.43 1of6 n GLY 203 N -1.20 -0.06 0.36 0.45 0.00 -0.17 -4.48 105.19 100.09 1of6 n GLY 203 Ca 0.09 -0.04 0.32 0.00 0.00 0.00 0.00 46.02 46.38 1of6 n GLY 203 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1of6 n THR 204 N -1.31 -0.25 1.93 2.61 -1.04 -1.26 -0.75 114.28 114.22 1of6 n THR 204 Ca 0.12 1.56 0.16 0.00 -2.04 0.00 0.00 64.05 63.84 1of6 n THR 204 Cb 0.45 -2.55 0.91 0.00 -1.82 0.00 0.00 70.33 67.32 1of6 n THR 204 CO 0.00 0.00 0.00 -0.90 -0.64 0.00 0.00 175.07 173.53 1of6 n ASP 205 N -4.51 0.12 0.00 8.00 5.75 -1.26 -2.81 116.55 121.85 1of6 n ASP 205 Ca 0.33 -1.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.11 1of6 n ASP 205 Cb 1.25 -0.01 0.00 0.00 -1.03 0.00 0.00 41.12 41.33 1of6 n ASP 205 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1of6 n GLY 206 N 1.03 0.77 3.88 6.12 0.00 0.07 -2.92 105.19 114.15 1of6 n GLY 206 Ca 0.23 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.96 1of6 n GLY 206 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1of6 s THR 207 N -3.13 4.79 -0.10 2.61 -4.23 -1.26 -4.82 115.64 109.51 1of6 s THR 207 Ca 0.00 0.57 0.09 0.00 -1.18 0.00 0.00 61.69 61.17 1of6 s THR 207 Cb 0.00 -3.81 -0.13 0.00 1.34 0.00 0.00 72.50 69.90 1of6 s THR 207 CO 0.00 -0.81 0.04 -0.11 -0.54 0.00 0.00 174.62 173.20 1of6 n LEU 208 N -2.03 0.00 -0.33 4.79 7.94 -1.26 -1.00 117.00 125.11 1of6 n LEU 208 Ca 0.03 0.00 0.13 0.00 -1.11 0.00 0.00 56.01 55.06 1of6 n LEU 208 Cb 0.54 0.26 0.25 0.00 0.53 0.00 0.00 43.42 45.00 1of6 n LEU 208 CO 0.52 0.26 0.73 0.59 -1.11 0.00 0.00 177.39 178.38 1of6 n ASN 209 N -2.38 -0.15 -0.11 1.96 3.02 -1.26 -0.80 115.26 115.54 1of6 n ASN 209 Ca -0.17 1.60 -0.04 0.00 -0.03 0.00 0.00 54.58 55.94 1of6 n ASN 209 Cb 0.84 -0.57 0.17 0.00 -0.61 0.00 0.00 39.78 39.61 1of6 n ASN 209 CO 0.00 0.00 0.00 -0.37 -2.62 0.00 0.00 177.26 174.27 1of6 h VAL 210 N 0.00 1.24 -0.24 2.41 -1.51 -1.96 -0.68 116.25 115.51 1of6 h VAL 210 Ca 0.55 -0.96 -0.14 0.00 -1.23 0.00 0.00 66.70 64.93 1of6 h VAL 210 Cb 1.10 0.83 -0.01 0.00 -2.13 0.00 0.00 31.29 31.08 1of6 h VAL 210 CO -0.90 0.34 -0.42 0.00 -1.23 0.00 0.00 177.57 175.36 1of6 h ALA 211 N 1.28 0.82 -0.11 5.19 0.00 -1.19 -2.21 119.26 123.04 1of6 h ALA 211 Ca 0.15 -0.45 -0.01 0.00 0.00 0.00 0.00 54.91 54.60 1of6 h ALA 211 Cb 0.42 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.10 1of6 h ALA 211 CO 0.01 0.65 0.02 0.28 0.00 0.00 0.00 179.25 180.22 1of6 h VAL 212 N 0.47 1.20 -0.46 0.00 2.07 -1.13 -1.66 116.25 116.74 1of6 h VAL 212 Ca 0.04 -0.63 0.05 0.00 0.82 0.00 0.00 66.70 66.98 1of6 h VAL 212 Cb 0.93 1.43 -0.03 0.00 -1.52 0.00 0.00 31.29 32.10 1of6 h VAL 212 CO 0.08 0.18 0.31 0.44 0.02 0.00 0.00 177.57 178.60 1of6 h ASP 213 N -0.04 0.37 -0.11 0.57 3.32 -1.11 -1.84 116.42 117.57 1of6 h ASP 213 Ca 0.03 -0.00 -0.09 0.00 0.02 0.00 0.00 57.03 56.99 1of6 h ASP 213 Cb 0.27 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.74 1of6 h ASP 213 CO 0.00 0.24 -0.29 0.00 -1.72 0.00 0.00 179.24 177.47 1of6 h ALA 214 N 1.75 0.19 -0.83 3.45 0.00 -1.08 -1.00 119.26 121.73 1of6 h ALA 214 Ca 0.20 -0.42 0.04 0.00 0.00 0.00 0.00 54.91 54.73 1of6 h ALA 214 Cb 0.25 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.96 1of6 h ALA 214 CO -0.05 0.21 0.55 0.00 0.00 0.00 0.00 179.25 179.96 1of6 h GLN 216 N 1.00 0.12 -0.65 0.00 1.08 -1.19 -2.87 115.11 112.60 1of6 h GLN 216 Ca 0.34 -0.06 -0.04 0.00 -1.45 0.00 0.00 58.65 57.44 1of6 h GLN 216 Cb 0.09 -0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.49 1of6 h GLN 216 CO -0.11 0.53 0.24 0.00 -0.95 0.00 0.00 178.83 178.55 1of6 h ALA 217 N 0.59 1.20 0.00 3.87 0.00 -0.93 -2.92 119.26 121.06 1of6 h ALA 217 Ca 0.01 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 1of6 h ALA 217 Cb 0.50 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 1of6 h ALA 217 CO 0.01 0.58 -0.10 0.00 0.00 0.00 0.00 179.25 179.74 1of6 h ALA 218 N 1.32 1.08 0.00 0.00 0.00 -0.49 -2.64 119.26 118.53 1of6 h ALA 218 Ca 0.22 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1of6 h ALA 218 Cb 0.21 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1of6 h ALA 218 CO -0.02 0.12 0.00 0.00 0.00 0.00 0.00 179.25 179.35 1of6 h ALA 219 N 1.90 1.00 -2.31 0.00 0.00 -1.30 -0.13 119.26 118.43 1of6 h ALA 219 Ca -0.00 0.00 -0.49 0.00 0.00 0.00 0.00 54.91 54.42 1of6 h ALA 219 Cb 0.47 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.27 1of6 h ALA 219 CO 0.01 0.00 -0.13 -1.01 0.00 0.00 0.00 179.25 178.12 1of6 s HIS 220 N -3.53 3.50 0.29 0.00 3.76 -1.00 -3.91 115.29 114.41 1of6 s HIS 220 Ca 0.02 0.51 -0.29 0.00 -0.15 0.00 0.00 55.06 55.15 1of6 s HIS 220 Cb 0.09 -2.02 -0.10 0.00 1.11 0.00 0.00 32.58 31.66 1of6 s HIS 220 CO 0.48 0.07 1.25 0.45 -0.85 0.00 0.00 174.74 176.14 1of6 s SER 221 N -3.80 6.94 0.24 1.40 0.15 -1.26 -3.74 113.70 113.63 1of6 s SER 221 Ca 0.42 2.50 0.01 0.00 0.70 0.00 0.00 55.95 59.58 1of6 s SER 221 Cb -0.10 -2.63 -0.05 0.00 -1.71 0.00 0.00 66.02 61.53 1of6 s SER 221 CO 0.36 -0.42 0.10 -1.00 1.20 0.00 0.00 173.24 173.48 1of6 s HIS 222 N -0.86 1.41 -0.09 3.44 3.76 -1.24 -4.94 115.29 116.77 1of6 s HIS 222 Ca 0.49 -1.23 0.04 0.00 -0.15 0.00 0.00 55.06 54.22 1of6 s HIS 222 Cb -0.37 -0.79 -0.01 0.00 1.11 0.00 0.00 32.58 32.53 1of6 s HIS 222 CO 0.46 -0.42 -0.23 -1.01 -0.85 0.00 0.00 174.74 172.70 1of6 s HIS 223 N -3.87 2.55 0.07 1.40 3.76 -1.26 -0.40 115.29 117.55 1of6 s HIS 223 Ca 0.37 -0.87 -0.12 0.00 -0.15 0.00 0.00 55.06 54.30 1of6 s HIS 223 Cb 0.08 -1.69 0.01 0.00 1.11 0.00 0.00 32.58 32.09 1of6 s HIS 223 CO 0.13 -0.31 0.26 -0.59 -0.85 0.00 0.00 174.74 173.37 1of6 s PHE 224 N 0.14 -0.00 -0.67 1.40 -0.12 -0.62 -4.96 117.98 113.15 1of6 s PHE 224 Ca -0.12 -0.27 -0.23 0.00 -0.05 0.00 0.00 56.93 56.26 1of6 s PHE 224 Cb -0.16 0.04 0.07 0.00 -0.63 0.00 0.00 43.02 42.34 1of6 s PHE 224 CO 0.07 -0.53 0.99 -1.64 -0.05 0.00 0.00 175.22 174.06 1of6 s MET 225 N -3.16 3.12 0.00 1.99 -1.94 -1.26 -0.41 119.30 117.64 1of6 s MET 225 Ca -0.01 -0.78 0.00 0.00 -1.71 0.00 0.00 55.69 53.19 1of6 s MET 225 Cb 0.01 -4.23 0.00 0.00 2.01 0.00 0.00 34.83 32.63 1of6 s MET 225 CO -0.07 -1.85 0.00 0.41 -0.01 0.00 0.00 175.02 173.50 1of6 n GLY 226 N 5.33 5.46 3.21 -0.03 0.00 -0.72 -4.91 105.19 113.53 1of6 n GLY 226 Ca -0.03 -2.03 -0.21 0.00 0.00 0.00 0.00 46.02 43.74 1of6 n GLY 226 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1of6 s VAL 227 N 1.39 1.36 0.88 1.61 -7.23 -1.26 -1.29 120.40 115.87 1of6 s VAL 227 Ca 0.00 -1.31 -0.13 0.00 -1.81 0.00 0.00 61.98 58.73 1of6 s VAL 227 Cb 0.00 -1.25 0.15 0.00 0.56 0.00 0.00 36.38 35.83 1of6 s VAL 227 CO 0.00 -0.08 1.24 0.42 -0.31 0.00 0.00 175.10 176.37 1of6 s THR 228 N -1.10 2.02 0.38 5.32 -4.23 -0.16 -4.88 115.64 112.99 1of6 s THR 228 Ca 0.02 -0.04 0.09 0.00 -1.18 0.00 0.00 61.69 60.58 1of6 s THR 228 Cb -0.09 -2.98 0.16 0.00 1.34 0.00 0.00 72.50 70.92 1of6 s THR 228 CO 0.03 0.00 1.91 0.11 -0.54 0.00 0.00 174.62 176.12 1of6 h LYS 229 N -1.33 0.24 -0.44 3.99 1.79 -1.95 0.10 116.57 118.98 1of6 h LYS 229 Ca -0.45 -0.06 0.00 0.00 -2.18 0.00 0.00 60.65 57.97 1of6 h LYS 229 Cb 1.27 -0.03 0.00 0.00 -1.58 0.00 0.00 32.23 31.89 1of6 h LYS 229 CO 0.49 0.39 0.00 0.72 -1.08 0.00 0.00 179.45 179.97 1of6 n HIS 230 N -4.27 0.32 -1.47 -1.35 8.25 -1.26 -0.95 115.22 114.49 1of6 n HIS 230 Ca -0.01 -0.13 0.00 0.00 -0.26 0.00 0.00 57.72 57.32 1of6 n HIS 230 Cb 0.27 -0.07 0.00 0.00 1.12 0.00 0.00 29.99 31.31 1of6 n HIS 230 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1of6 n GLY 231 N 0.54 0.42 3.51 -1.41 0.00 0.36 -4.86 105.19 103.76 1of6 n GLY 231 Ca 0.06 -0.95 -0.34 0.00 0.00 0.00 0.00 46.02 44.80 1of6 n GLY 231 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1of6 s VAL 232 N -2.00 3.60 0.41 1.61 1.01 -1.25 -4.84 120.40 118.94 1of6 s VAL 232 Ca 0.00 -0.49 -0.26 0.00 0.00 0.00 0.00 61.98 61.23 1of6 s VAL 232 Cb 0.00 -2.51 -0.09 0.00 0.00 0.00 0.00 36.38 33.78 1of6 s VAL 232 CO 0.00 0.55 1.34 0.00 0.00 0.00 0.00 175.10 176.99 1of6 s ALA 233 N -0.24 3.28 0.09 5.51 0.00 -1.26 -0.99 121.76 128.15 1of6 s ALA 233 Ca 0.03 1.30 -0.22 0.00 0.00 0.00 0.00 51.96 53.07 1of6 s ALA 233 Cb -0.13 -3.51 0.06 0.00 0.00 0.00 0.00 23.12 19.54 1of6 s ALA 233 CO 0.03 -0.91 0.55 0.00 0.00 0.00 0.00 175.76 175.43 1of6 s ALA 234 N -1.24 -1.41 -0.22 0.00 0.00 -0.41 -4.88 121.76 113.61 1of6 s ALA 234 Ca 0.57 0.52 -0.25 0.00 0.00 0.00 0.00 51.96 52.81 1of6 s ALA 234 Cb -0.40 0.59 -0.01 0.00 0.00 0.00 0.00 23.12 23.31 1of6 s ALA 234 CO 0.51 -0.62 0.82 0.42 0.00 0.00 0.00 175.76 176.89 1of6 s ILE 235 N -3.05 4.86 -0.21 0.00 1.01 -1.26 -1.76 121.20 120.80 1of6 s ILE 235 Ca -0.02 1.56 -0.05 0.00 0.00 0.00 0.00 60.65 62.14 1of6 s ILE 235 Cb -0.00 -4.11 -0.02 0.00 0.01 0.00 0.00 42.46 38.33 1of6 s ILE 235 CO -0.07 -0.03 0.01 -0.89 0.00 0.00 0.00 174.94 173.96 1of6 s THR 236 N 2.56 3.95 -0.17 2.92 2.01 0.45 -4.96 115.64 122.41 1of6 s THR 236 Ca 0.36 -0.31 -0.10 0.00 0.31 0.00 0.00 61.69 61.94 1of6 s THR 236 Cb -0.16 -2.80 -0.05 0.00 0.01 0.00 0.00 72.50 69.51 1of6 s THR 236 CO 0.09 0.42 0.17 -0.89 -0.69 0.00 0.00 174.62 173.72 1of6 s THR 237 N 1.12 5.40 0.29 -0.82 2.01 -1.26 -1.59 115.64 120.79 1of6 s THR 237 Ca 0.03 0.28 0.07 0.00 0.31 0.00 0.00 61.69 62.38 1of6 s THR 237 Cb -0.14 -3.49 -0.03 0.00 0.01 0.00 0.00 72.50 68.85 1of6 s THR 237 CO 0.01 0.48 0.29 0.42 -0.69 0.00 0.00 174.62 175.13 1of6 s THR 238 N -0.01 4.23 -0.28 -0.82 -4.23 0.47 -4.96 115.64 110.04 1of6 s THR 238 Ca 0.12 -1.28 0.22 0.00 -1.18 0.00 0.00 61.69 59.57 1of6 s THR 238 Cb -0.12 -3.40 -0.16 0.00 1.34 0.00 0.00 72.50 70.15 1of6 s THR 238 CO 0.01 -0.27 0.82 1.17 -0.54 0.00 0.00 174.62 175.82 1of6 n LYS 239 N -1.34 0.53 0.00 3.99 4.81 -1.25 -3.68 118.16 121.22 1of6 n LYS 239 Ca -0.05 -0.03 0.00 0.00 -0.87 0.00 0.00 58.31 57.35 1of6 n LYS 239 Cb 0.58 -1.64 0.00 0.00 0.02 0.00 0.00 35.03 33.99 1of6 n LYS 239 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1of6 n GLY 240 N 1.27 0.94 2.92 3.14 0.00 -0.68 -4.32 105.19 108.46 1of6 n GLY 240 Ca -0.01 -1.63 -0.30 0.00 0.00 0.00 0.00 46.02 44.09 1of6 n GLY 240 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1of6 s ASN 241 N -0.75 3.69 0.00 1.61 3.84 -0.06 -4.87 114.94 118.39 1of6 s ASN 241 Ca 0.00 -1.10 0.27 0.00 0.21 0.00 0.00 52.86 52.24 1of6 s ASN 241 Cb 0.00 -1.11 0.77 0.00 -0.55 0.00 0.00 41.25 40.36 1of6 s ASN 241 CO 0.00 -0.23 1.59 -1.84 -2.79 0.00 0.00 177.10 173.82 1of6 n GLU 242 N 4.72 1.81 -1.60 0.43 0.00 -1.26 -3.64 120.64 121.10 1of6 n GLU 242 Ca -0.12 -1.23 -0.34 0.00 0.00 0.00 0.00 57.16 55.48 1of6 n GLU 242 Cb 0.45 -1.47 0.06 0.00 0.00 0.00 0.00 31.44 30.47 1of6 n GLU 242 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 1of6 n HIS 243 N 0.48 3.13 -3.73 -1.84 8.25 -1.26 -4.90 115.22 115.34 1of6 n HIS 243 Ca 0.17 -2.79 -0.37 0.00 -0.26 0.00 0.00 57.72 54.48 1of6 n HIS 243 Cb 0.43 -1.18 -0.06 0.00 1.12 0.00 0.00 29.99 30.30 1of6 n HIS 243 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1of6 s PHE 245 N -0.66 1.27 -0.14 0.00 -0.71 -0.33 -4.57 117.98 112.84 1of6 s PHE 245 Ca 0.16 -1.43 -0.11 0.00 -1.04 0.00 0.00 56.93 54.52 1of6 s PHE 245 Cb -0.13 -0.59 -0.05 0.00 -1.21 0.00 0.00 43.02 41.04 1of6 s PHE 245 CO 0.05 -0.67 0.20 0.08 -1.34 0.00 0.00 175.22 173.54 1of6 s VAL 246 N -4.03 5.38 -0.13 -2.49 1.01 -1.26 -0.63 120.40 118.24 1of6 s VAL 246 Ca 0.39 0.35 -0.01 0.00 0.00 0.00 0.00 61.98 62.72 1of6 s VAL 246 Cb 0.06 -3.51 -0.02 0.00 0.00 0.00 0.00 36.38 32.91 1of6 s VAL 246 CO 0.15 0.50 -0.10 -0.63 0.00 0.00 0.00 175.10 175.02 1of6 s ILE 247 N -0.20 3.33 -0.32 2.22 1.01 -0.45 -0.84 121.20 125.95 1of6 s ILE 247 Ca 0.14 -0.56 -0.13 0.00 0.00 0.00 0.00 60.65 60.10 1of6 s ILE 247 Cb -0.12 -2.42 -0.03 0.00 0.01 0.00 0.00 42.46 39.90 1of6 s ILE 247 CO 0.03 0.52 0.24 -0.76 0.00 0.00 0.00 174.94 174.97 1of6 s LEU 248 N 0.28 4.38 -0.01 2.97 1.43 -0.14 -1.92 118.68 125.68 1of6 s LEU 248 Ca -0.08 -0.29 0.01 0.00 -1.03 0.00 0.00 54.13 52.75 1of6 s LEU 248 Cb -0.15 -2.16 0.02 0.00 0.03 0.00 0.00 46.19 43.93 1of6 s LEU 248 CO 0.05 -0.20 0.98 -2.11 0.23 0.00 0.00 176.35 175.30 1of6 n ARG 249 N 5.12 0.08 0.00 1.70 -4.01 -1.26 -0.75 116.66 117.54 1of6 n ARG 249 Ca -0.13 -1.05 0.00 0.00 -1.04 0.00 0.00 57.85 55.63 1of6 n ARG 249 Cb 0.50 -0.55 0.00 0.00 -3.04 0.00 0.00 32.46 29.37 1of6 n ARG 249 CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 1of6 n GLY 250 N -0.08 -0.39 0.00 2.89 0.00 -1.26 -1.86 105.19 104.50 1of6 n GLY 250 Ca 0.01 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 44.95 1of6 n GLY 250 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1of6 n GLY 251 N 0.00 0.77 0.27 -0.02 0.00 -1.16 -4.18 105.19 100.87 1of6 n GLY 251 Ca 0.00 -1.90 0.12 0.00 0.00 0.00 0.00 46.02 44.24 1of6 n GLY 251 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1of6 h LYS 252 N 0.00 0.00 -0.59 1.61 1.57 -1.60 0.33 116.57 117.89 1of6 h LYS 252 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1of6 h LYS 252 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1of6 h LYS 252 CO 0.00 0.03 0.00 1.63 -0.57 0.00 0.00 179.45 180.54 1of6 n LYS 253 N -4.10 2.20 0.00 3.15 5.02 -1.15 -4.97 118.16 118.32 1of6 n LYS 253 Ca -0.03 -1.22 0.00 0.00 -2.02 0.00 0.00 58.31 55.04 1of6 n LYS 253 Cb 0.12 -1.55 0.00 0.00 -0.02 0.00 0.00 35.03 33.57 1of6 n LYS 253 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1of6 n GLY 254 N 0.60 0.24 3.68 0.72 0.00 0.11 -4.95 105.19 105.58 1of6 n GLY 254 Ca 0.11 -1.97 -0.36 0.00 0.00 0.00 0.00 46.02 43.80 1of6 n GLY 254 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1of6 n THR 255 N 0.16 3.63 -2.66 2.61 -2.24 -1.26 -3.01 114.28 111.51 1of6 n THR 255 Ca 0.00 -0.40 -0.00 0.00 -2.27 0.00 0.00 64.05 61.38 1of6 n THR 255 Cb 0.00 -1.28 0.04 0.00 -2.10 0.00 0.00 70.33 66.99 1of6 n THR 255 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 1of6 n ASN 256 N -2.02 1.63 -0.24 3.42 0.23 -1.26 -4.87 115.26 112.14 1of6 n ASN 256 Ca 0.14 -2.18 0.10 0.00 -0.53 0.00 0.00 54.58 52.12 1of6 n ASN 256 Cb 0.49 -0.42 -0.06 0.00 -2.08 0.00 0.00 39.78 37.71 1of6 n ASN 256 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1of6 n TYR 257 N -0.31 0.00 -1.95 -2.53 0.18 -1.26 -4.41 117.16 106.87 1of6 n TYR 257 Ca 0.09 0.00 -0.29 0.00 1.88 0.00 0.00 57.90 59.58 1of6 n TYR 257 Cb 0.91 0.00 0.06 0.00 -0.38 0.00 0.00 39.34 39.93 1of6 n TYR 257 CO 0.00 0.00 0.00 0.16 -2.08 0.00 0.00 176.86 174.94 1of6 s ASP 258 N -2.67 5.11 0.28 9.48 -4.77 -1.26 -4.62 116.67 118.21 1of6 s ASP 258 Ca 0.13 0.94 0.01 0.00 -3.30 0.00 0.00 52.55 50.32 1of6 s ASP 258 Cb 0.16 -1.64 0.64 0.00 -1.09 0.00 0.00 42.92 41.00 1of6 s ASP 258 CO 0.70 -1.52 1.68 0.00 0.70 0.00 0.00 175.17 176.73 1of6 h ALA 259 N -0.74 1.24 -0.14 2.11 0.00 -1.95 0.27 119.26 120.06 1of6 h ALA 259 Ca -0.45 0.18 -0.12 0.00 0.00 0.00 0.00 54.91 54.52 1of6 h ALA 259 Cb 1.28 0.22 0.00 0.00 0.00 0.00 0.00 17.79 19.30 1of6 h ALA 259 CO 0.64 -0.37 -0.37 0.87 0.00 0.00 0.00 179.25 180.01 1of6 h LYS 260 N 0.31 0.50 -0.60 0.00 1.57 -1.98 -1.41 116.57 114.95 1of6 h LYS 260 Ca 0.51 -0.35 -0.05 0.00 -1.87 0.00 0.00 60.65 58.90 1of6 h LYS 260 Cb 0.97 0.06 -0.03 0.00 0.08 0.00 0.00 32.23 33.31 1of6 h LYS 260 CO -0.56 0.97 0.20 0.77 -0.57 0.00 0.00 179.45 180.25 1of6 h SER 261 N 0.11 0.88 -0.67 0.86 0.02 -1.77 -0.97 113.55 112.00 1of6 h SER 261 Ca -0.01 -0.20 0.03 0.00 -0.84 0.00 0.00 61.79 60.77 1of6 h SER 261 Cb 0.99 -0.23 -0.04 0.00 0.14 0.00 0.00 62.40 63.26 1of6 h SER 261 CO 0.08 0.85 0.44 0.58 -1.14 0.00 0.00 176.83 177.64 1of6 h VAL 262 N 0.86 1.09 -0.04 2.27 2.07 -0.34 -1.38 116.25 120.79 1of6 h VAL 262 Ca 0.20 -0.27 -0.18 0.00 0.82 0.00 0.00 66.70 67.26 1of6 h VAL 262 Cb 0.28 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 30.26 1of6 h VAL 262 CO -0.01 0.15 -0.77 0.00 0.02 0.00 0.00 177.57 176.96 1of6 h ALA 263 N 1.61 0.61 -0.00 1.67 0.00 -0.99 -1.03 119.26 121.13 1of6 h ALA 263 Ca 0.27 -0.65 -0.13 0.00 0.00 0.00 0.00 54.91 54.40 1of6 h ALA 263 Cb 0.08 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1of6 h ALA 263 CO -0.08 0.82 -0.62 1.49 0.00 0.00 0.00 179.25 180.87 1of6 h GLU 264 N 0.18 0.01 -0.05 0.00 4.81 -0.76 -2.02 114.58 116.75 1of6 h GLU 264 Ca -0.03 -0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.16 1of6 h GLU 264 Cb 1.35 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.74 1of6 h GLU 264 CO 0.12 0.62 -0.09 0.00 -0.73 0.00 0.00 179.01 178.93 1of6 h ALA 265 N 1.38 0.07 -0.54 2.92 0.00 -1.06 -2.75 119.26 119.28 1of6 h ALA 265 Ca -0.01 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 1of6 h ALA 265 Cb 1.09 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.84 1of6 h ALA 265 CO 0.08 -0.07 0.29 0.87 0.00 0.00 0.00 179.25 180.42 1of6 h LYS 266 N -0.37 0.74 0.00 0.00 1.57 -1.09 -1.51 116.57 115.91 1of6 h LYS 266 Ca 0.00 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.71 1of6 h LYS 266 Cb 0.68 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.84 1of6 h LYS 266 CO 0.02 0.55 0.00 0.00 -0.57 0.00 0.00 179.45 179.46 1of6 n ALA 267 N -2.45 2.00 0.73 3.86 0.00 -0.77 -1.86 120.51 122.02 1of6 n ALA 267 Ca 0.05 -0.08 0.12 0.00 0.00 0.00 0.00 53.44 53.53 1of6 n ALA 267 Cb 0.10 -1.34 0.17 0.00 0.00 0.00 0.00 19.45 18.38 1of6 n ALA 267 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1of6 n GLN 268 N -1.44 0.18 -3.16 0.00 6.02 -0.58 -4.92 117.38 113.48 1of6 n GLN 268 Ca 0.06 0.04 -0.40 0.00 -0.01 0.00 0.00 57.00 56.69 1of6 n GLN 268 Cb 0.22 -1.60 -0.06 0.00 1.02 0.00 0.00 30.24 29.83 1of6 n GLN 268 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1of6 s LEU 269 N -3.70 4.15 0.84 1.08 1.43 -0.78 -5.03 118.68 116.68 1of6 s LEU 269 Ca 0.08 0.80 -0.13 0.00 -1.03 0.00 0.00 54.13 53.84 1of6 s LEU 269 Cb 0.15 -2.84 0.07 0.00 0.03 0.00 0.00 46.19 43.60 1of6 s LEU 269 CO 0.73 -0.23 0.96 -0.81 0.23 0.00 0.00 176.35 177.22 1of6 n PRO 270 N 4.90 0.01 -1.56 1.29 -0.04 -1.26 -4.90 135.00 133.43 1of6 n PRO 270 Ca -0.02 0.07 -0.55 0.00 -0.04 0.00 0.00 63.50 62.96 1of6 n PRO 270 Cb 0.50 -2.24 -0.07 0.00 -0.04 0.00 0.00 33.50 31.65 1of6 n PRO 270 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1of6 n ALA 271 N -3.38 -1.97 -3.34 0.55 0.00 -1.26 -2.52 120.51 108.59 1of6 n ALA 271 Ca 0.12 0.55 -0.18 0.00 0.00 0.00 0.00 53.44 53.92 1of6 n ALA 271 Cb 0.51 -1.96 0.06 0.00 0.00 0.00 0.00 19.45 18.07 1of6 n ALA 271 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1of6 n GLY 272 N 2.20 -0.23 3.86 0.00 0.00 -1.26 -5.00 105.19 104.75 1of6 n GLY 272 Ca 0.19 0.05 -0.31 0.00 0.00 0.00 0.00 46.02 45.96 1of6 n GLY 272 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1of6 s SER 273 N -3.38 6.47 0.99 1.61 0.01 -1.05 -5.09 113.70 113.26 1of6 s SER 273 Ca 0.40 1.41 -0.11 0.00 1.31 0.00 0.00 55.95 58.95 1of6 s SER 273 Cb -0.18 -2.45 0.18 0.00 0.21 0.00 0.00 66.02 63.79 1of6 s SER 273 CO 0.58 -0.63 1.09 0.20 0.41 0.00 0.00 173.24 174.88 1of6 s ASN 274 N -3.47 2.48 0.81 2.44 0.01 -1.26 -4.98 114.94 110.96 1of6 s ASN 274 Ca 0.56 1.72 -0.11 0.00 -0.71 0.00 0.00 52.86 54.32 1of6 s ASN 274 Cb -0.10 -2.35 0.08 0.00 0.41 0.00 0.00 41.25 39.29 1of6 s ASN 274 CO 0.39 -3.30 1.12 -0.83 -1.51 0.00 0.00 177.10 172.97 1of6 s GLY 275 N -2.89 1.79 0.33 0.66 0.00 0.38 -4.88 107.32 102.72 1of6 s GLY 275 Ca 0.66 0.47 -0.15 0.00 0.00 0.00 0.00 44.72 45.70 1of6 s GLY 275 CO 0.60 0.85 0.74 1.08 0.00 0.00 0.00 173.10 176.36 1of6 s LEU 276 N -6.00 4.04 0.07 0.66 1.43 -0.10 -4.30 118.68 114.49 1of6 s LEU 276 Ca 0.65 1.27 0.06 0.00 -1.03 0.00 0.00 54.13 55.08 1of6 s LEU 276 Cb -0.21 -4.08 -0.04 0.00 0.03 0.00 0.00 46.19 41.90 1of6 s LEU 276 CO 0.54 -0.22 -0.12 -0.32 0.23 0.00 0.00 176.35 176.47 1of6 s MET 277 N -3.05 2.20 -0.17 1.70 -2.45 -0.02 -1.72 119.30 115.79 1of6 s MET 277 Ca 0.54 -0.95 0.01 0.00 -1.25 0.00 0.00 55.69 54.04 1of6 s MET 277 Cb -0.10 -2.31 0.02 0.00 1.25 0.00 0.00 34.83 33.68 1of6 s MET 277 CO 0.18 0.54 -0.20 0.42 1.05 0.00 0.00 175.02 177.01 1of6 s ILE 278 N -1.09 2.05 -0.34 10.11 1.01 -0.10 -0.96 121.20 131.88 1of6 s ILE 278 Ca 0.18 -0.94 -0.27 0.00 0.00 0.00 0.00 60.65 59.63 1of6 s ILE 278 Cb -0.11 -1.84 0.01 0.00 0.01 0.00 0.00 42.46 40.53 1of6 s ILE 278 CO 0.10 0.54 0.96 -0.62 0.00 0.00 0.00 174.94 175.91 1of6 s ASP 279 N 1.21 6.77 0.34 3.58 2.15 0.07 -0.47 116.67 130.32 1of6 s ASP 279 Ca 0.03 0.78 0.26 0.00 0.43 0.00 0.00 52.55 54.05 1of6 s ASP 279 Cb -0.13 -2.48 0.91 0.00 -0.30 0.00 0.00 42.92 40.91 1of6 s ASP 279 CO -0.11 -0.82 1.77 1.88 -0.17 0.00 0.00 175.17 177.72 1of6 h TYR 280 N 8.26 0.00 -3.00 -5.34 -1.99 -1.52 -3.41 116.97 109.97 1of6 h TYR 280 Ca -0.22 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.51 1of6 h TYR 280 Cb 1.07 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.80 1of6 h TYR 280 CO 0.82 0.00 0.00 0.45 -0.00 0.00 0.00 178.16 179.43 1of6 n SER 281 N -2.57 0.67 0.00 3.88 2.88 -1.26 -3.70 113.62 113.51 1of6 n SER 281 Ca 0.03 -0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.57 1of6 n SER 281 Cb 0.36 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.82 1of6 n SER 281 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 1of6 n HIS 282 N -0.00 0.00 -0.29 0.66 8.25 -1.26 -1.91 115.22 120.67 1of6 n HIS 282 Ca 0.00 0.00 0.27 0.00 -0.26 0.00 0.00 57.72 57.73 1of6 n HIS 282 Cb 0.00 0.01 0.62 0.00 1.12 0.00 0.00 29.99 31.75 1of6 n HIS 282 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 1of6 h GLY 283 N 0.00 0.58 1.70 -1.41 0.00 -1.68 -2.19 103.07 100.07 1of6 h GLY 283 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 47.23 1of6 h GLY 283 CO 0.00 -0.06 0.00 0.70 0.00 0.00 0.00 176.54 177.18 1of6 n ASN 284 N -4.41 0.00 -0.81 0.19 3.02 -0.80 -2.41 115.26 110.04 1of6 n ASN 284 Ca 0.23 0.15 0.08 0.00 -0.03 0.00 0.00 54.58 55.02 1of6 n ASN 284 Cb 0.99 -0.35 0.16 0.00 -0.61 0.00 0.00 39.78 39.97 1of6 n ASN 284 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1of6 n SER 285 N -1.35 2.95 0.00 6.41 7.64 -0.82 -4.83 113.62 123.62 1of6 n SER 285 Ca 0.08 -1.87 0.00 0.00 1.01 0.00 0.00 58.87 58.09 1of6 n SER 285 Cb 0.18 -0.21 0.00 0.00 -1.01 0.00 0.00 64.21 63.18 1of6 n SER 285 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 1of6 n ASN 286 N 0.93 0.00 0.00 6.43 6.94 -1.01 -1.73 115.26 126.82 1of6 n ASN 286 Ca 0.14 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.70 1of6 n ASN 286 Cb 0.46 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.88 1of6 n ASN 286 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 1of6 n LYS 287 N 0.00 0.00 -3.95 -3.83 4.01 -1.26 -4.98 118.16 108.15 1of6 n LYS 287 Ca 0.00 0.00 -0.30 0.00 -0.51 0.00 0.00 58.31 57.50 1of6 n LYS 287 Cb 0.00 -2.06 -0.15 0.00 -0.51 0.00 0.00 35.03 32.31 1of6 n LYS 287 CO 0.00 0.00 0.00 0.34 -1.11 0.00 0.00 177.40 176.63 1of6 s ASP 288 N -3.00 3.94 0.61 4.39 -1.08 -0.71 -5.01 116.67 115.82 1of6 s ASP 288 Ca 0.00 -1.25 0.32 0.00 -0.52 0.00 0.00 52.55 51.10 1of6 s ASP 288 Cb 0.00 -1.22 1.86 0.00 -1.46 0.00 0.00 42.92 42.11 1of6 s ASP 288 CO 0.00 -0.24 2.20 2.19 0.52 0.00 0.00 175.17 179.84 1of6 h PHE 289 N 7.93 0.00 0.00 -5.34 -0.00 -1.86 -1.39 116.94 116.28 1of6 h PHE 289 Ca -0.17 0.00 0.00 0.00 -0.00 0.00 0.00 57.97 57.80 1of6 h PHE 289 Cb 1.06 0.00 0.00 0.00 -0.00 0.00 0.00 35.95 37.01 1of6 h PHE 289 CO 0.50 0.00 0.00 0.00 -0.00 0.00 0.00 178.31 178.81 1of6 h ARG 290 N 0.00 0.00 0.00 6.09 3.08 -1.93 -2.60 114.38 119.02 1of6 h ARG 290 Ca 0.03 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.08 1of6 h ARG 290 Cb 0.21 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.26 1of6 h ARG 290 CO -0.00 0.00 0.00 0.09 -1.07 0.00 0.00 179.97 178.99 1of6 n ASN 291 N -2.99 0.55 -0.21 7.04 3.02 -0.52 -3.84 115.26 118.31 1of6 n ASN 291 Ca -0.00 0.70 -0.06 0.00 -0.03 0.00 0.00 54.58 55.18 1of6 n ASN 291 Cb 0.22 -0.79 0.03 0.00 -0.61 0.00 0.00 39.78 38.64 1of6 n ASN 291 CO 0.00 0.00 0.00 1.56 -2.62 0.00 0.00 177.26 176.20 1of6 h GLN 292 N 0.00 0.81 -0.06 3.52 4.20 -1.66 -1.11 115.11 120.81 1of6 h GLN 292 Ca 0.00 -0.08 0.02 0.00 0.06 0.00 0.00 58.65 58.65 1of6 h GLN 292 Cb 0.16 -0.17 -0.00 0.00 0.30 0.00 0.00 27.48 27.76 1of6 h GLN 292 CO 0.00 0.59 0.05 -1.35 -0.67 0.00 0.00 178.83 177.45 1of6 h PRO 293 N 0.81 0.00 -0.09 1.46 0.11 -1.83 -1.33 132.00 131.13 1of6 h PRO 293 Ca 0.21 0.00 -0.22 0.00 0.11 0.00 0.00 66.00 66.10 1of6 h PRO 293 Cb -0.01 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.10 1of6 h PRO 293 CO -0.04 0.00 -0.83 0.87 -0.21 0.00 0.00 178.00 177.79 1of6 h LYS 294 N 0.00 0.62 -0.42 1.05 1.57 -1.54 -2.12 116.57 115.73 1of6 h LYS 294 Ca 0.03 -0.55 -0.00 0.00 -1.87 0.00 0.00 60.65 58.26 1of6 h LYS 294 Cb 0.13 0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.55 1of6 h LYS 294 CO -0.00 1.17 0.26 0.28 -0.57 0.00 0.00 179.45 180.59 1of6 h VAL 295 N 0.41 1.13 -0.29 0.50 2.07 -0.91 -2.34 116.25 116.82 1of6 h VAL 295 Ca -0.06 -0.30 0.07 0.00 0.82 0.00 0.00 66.70 67.22 1of6 h VAL 295 Cb 1.45 0.57 -0.07 0.00 -1.52 0.00 0.00 31.29 31.72 1of6 h VAL 295 CO 0.16 0.13 -0.15 -1.13 0.02 0.00 0.00 177.57 176.60 1of6 h ASN 296 N 0.56 -0.50 -0.67 0.57 -1.24 -1.12 -0.90 115.58 112.28 1of6 h ASN 296 Ca 0.15 0.12 0.08 0.00 0.71 0.00 0.00 56.30 57.36 1of6 h ASN 296 Cb -0.01 0.27 -0.07 0.00 0.73 0.00 0.00 38.32 39.25 1of6 h ASN 296 CO -0.03 -0.18 0.33 0.44 -1.29 0.00 0.00 177.43 176.70 1of6 h ASP 297 N -0.11 0.44 -0.19 1.15 3.32 -1.24 0.61 116.42 120.40 1of6 h ASP 297 Ca 0.15 0.05 -0.08 0.00 0.02 0.00 0.00 57.03 57.17 1of6 h ASP 297 Cb 0.34 -0.02 -0.02 0.00 0.22 0.00 0.00 39.33 39.85 1of6 h ASP 297 CO -0.36 0.26 -0.15 0.58 -1.72 0.00 0.00 179.24 177.85 1of6 h VAL 298 N 0.58 1.25 0.09 -1.35 2.07 -0.86 -1.66 116.25 116.37 1of6 h VAL 298 Ca 0.33 -1.13 -0.24 0.00 0.82 0.00 0.00 66.70 66.47 1of6 h VAL 298 Cb 0.32 1.16 0.02 0.00 -1.52 0.00 0.00 31.29 31.27 1of6 h VAL 298 CO -0.25 0.37 -0.99 0.58 0.02 0.00 0.00 177.57 177.31 1of6 h VAL 299 N 0.54 1.37 -0.64 2.57 2.07 -0.61 -3.20 116.25 118.34 1of6 h VAL 299 Ca 0.09 -2.37 0.10 0.00 0.82 0.00 0.00 66.70 65.34 1of6 h VAL 299 Cb 0.57 2.77 -0.07 0.00 -1.52 0.00 0.00 31.29 33.03 1of6 h VAL 299 CO 0.04 0.70 0.26 0.00 0.02 0.00 0.00 177.57 178.59 1of6 h GLU 301 N 0.45 0.45 -0.62 0.00 4.81 -1.38 0.35 114.58 118.64 1of6 h GLU 301 Ca 0.33 -0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.47 1of6 h GLU 301 Cb 0.40 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.65 1of6 h GLU 301 CO -0.31 0.30 0.15 1.96 -0.73 0.00 0.00 179.01 180.37 1of6 h GLN 302 N 0.46 0.99 0.34 1.92 4.20 -1.46 -2.26 115.11 119.30 1of6 h GLN 302 Ca 0.26 -0.24 -0.02 0.00 0.06 0.00 0.00 58.65 58.71 1of6 h GLN 302 Cb 0.24 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 27.89 1of6 h GLN 302 CO -0.22 0.91 -0.16 0.82 -0.67 0.00 0.00 178.83 179.50 1of6 h ILE 303 N 0.91 0.67 -0.98 2.54 2.04 -0.76 -0.65 117.51 121.28 1of6 h ILE 303 Ca 0.19 -0.39 0.32 0.00 1.00 0.00 0.00 64.86 65.99 1of6 h ILE 303 Cb 0.36 0.87 -0.16 0.00 -0.74 0.00 0.00 36.82 37.16 1of6 h ILE 303 CO 0.00 0.08 0.47 0.00 0.00 0.00 0.00 178.15 178.70 1of6 h ALA 304 N -0.10 1.83 -0.41 1.87 0.00 -0.33 -0.28 119.26 121.84 1of6 h ALA 304 Ca -0.05 0.22 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1of6 h ALA 304 Cb 0.48 0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1of6 h ALA 304 CO 0.08 -0.63 0.00 0.09 0.00 0.00 0.00 179.25 178.79 1of6 n ASN 305 N -5.15 2.40 0.00 0.00 3.02 -0.85 -3.93 115.26 110.74 1of6 n ASN 305 Ca 0.31 -2.06 0.00 0.00 -0.03 0.00 0.00 54.58 52.79 1of6 n ASN 305 Cb 0.98 -0.32 0.00 0.00 -0.61 0.00 0.00 39.78 39.83 1of6 n ASN 305 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1of6 n GLY 306 N 1.06 1.19 3.59 7.41 0.00 -0.12 -5.05 105.19 113.27 1of6 n GLY 306 Ca 0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.74 1of6 n GLY 306 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1of6 s GLU 307 N -0.47 3.44 0.00 1.61 2.56 -0.26 -4.86 118.70 120.72 1of6 s GLU 307 Ca 0.00 0.69 0.24 0.00 0.00 0.00 0.00 54.97 55.91 1of6 s GLU 307 Cb 0.00 -4.07 0.36 0.00 2.00 0.00 0.00 34.13 32.42 1of6 s GLU 307 CO 0.00 -1.74 1.31 0.09 -0.56 0.00 0.00 175.26 174.36 1of6 n ASN 308 N 9.17 0.99 0.00 -1.70 3.02 -1.26 -4.12 115.26 121.36 1of6 n ASN 308 Ca 0.14 -0.78 0.11 0.00 -0.03 0.00 0.00 54.58 54.02 1of6 n ASN 308 Cb 0.49 0.40 0.13 0.00 -0.61 0.00 0.00 39.78 40.18 1of6 n ASN 308 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1of6 n ALA 309 N -1.02 3.87 -2.67 5.41 0.00 -1.26 -4.44 120.51 120.39 1of6 n ALA 309 Ca 0.08 -0.42 -0.42 0.00 0.00 0.00 0.00 53.44 52.68 1of6 n ALA 309 Cb 0.36 -1.01 -0.03 0.00 0.00 0.00 0.00 19.45 18.77 1of6 n ALA 309 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1of6 s ILE 310 N -3.02 4.10 -0.88 0.00 1.01 -1.26 -0.92 121.20 120.24 1of6 s ILE 310 Ca 0.10 -0.65 0.23 0.00 0.00 0.00 0.00 60.65 60.32 1of6 s ILE 310 Cb 0.17 -4.93 -0.10 0.00 0.01 0.00 0.00 42.46 37.61 1of6 s ILE 310 CO 0.76 -1.77 1.14 0.35 0.00 0.00 0.00 174.94 175.41 1of6 n THR 311 N 6.37 0.05 -3.87 2.92 -2.24 -0.70 -4.96 114.28 111.85 1of6 n THR 311 Ca 0.21 -0.08 -0.10 0.00 -2.27 0.00 0.00 64.05 61.81 1of6 n THR 311 Cb 0.50 0.47 -0.09 0.00 -2.10 0.00 0.00 70.33 69.10 1of6 n THR 311 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1of6 s GLY 312 N -3.20 0.07 0.05 3.38 0.00 -0.91 -0.47 107.32 106.24 1of6 s GLY 312 Ca 0.08 -0.31 0.00 0.00 0.00 0.00 0.00 44.72 44.49 1of6 s GLY 312 CO 0.78 -0.46 -0.05 -1.34 0.00 0.00 0.00 173.10 172.03 1of6 s VAL 313 N -2.25 0.37 0.01 1.40 -7.23 -0.03 -0.92 120.40 111.75 1of6 s VAL 313 Ca -0.08 -1.51 0.05 0.00 -1.81 0.00 0.00 61.98 58.63 1of6 s VAL 313 Cb -0.03 -1.12 -0.02 0.00 0.56 0.00 0.00 36.38 35.78 1of6 s VAL 313 CO -0.02 -0.75 -0.15 -0.32 -0.31 0.00 0.00 175.10 173.54 1of6 s MET 314 N -2.94 1.14 -0.10 4.82 1.75 0.38 -1.48 119.30 122.88 1of6 s MET 314 Ca 0.00 -0.66 -0.04 0.00 -1.25 0.00 0.00 55.69 53.74 1of6 s MET 314 Cb 0.00 -1.14 0.05 0.00 2.84 0.00 0.00 34.83 36.58 1of6 s MET 314 CO -0.05 0.30 0.21 0.42 -0.65 0.00 0.00 175.02 175.25 1of6 s ILE 315 N -0.57 -0.11 -0.32 10.11 1.01 -0.26 -1.39 121.20 129.66 1of6 s ILE 315 Ca 0.05 0.19 -0.18 0.00 0.00 0.00 0.00 60.65 60.71 1of6 s ILE 315 Cb -0.07 -0.34 -0.01 0.00 0.01 0.00 0.00 42.46 42.05 1of6 s ILE 315 CO 0.00 0.08 0.52 -1.61 0.00 0.00 0.00 174.94 173.94 1of6 s GLU 316 N 1.49 3.76 -0.19 2.79 2.02 -1.26 -1.94 118.70 125.37 1of6 s GLU 316 Ca -0.07 0.01 -0.14 0.00 0.02 0.00 0.00 54.97 54.79 1of6 s GLU 316 Cb -0.11 -3.76 0.06 0.00 0.10 0.00 0.00 34.13 30.42 1of6 s GLU 316 CO -0.08 -0.56 0.49 0.45 0.02 0.00 0.00 175.26 175.58 1of6 s SER 317 N 1.70 -0.58 0.37 -0.19 0.15 -0.19 -1.94 113.70 113.01 1of6 s SER 317 Ca 0.20 1.03 0.05 0.00 0.70 0.00 0.00 55.95 57.93 1of6 s SER 317 Cb -0.15 0.97 -0.03 0.00 -1.71 0.00 0.00 66.02 65.10 1of6 s SER 317 CO 0.12 -0.19 0.18 0.21 1.20 0.00 0.00 173.24 174.76 1of6 s ASN 318 N 0.94 2.23 0.11 5.45 3.84 -0.65 0.89 114.94 127.76 1of6 s ASN 318 Ca -0.05 -1.68 -0.28 0.00 0.21 0.00 0.00 52.86 51.06 1of6 s ASN 318 Cb -0.06 0.50 -0.08 0.00 -0.55 0.00 0.00 41.25 41.06 1of6 s ASN 318 CO -0.08 -0.96 1.62 0.40 -2.79 0.00 0.00 177.10 175.29 1of6 h ILE 319 N 1.97 0.32 -2.07 -5.21 2.04 -1.85 -2.11 117.51 110.60 1of6 h ILE 319 Ca -0.32 0.00 -0.56 0.00 1.00 0.00 0.00 64.86 64.98 1of6 h ILE 319 Cb 1.26 0.32 -0.09 0.00 -0.74 0.00 0.00 36.82 37.56 1of6 h ILE 319 CO 0.50 0.00 -0.61 0.20 0.00 0.00 0.00 178.15 178.24 1of6 s ASN 320 N -4.78 4.52 0.58 1.72 0.01 -0.01 -1.10 114.94 115.87 1of6 s ASN 320 Ca -0.16 -0.74 -0.04 0.00 -0.71 0.00 0.00 52.86 51.22 1of6 s ASN 320 Cb 0.08 -0.76 0.02 0.00 0.41 0.00 0.00 41.25 41.00 1of6 s ASN 320 CO 0.65 -0.12 0.86 -1.83 -1.51 0.00 0.00 177.10 175.15 1of6 s GLU 321 N -3.73 2.77 1.64 -0.60 -1.05 -1.26 -4.45 118.70 112.02 1of6 s GLU 321 Ca 0.34 -0.25 0.00 0.00 -0.15 0.00 0.00 54.97 54.91 1of6 s GLU 321 Cb -0.04 -2.34 0.00 0.00 -0.44 0.00 0.00 34.13 31.31 1of6 s GLU 321 CO 0.21 -0.72 0.00 0.41 0.95 0.00 0.00 175.26 176.11 1of6 n GLY 322 N -2.52 -1.58 2.50 -3.83 0.00 -0.57 -4.84 105.19 94.35 1of6 n GLY 322 Ca 0.05 -1.44 -0.11 0.00 0.00 0.00 0.00 46.02 44.52 1of6 n GLY 322 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1of6 n ASN 323 N 0.00 -0.95 -3.63 1.61 6.94 -1.26 -1.76 115.26 116.22 1of6 n ASN 323 Ca 0.00 -2.45 -0.13 0.00 -0.02 0.00 0.00 54.58 51.99 1of6 n ASN 323 Cb 0.00 1.80 -0.06 0.00 -2.36 0.00 0.00 39.78 39.17 1of6 n ASN 323 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1of6 s GLN 324 N -2.66 0.99 0.85 -3.83 -2.07 0.02 -4.87 119.66 108.10 1of6 s GLN 324 Ca 0.23 -0.40 -0.11 0.00 -1.82 0.00 0.00 55.36 53.25 1of6 s GLN 324 Cb -0.00 0.45 0.15 0.00 -1.09 0.00 0.00 33.01 32.51 1of6 s GLN 324 CO 0.16 -0.36 1.19 0.20 -1.32 0.00 0.00 175.29 175.16 1of6 s GLY 325 N -2.19 1.73 -0.25 2.60 0.00 -1.26 -4.39 107.32 103.57 1of6 s GLY 325 Ca -0.03 -1.17 -0.08 0.00 0.00 0.00 0.00 44.72 43.44 1of6 s GLY 325 CO -0.05 -0.54 0.08 -0.42 0.00 0.00 0.00 173.10 172.18 1of6 s ILE 326 N -3.60 4.44 0.00 0.90 1.01 -1.26 -4.99 121.20 117.69 1of6 s ILE 326 Ca 0.68 -0.13 0.00 0.00 0.00 0.00 0.00 60.65 61.20 1of6 s ILE 326 Cb -0.06 -3.07 0.00 0.00 0.01 0.00 0.00 42.46 39.33 1of6 s ILE 326 CO 0.49 0.34 0.00 -0.81 0.00 0.00 0.00 174.94 174.96 1of6 n PRO 327 N 4.82 0.00 0.00 2.79 -0.05 -1.26 -5.14 135.00 136.16 1of6 n PRO 327 Ca -0.16 0.00 0.00 0.00 -0.05 0.00 0.00 63.50 63.29 1of6 n PRO 327 Cb 0.52 -0.39 0.00 0.00 -0.05 0.00 0.00 33.50 33.57 1of6 n PRO 327 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 175.50 175.86 1of6 n GLY 330 N 2.56 2.42 0.33 0.55 0.00 -1.26 -5.10 105.19 104.69 1of6 n GLY 330 Ca 0.00 -0.09 0.18 0.00 0.00 0.00 0.00 46.02 46.10 1of6 n GLY 330 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1of6 h LYS 331 N 0.00 0.45 0.00 1.61 3.64 -1.81 -0.55 116.57 119.92 1of6 h LYS 331 Ca 0.00 -0.03 -0.07 0.00 -1.27 0.00 0.00 60.65 59.29 1of6 h LYS 331 Cb 0.00 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.71 1of6 h LYS 331 CO 0.00 0.30 -0.31 0.00 -2.27 0.00 0.00 179.45 177.17 1of6 h ALA 332 N 1.75 1.27 -0.00 5.00 0.00 -1.96 -3.11 119.26 122.23 1of6 h ALA 332 Ca 0.64 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 55.27 1of6 h ALA 332 Cb 1.28 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1of6 h ALA 332 CO -0.52 0.39 -0.03 0.41 0.00 0.00 0.00 179.25 179.50 1of6 n GLY 333 N -0.36 -1.09 3.78 0.00 0.00 -0.22 -4.94 105.19 102.36 1of6 n GLY 333 Ca -0.01 -0.20 -0.36 0.00 0.00 0.00 0.00 46.02 45.44 1of6 n GLY 333 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1of6 s LEU 334 N -2.37 4.13 0.20 0.99 1.43 -1.18 -4.93 118.68 116.95 1of6 s LEU 334 Ca 0.34 2.05 -0.30 0.00 -1.03 0.00 0.00 54.13 55.20 1of6 s LEU 334 Cb 0.21 -4.19 -0.08 0.00 0.03 0.00 0.00 46.19 42.15 1of6 s LEU 334 CO 0.44 -0.52 1.16 -0.54 0.23 0.00 0.00 176.35 177.11 1of6 s LYS 335 N -2.52 4.54 0.06 1.70 1.02 -1.26 -4.98 119.74 118.29 1of6 s LYS 335 Ca 0.58 1.83 -0.31 0.00 0.02 0.00 0.00 55.97 58.10 1of6 s LYS 335 Cb -0.22 -3.24 -0.07 0.00 -0.52 0.00 0.00 37.83 33.78 1of6 s LYS 335 CO 0.28 0.01 1.41 -0.47 -0.92 0.00 0.00 175.35 175.65 1of6 s TYR 336 N -0.33 3.02 0.00 3.18 5.04 -1.26 -3.66 117.35 123.34 1of6 s TYR 336 Ca 0.50 0.86 0.00 0.00 -2.44 0.00 0.00 57.07 55.99 1of6 s TYR 336 Cb -0.32 -3.68 0.00 0.00 0.35 0.00 0.00 41.96 38.31 1of6 s TYR 336 CO 0.37 -2.48 0.00 0.41 -1.34 0.00 0.00 175.55 172.51 1of6 n GLY 337 N 3.59 0.46 3.05 8.97 0.00 -1.26 -4.76 105.19 115.24 1of6 n GLY 337 Ca 0.12 -0.92 -0.26 0.00 0.00 0.00 0.00 46.02 44.97 1of6 n GLY 337 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1of6 s VAL 338 N -2.00 1.29 0.54 1.61 1.01 -1.24 -0.83 120.40 120.78 1of6 s VAL 338 Ca 0.00 -0.56 -0.22 0.00 0.00 0.00 0.00 61.98 61.20 1of6 s VAL 338 Cb 0.00 -1.17 -0.05 0.00 0.00 0.00 0.00 36.38 35.16 1of6 s VAL 338 CO 0.00 0.39 1.35 -0.55 0.00 0.00 0.00 175.10 176.29 1of6 s SER 339 N 0.69 5.30 0.00 3.32 0.15 -1.26 -4.78 113.70 117.13 1of6 s SER 339 Ca -0.14 2.74 0.13 0.00 0.70 0.00 0.00 55.95 59.39 1of6 s SER 339 Cb -0.16 -2.63 0.33 0.00 -1.71 0.00 0.00 66.02 61.85 1of6 s SER 339 CO 0.04 -1.55 1.25 2.30 1.20 0.00 0.00 173.24 176.48 1of6 n ILE 340 N -1.01 0.83 0.00 6.45 -5.35 -1.26 -0.80 119.36 118.21 1of6 n ILE 340 Ca 0.10 -0.92 0.00 0.00 -0.27 0.00 0.00 62.75 61.67 1of6 n ILE 340 Cb 0.45 0.63 0.00 0.00 -1.74 0.00 0.00 39.64 38.98 1of6 n ILE 340 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1of6 n THR 341 N 0.76 0.00 -1.65 7.28 -2.24 -1.26 -4.76 114.28 112.41 1of6 n THR 341 Ca 0.13 0.00 -0.41 0.00 -2.27 0.00 0.00 64.05 61.50 1of6 n THR 341 Cb 0.45 0.00 0.01 0.00 -2.10 0.00 0.00 70.33 68.69 1of6 n THR 341 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1of6 n ASP 342 N 0.00 1.86 -4.77 3.42 8.00 -1.26 -4.73 116.55 119.07 1of6 n ASP 342 Ca 0.00 1.08 -0.37 0.00 0.71 0.00 0.00 54.79 56.20 1of6 n ASP 342 Cb 0.00 -1.42 -0.02 0.00 -0.02 0.00 0.00 41.12 39.66 1of6 n ASP 342 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1of6 s ALA 343 N -1.23 3.10 0.12 2.24 0.00 -1.26 -4.69 121.76 120.04 1of6 s ALA 343 Ca 0.62 0.88 0.07 0.00 0.00 0.00 0.00 51.96 53.54 1of6 s ALA 343 Cb -0.54 -3.35 -0.04 0.00 0.00 0.00 0.00 23.12 19.19 1of6 s ALA 343 CO 0.57 -0.47 -0.18 0.00 0.00 0.00 0.00 175.76 175.69 1of6 s ILE 345 N -1.66 3.09 0.94 0.00 -4.36 -0.82 -1.52 121.20 116.87 1of6 s ILE 345 Ca 0.09 0.77 -0.13 0.00 -0.26 0.00 0.00 60.65 61.12 1of6 s ILE 345 Cb -0.08 -3.37 0.21 0.00 1.25 0.00 0.00 42.46 40.47 1of6 s ILE 345 CO 0.04 -0.06 1.28 -0.83 0.24 0.00 0.00 174.94 175.62 1of6 s GLY 346 N -1.48 1.80 0.04 6.27 0.00 -1.26 -1.63 107.32 111.07 1of6 s GLY 346 Ca 0.67 -1.44 -0.24 0.00 0.00 0.00 0.00 44.72 43.71 1of6 s GLY 346 CO 0.33 -0.66 1.54 -0.25 0.00 0.00 0.00 173.10 174.06 1of6 h TRP 347 N -1.49 -0.04 -0.44 1.90 2.91 -0.39 -1.69 115.95 116.71 1of6 h TRP 347 Ca -0.42 -0.00 -0.03 0.00 1.13 0.00 0.00 58.89 59.57 1of6 h TRP 347 Cb 1.23 0.01 -0.02 0.00 -0.51 0.00 0.00 29.16 29.87 1of6 h TRP 347 CO -1.18 0.17 0.16 0.93 -1.03 0.00 0.00 178.44 177.49 1of6 h GLU 348 N -0.24 0.67 -0.62 2.65 5.08 -1.89 -0.97 114.58 119.26 1of6 h GLU 348 Ca -0.00 -0.13 0.12 0.00 -1.00 0.00 0.00 59.36 58.35 1of6 h GLU 348 Cb 0.22 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.33 1of6 h GLU 348 CO 0.01 0.63 0.42 1.15 -1.00 0.00 0.00 179.01 180.21 1of6 h THR 349 N 0.57 0.83 0.03 1.13 2.02 -1.93 -2.76 112.91 112.80 1of6 h THR 349 Ca 0.15 -0.11 -0.25 0.00 0.77 0.00 0.00 66.41 66.96 1of6 h THR 349 Cb 0.22 0.49 0.02 0.00 -1.74 0.00 0.00 68.15 67.14 1of6 h THR 349 CO -0.01 0.06 -1.00 0.74 0.37 0.00 0.00 175.52 175.67 1of6 h THR 350 N 0.32 1.31 -0.53 3.16 2.02 -0.27 -2.12 112.91 116.80 1of6 h THR 350 Ca 0.29 -2.27 0.09 0.00 0.77 0.00 0.00 66.41 65.30 1of6 h THR 350 Cb 0.72 2.50 -0.07 0.00 -1.74 0.00 0.00 68.15 69.56 1of6 h THR 350 CO -0.07 0.69 0.12 -0.08 0.37 0.00 0.00 175.52 176.55 1of6 h GLU 351 N 0.26 0.25 -0.04 6.66 4.81 -0.96 0.87 114.58 126.44 1of6 h GLU 351 Ca -0.13 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.07 1of6 h GLU 351 Cb 1.68 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 31.00 1of6 h GLU 351 CO 0.20 0.16 -0.00 0.22 -0.73 0.00 0.00 179.01 178.86 1of6 h ASP 352 N 0.26 0.07 -0.26 1.04 3.58 -1.47 -0.03 116.42 119.60 1of6 h ASP 352 Ca 0.27 -0.32 0.06 0.00 0.42 0.00 0.00 57.03 57.45 1of6 h ASP 352 Cb 0.36 -0.02 -0.06 0.00 1.72 0.00 0.00 39.33 41.33 1of6 h ASP 352 CO -0.34 0.38 -0.12 0.58 -2.88 0.00 0.00 179.24 176.86 1of6 h VAL 353 N -0.24 0.62 -0.32 2.25 2.07 -1.25 -1.18 116.25 118.20 1of6 h VAL 353 Ca 0.01 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.46 1of6 h VAL 353 Cb 0.34 0.62 -0.01 0.00 -1.52 0.00 0.00 31.29 30.72 1of6 h VAL 353 CO 0.00 0.00 -0.07 -0.07 0.02 0.00 0.00 177.57 177.45 1of6 h LEU 354 N -0.08 0.61 -0.99 2.57 3.38 -0.49 -1.78 115.31 118.52 1of6 h LEU 354 Ca 0.14 -0.36 0.05 0.00 0.09 0.00 0.00 57.88 57.79 1of6 h LEU 354 Cb 0.29 -0.17 -0.06 0.00 0.09 0.00 0.00 40.66 40.81 1of6 h LEU 354 CO -0.32 0.83 0.65 0.03 0.09 0.00 0.00 178.44 179.72 1of6 h ARG 355 N 0.39 1.19 -0.60 1.13 3.08 -1.01 -1.23 114.38 117.33 1of6 h ARG 355 Ca 0.08 -0.07 -0.04 0.00 0.07 0.00 0.00 59.98 60.02 1of6 h ARG 355 Cb 0.56 -0.27 -0.03 0.00 0.08 0.00 0.00 29.97 30.32 1of6 h ARG 355 CO 0.03 0.79 0.22 0.87 -1.07 0.00 0.00 179.97 180.81 1of6 h LYS 356 N 1.22 0.89 -0.25 0.04 1.57 -0.87 -2.23 116.57 116.95 1of6 h LYS 356 Ca 0.41 -0.15 -0.11 0.00 -1.87 0.00 0.00 60.65 58.93 1of6 h LYS 356 Cb 0.06 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.21 1of6 h LYS 356 CO -0.14 0.74 -0.30 1.25 -0.57 0.00 0.00 179.45 180.43 1of6 h LEU 357 N 0.87 0.52 -0.41 2.94 6.46 -0.86 -2.60 115.31 122.21 1of6 h LEU 357 Ca 0.20 -0.19 -0.12 0.00 -0.12 0.00 0.00 57.88 57.65 1of6 h LEU 357 Cb 0.20 -0.14 -0.01 0.00 -0.73 0.00 0.00 40.66 39.98 1of6 h LEU 357 CO -0.02 0.80 -0.19 0.00 -0.62 0.00 0.00 178.44 178.41 1of6 h ALA 358 N 1.24 0.58 -0.05 1.25 0.00 -0.95 -2.46 119.26 118.87 1of6 h ALA 358 Ca 0.06 -0.37 0.04 0.00 0.00 0.00 0.00 54.91 54.63 1of6 h ALA 358 Cb 0.75 -0.14 -0.05 0.00 0.00 0.00 0.00 17.79 18.35 1of6 h ALA 358 CO 0.06 0.54 -0.21 0.00 0.00 0.00 0.00 179.25 179.64 1of6 h ALA 359 N 0.82 -0.23 -0.69 0.00 0.00 -1.20 -2.06 119.26 115.89 1of6 h ALA 359 Ca 0.09 0.02 0.14 0.00 0.00 0.00 0.00 54.91 55.16 1of6 h ALA 359 Cb 0.76 0.39 -0.04 0.00 0.00 0.00 0.00 17.79 18.89 1of6 h ALA 359 CO 0.06 -0.69 0.47 0.00 0.00 0.00 0.00 179.25 179.08 1of6 h ALA 360 N 0.61 2.14 -0.20 0.00 0.00 -1.40 0.46 119.26 120.87 1of6 h ALA 360 Ca 0.08 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 54.82 1of6 h ALA 360 Cb 0.42 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1of6 h ALA 360 CO -0.23 -0.33 -0.49 0.28 0.00 0.00 0.00 179.25 178.48 1of6 h VAL 361 N 0.36 1.31 0.95 0.00 2.07 -0.97 -1.23 116.25 118.74 1of6 h VAL 361 Ca 0.33 -1.72 -0.05 0.00 0.82 0.00 0.00 66.70 66.09 1of6 h VAL 361 Cb 0.80 1.87 0.01 0.00 -1.52 0.00 0.00 31.29 32.46 1of6 h VAL 361 CO -0.09 0.54 -0.46 0.03 0.02 0.00 0.00 177.57 177.61 1of6 h ARG 362 N 0.39 -1.23 -0.99 1.57 3.08 -0.46 -2.78 114.38 113.96 1of6 h ARG 362 Ca -0.01 0.08 0.35 0.00 0.07 0.00 0.00 59.98 60.48 1of6 h ARG 362 Cb 1.11 0.28 -0.17 0.00 0.08 0.00 0.00 29.97 31.27 1of6 h ARG 362 CO 0.11 -0.82 0.41 0.37 -1.07 0.00 0.00 179.97 178.97 1of6 h GLN 363 N -1.28 0.08 -0.35 0.04 5.75 -1.01 -0.25 115.11 118.09 1of6 h GLN 363 Ca -0.13 -0.00 -0.09 0.00 -0.15 0.00 0.00 58.65 58.28 1of6 h GLN 363 Cb 0.98 -0.02 -0.02 0.00 1.07 0.00 0.00 27.48 29.49 1of6 h GLN 363 CO 0.21 0.05 -0.14 -0.09 -2.65 0.00 0.00 178.83 176.22 1of6 h ARG 364 N 0.08 0.62 -0.44 1.69 2.43 -1.09 -2.84 114.38 114.84 1of6 h ARG 364 Ca 0.75 -0.20 0.09 0.00 -0.81 0.00 0.00 59.98 59.81 1of6 h ARG 364 Cb 1.83 -0.06 -0.09 0.00 -0.42 0.00 0.00 29.97 31.23 1of6 h ARG 364 CO -0.76 0.74 -0.19 0.00 -1.51 0.00 0.00 179.97 178.25 1of6 h ARG 365 N 0.57 -0.10 0.27 0.20 3.08 -0.76 -1.87 114.38 115.77 1of6 h ARG 365 Ca 0.10 0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.15 1of6 h ARG 365 Cb 0.57 0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.62 1of6 h ARG 365 CO 0.04 -0.07 -0.31 0.93 -1.07 0.00 0.00 179.97 179.49 1of6 h GLU 366 N -0.10 -0.57 -1.20 0.04 4.39 -1.35 -2.64 114.58 113.14 1of6 h GLU 366 Ca 0.21 0.04 0.35 0.00 0.34 0.00 0.00 59.36 60.30 1of6 h GLU 366 Cb 0.43 0.13 -0.10 0.00 -0.10 0.00 0.00 28.75 29.11 1of6 h GLU 366 CO -0.51 -0.38 0.79 0.28 -1.16 0.00 0.00 179.01 178.04 1of6 h VAL 367 N -0.59 0.34 0.00 3.13 2.07 -1.42 -3.53 116.25 116.25 1of6 h VAL 367 Ca -0.03 -0.07 0.00 0.00 0.82 0.00 0.00 66.70 67.42 1of6 h VAL 367 Cb 0.52 0.11 0.00 0.00 -1.52 0.00 0.00 31.29 30.41 1of6 h VAL 367 CO -0.06 0.04 0.00 0.59 0.02 0.00 0.00 177.57 178.16