#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i01 n GLU 4 N 0.00 2.63 -0.26 -1.08 2.13 -1.24 -1.26 120.64 121.56 1i01 n GLU 4 Ca 0.00 0.95 0.00 0.00 0.66 0.00 0.00 57.16 58.77 1i01 n GLU 4 Cb 0.00 -2.81 0.00 0.00 0.27 0.00 0.00 31.44 28.90 1i01 n GLU 4 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1i01 n GLY 5 N 4.03 0.91 3.89 8.31 0.00 -1.26 -5.02 105.19 116.06 1i01 n GLY 5 Ca 0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 1i01 n GLY 5 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1i01 s LYS 6 N -0.59 3.40 -0.16 1.61 -0.14 -0.39 -5.01 119.74 118.47 1i01 s LYS 6 Ca 0.00 -0.36 -0.01 0.00 -1.36 0.00 0.00 55.97 54.24 1i01 s LYS 6 Cb 0.00 -3.06 -0.01 0.00 -1.68 0.00 0.00 37.83 33.08 1i01 s LYS 6 CO 0.00 0.66 -0.11 0.42 -0.76 0.00 0.00 175.35 175.56 1i01 s ILE 7 N -1.34 3.04 -0.08 2.17 1.01 -1.26 -1.18 121.20 123.55 1i01 s ILE 7 Ca 0.28 -0.65 0.04 0.00 0.00 0.00 0.00 60.65 60.33 1i01 s ILE 7 Cb -0.13 -2.31 -0.01 0.00 0.01 0.00 0.00 42.46 40.03 1i01 s ILE 7 CO 0.20 0.50 -0.22 0.00 0.00 0.00 0.00 174.94 175.41 1i01 s ALA 8 N 0.73 2.26 -0.28 9.38 0.00 -0.11 -0.71 121.76 133.03 1i01 s ALA 8 Ca -0.05 -1.00 -0.07 0.00 0.00 0.00 0.00 51.96 50.84 1i01 s ALA 8 Cb -0.15 -0.81 -0.01 0.00 0.00 0.00 0.00 23.12 22.15 1i01 s ALA 8 CO 0.02 0.36 0.08 -1.17 0.00 0.00 0.00 175.76 175.05 1i01 s LEU 9 N 0.03 3.67 -0.26 0.00 2.96 0.69 -0.72 118.68 125.06 1i01 s LEU 9 Ca -0.08 -0.51 0.00 0.00 -0.22 0.00 0.00 54.13 53.32 1i01 s LEU 9 Cb -0.15 -1.90 0.04 0.00 0.50 0.00 0.00 46.19 44.68 1i01 s LEU 9 CO 0.05 -0.13 -0.08 -0.69 -1.32 0.00 0.00 176.35 174.18 1i01 s VAL 10 N 1.55 2.58 0.33 1.68 1.01 -0.07 -0.91 120.40 126.58 1i01 s VAL 10 Ca 0.04 -1.28 -0.19 0.00 0.00 0.00 0.00 61.98 60.55 1i01 s VAL 10 Cb -0.16 -2.39 -0.10 0.00 0.00 0.00 0.00 36.38 33.73 1i01 s VAL 10 CO 0.03 0.10 0.82 0.42 0.00 0.00 0.00 175.10 176.47 1i01 s THR 11 N 1.23 4.51 -1.05 3.92 -4.23 -0.80 -1.24 115.64 117.99 1i01 s THR 11 Ca -0.03 1.28 -0.02 0.00 -1.18 0.00 0.00 61.69 61.74 1i01 s THR 11 Cb -0.18 -3.71 0.00 0.00 1.34 0.00 0.00 72.50 69.95 1i01 s THR 11 CO -0.05 -0.10 0.89 0.61 -0.54 0.00 0.00 174.62 175.42 1i01 n GLY 12 N -0.11 -0.26 1.19 3.99 0.00 -0.99 -3.60 105.19 105.42 1i01 n GLY 12 Ca 0.03 0.04 0.06 0.00 0.00 0.00 0.00 46.02 46.15 1i01 n GLY 12 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i01 n ALA 13 N -3.89 2.98 -0.21 4.61 0.00 -0.73 -4.11 120.51 119.15 1i01 n ALA 13 Ca -0.18 -1.08 -0.06 0.00 0.00 0.00 0.00 53.44 52.12 1i01 n ALA 13 Cb 0.62 -1.03 0.04 0.00 0.00 0.00 0.00 19.45 19.08 1i01 n ALA 13 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1i01 h SER 14 N 2.72 0.67 -1.10 0.00 0.02 -1.89 -3.27 113.55 110.69 1i01 h SER 14 Ca 0.00 -0.02 -0.00 0.00 -0.84 0.00 0.00 61.79 60.93 1i01 h SER 14 Cb 1.11 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 63.49 1i01 h SER 14 CO 0.18 0.48 0.00 -2.11 -1.14 0.00 0.00 176.83 174.25 1i01 n ARG 15 N -4.68 0.02 0.00 3.45 1.85 -1.26 -4.77 116.66 111.26 1i01 n ARG 15 Ca 0.04 -0.04 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 1i01 n ARG 15 Cb 0.03 0.05 0.00 0.00 -1.05 0.00 0.00 32.46 31.48 1i01 n ARG 15 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1i01 n GLY 16 N -0.01 2.89 0.10 2.89 0.00 -1.26 -1.92 105.19 107.87 1i01 n GLY 16 Ca -0.00 -0.02 -0.09 0.00 0.00 0.00 0.00 46.02 45.91 1i01 n GLY 16 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1i01 h ILE 17 N 0.00 0.86 -0.60 -0.61 2.04 -1.93 -0.58 117.51 116.68 1i01 h ILE 17 Ca 0.00 -0.01 0.07 0.00 1.00 0.00 0.00 64.86 65.92 1i01 h ILE 17 Cb 0.00 0.82 -0.06 0.00 -0.74 0.00 0.00 36.82 36.84 1i01 h ILE 17 CO 0.00 0.01 0.29 1.23 0.00 0.00 0.00 178.15 179.68 1i01 h GLY 18 N 0.03 0.86 1.27 5.37 0.00 -1.60 -0.38 103.07 108.62 1i01 h GLY 18 Ca 0.08 -0.19 -0.16 0.00 0.00 0.00 0.00 47.33 47.06 1i01 h GLY 18 CO -0.16 0.08 -0.46 -0.09 0.00 0.00 0.00 176.54 175.92 1i01 h ARG 19 N 0.53 0.79 -0.88 4.80 2.43 -1.11 -1.54 114.38 119.40 1i01 h ARG 19 Ca 0.28 -0.45 -0.01 0.00 -0.81 0.00 0.00 59.98 58.99 1i01 h ARG 19 Cb 0.25 0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 29.78 1i01 h ARG 19 CO -0.22 1.08 0.51 0.00 -1.51 0.00 0.00 179.97 179.83 1i01 h ALA 20 N 0.85 1.13 -0.15 2.80 0.00 -0.66 0.95 119.26 124.18 1i01 h ALA 20 Ca 0.04 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 1i01 h ALA 20 Cb 1.03 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 1i01 h ALA 20 CO 0.10 0.61 0.02 0.82 0.00 0.00 0.00 179.25 180.80 1i01 h ILE 21 N 1.22 1.22 -0.45 0.00 2.04 -0.93 -0.75 117.51 119.86 1i01 h ILE 21 Ca 0.31 -0.71 0.00 0.00 1.00 0.00 0.00 64.86 65.47 1i01 h ILE 21 Cb -0.02 1.40 -0.02 0.00 -0.74 0.00 0.00 36.82 37.44 1i01 h ILE 21 CO -0.06 0.21 0.29 0.00 0.00 0.00 0.00 178.15 178.59 1i01 h ALA 22 N 0.81 0.57 -0.32 1.87 0.00 -0.92 -1.44 119.26 119.83 1i01 h ALA 22 Ca 0.05 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.81 1i01 h ALA 22 Cb 0.30 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 1i01 h ALA 22 CO 0.00 0.03 -0.23 0.93 0.00 0.00 0.00 179.25 179.98 1i01 h GLU 23 N 0.60 0.63 -0.21 0.00 5.08 -0.76 -1.83 114.58 118.09 1i01 h GLU 23 Ca 0.16 -0.24 -0.05 0.00 -1.00 0.00 0.00 59.36 58.23 1i01 h GLU 23 Cb -0.05 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 1i01 h GLU 23 CO -0.03 0.81 -0.06 1.15 -1.00 0.00 0.00 179.01 179.88 1i01 h THR 24 N 0.55 1.29 -0.57 1.13 2.02 -0.88 0.70 112.91 117.15 1i01 h THR 24 Ca 0.08 -1.07 -0.06 0.00 0.77 0.00 0.00 66.41 66.13 1i01 h THR 24 Cb 0.70 1.55 -0.03 0.00 -1.74 0.00 0.00 68.15 68.64 1i01 h THR 24 CO 0.05 0.33 0.12 -0.07 0.37 0.00 0.00 175.52 176.31 1i01 h LEU 25 N 0.14 0.85 -0.40 2.58 3.38 -1.23 -2.13 115.31 118.48 1i01 h LEU 25 Ca 0.05 -0.17 -0.11 0.00 0.09 0.00 0.00 57.88 57.74 1i01 h LEU 25 Cb 0.52 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 1i01 h LEU 25 CO 0.02 0.84 -0.18 0.00 0.09 0.00 0.00 178.44 179.22 1i01 h ALA 26 N 1.27 0.57 0.00 1.53 0.00 -1.21 -1.33 119.26 120.08 1i01 h ALA 26 Ca 0.18 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 1i01 h ALA 26 Cb 0.34 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.99 1i01 h ALA 26 CO 0.00 0.51 -0.05 0.00 0.00 0.00 0.00 179.25 179.71 1i01 h ALA 27 N 0.82 1.14 -0.62 0.00 0.00 -0.58 -1.77 119.26 118.26 1i01 h ALA 27 Ca 0.09 -0.04 -0.11 0.00 0.00 0.00 0.00 54.91 54.85 1i01 h ALA 27 Cb 0.73 -0.01 -0.07 0.00 0.00 0.00 0.00 17.79 18.45 1i01 h ALA 27 CO 0.06 0.06 0.13 0.54 0.00 0.00 0.00 179.25 180.03 1i01 n ARG 28 N -3.35 4.04 -0.21 0.00 1.74 -0.83 -4.94 116.66 113.12 1i01 n ARG 28 Ca -0.02 -3.10 0.00 0.00 -0.77 0.00 0.00 57.85 53.96 1i01 n ARG 28 Cb 0.19 -2.19 0.00 0.00 -1.02 0.00 0.00 32.46 29.44 1i01 n ARG 28 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1i01 n GLY 29 N 0.07 0.69 3.87 -0.13 0.00 -0.66 -3.33 105.19 105.70 1i01 n GLY 29 Ca 0.34 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.05 1i01 n GLY 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i01 s ALA 30 N -2.48 3.24 -0.38 4.61 0.00 -0.54 -3.74 121.76 122.48 1i01 s ALA 30 Ca 0.00 -0.14 -0.20 0.00 0.00 0.00 0.00 51.96 51.62 1i01 s ALA 30 Cb 0.00 -2.86 0.01 0.00 0.00 0.00 0.00 23.12 20.27 1i01 s ALA 30 CO 0.00 -0.27 0.60 0.15 0.00 0.00 0.00 175.76 176.24 1i01 s LYS 31 N -4.35 3.55 -0.14 0.00 -0.14 -0.33 -4.36 119.74 113.98 1i01 s LYS 31 Ca 0.53 -0.12 -0.05 0.00 -1.36 0.00 0.00 55.97 54.97 1i01 s LYS 31 Cb -0.10 -3.85 -0.03 0.00 -1.68 0.00 0.00 37.83 32.16 1i01 s LYS 31 CO 0.39 -0.78 0.02 0.08 -0.76 0.00 0.00 175.35 174.29 1i01 s VAL 32 N 2.64 4.44 -0.29 3.17 1.01 -0.29 -0.94 120.40 130.15 1i01 s VAL 32 Ca 0.22 -0.18 0.00 0.00 0.00 0.00 0.00 61.98 62.03 1i01 s VAL 32 Cb -0.15 -2.94 0.06 0.00 0.00 0.00 0.00 36.38 33.36 1i01 s VAL 32 CO 0.15 0.53 -0.03 -0.63 0.00 0.00 0.00 175.10 175.12 1i01 s ILE 33 N -0.15 2.65 0.01 2.22 1.09 0.10 -1.19 121.20 125.93 1i01 s ILE 33 Ca 0.05 -1.56 -0.01 0.00 -1.10 0.00 0.00 60.65 58.03 1i01 s ILE 33 Cb -0.12 -2.57 -0.04 0.00 -1.06 0.00 0.00 42.46 38.66 1i01 s ILE 33 CO 0.02 -0.13 0.15 -0.83 -0.10 0.00 0.00 174.94 174.05 1i01 s GLY 34 N 1.20 2.13 0.29 6.18 0.00 -0.71 -0.89 107.32 115.52 1i01 s GLY 34 Ca -0.05 -0.82 0.11 0.00 0.00 0.00 0.00 44.72 43.96 1i01 s GLY 34 CO -0.03 -0.72 -0.15 -0.51 0.00 0.00 0.00 173.10 171.69 1i01 s THR 35 N -1.32 2.57 0.30 0.90 -4.23 -0.37 -1.46 115.64 112.04 1i01 s THR 35 Ca 0.27 -2.30 -0.03 0.00 -1.18 0.00 0.00 61.69 58.45 1i01 s THR 35 Cb -0.12 -2.44 -0.01 0.00 1.34 0.00 0.00 72.50 71.27 1i01 s THR 35 CO 0.19 -0.36 0.40 0.00 -0.54 0.00 0.00 174.62 174.31 1i01 s ALA 36 N -2.50 0.80 -0.22 3.99 0.00 -0.41 -1.78 121.76 121.64 1i01 s ALA 36 Ca 0.31 -1.51 0.22 0.00 0.00 0.00 0.00 51.96 50.98 1i01 s ALA 36 Cb -0.04 1.22 -0.10 0.00 0.00 0.00 0.00 23.12 24.21 1i01 s ALA 36 CO 0.16 -0.75 0.87 0.25 0.00 0.00 0.00 175.76 176.29 1i01 n THR 37 N -0.50 0.38 -4.45 0.00 -2.24 -1.26 0.13 114.28 106.34 1i01 n THR 37 Ca 0.02 -0.50 -0.25 0.00 -2.27 0.00 0.00 64.05 61.05 1i01 n THR 37 Cb 0.62 -0.17 -0.10 0.00 -2.10 0.00 0.00 70.33 68.58 1i01 n THR 37 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1i01 s SER 38 N -4.93 3.51 0.18 3.42 1.04 -1.26 -4.66 113.70 111.00 1i01 s SER 38 Ca -0.02 -0.99 -0.11 0.00 0.48 0.00 0.00 55.95 55.31 1i01 s SER 38 Cb 0.11 -0.28 0.09 0.00 0.10 0.00 0.00 66.02 66.04 1i01 s SER 38 CO 0.83 0.05 1.72 -0.33 0.98 0.00 0.00 173.24 176.49 1i01 h GLU 39 N 2.52 0.97 -0.96 4.02 4.39 -1.97 0.34 114.58 123.89 1i01 h GLU 39 Ca -0.42 -0.20 0.01 0.00 0.34 0.00 0.00 59.36 59.10 1i01 h GLU 39 Cb 1.25 -0.15 -0.05 0.00 -0.10 0.00 0.00 28.75 29.70 1i01 h GLU 39 CO 0.57 0.85 0.63 -0.91 -1.16 0.00 0.00 179.01 178.99 1i01 h ASN 40 N 0.90 1.10 -0.08 1.42 2.35 -1.98 0.61 115.58 119.90 1i01 h ASN 40 Ca 0.21 -0.03 -0.02 0.00 -0.55 0.00 0.00 56.30 55.91 1i01 h ASN 40 Cb 0.27 -0.27 -0.00 0.00 0.05 0.00 0.00 38.32 38.36 1i01 h ASN 40 CO -0.01 0.79 -0.02 1.23 -1.65 0.00 0.00 177.43 177.77 1i01 h GLY 41 N 1.29 0.16 0.59 2.83 0.00 -1.84 -0.58 103.07 105.52 1i01 h GLY 41 Ca 0.35 -0.13 0.09 0.00 0.00 0.00 0.00 47.33 47.65 1i01 h GLY 41 CO -0.08 0.12 0.64 0.00 0.00 0.00 0.00 176.54 177.22 1i01 h ALA 42 N 0.67 1.46 -0.40 3.60 0.00 -0.55 -0.29 119.26 123.74 1i01 h ALA 42 Ca 0.02 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.82 1i01 h ALA 42 Cb 0.42 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1i01 h ALA 42 CO 0.01 0.33 -0.21 0.37 0.00 0.00 0.00 179.25 179.74 1i01 h GLN 43 N 1.08 0.78 -0.40 0.00 5.75 -0.77 -1.13 115.11 120.42 1i01 h GLN 43 Ca 0.47 -0.31 -0.06 0.00 -0.15 0.00 0.00 58.65 58.59 1i01 h GLN 43 Cb 0.34 -0.04 -0.02 0.00 1.07 0.00 0.00 27.48 28.83 1i01 h GLN 43 CO -0.22 0.93 -0.02 0.00 -2.65 0.00 0.00 178.83 176.87 1i01 h ALA 44 N 1.07 1.22 -0.35 3.38 0.00 0.13 -0.55 119.26 124.17 1i01 h ALA 44 Ca 0.10 -0.24 -0.10 0.00 0.00 0.00 0.00 54.91 54.67 1i01 h ALA 44 Cb 0.72 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 1i01 h ALA 44 CO 0.06 0.51 -0.17 0.82 0.00 0.00 0.00 179.25 180.47 1i01 h ILE 45 N 0.61 1.29 -0.97 0.00 2.04 -0.53 -2.80 117.51 117.16 1i01 h ILE 45 Ca 0.12 -1.28 0.00 0.00 1.00 0.00 0.00 64.86 64.70 1i01 h ILE 45 Cb 0.41 1.37 -0.05 0.00 -0.74 0.00 0.00 36.82 37.81 1i01 h ILE 45 CO 0.02 0.42 0.60 0.28 0.00 0.00 0.00 178.15 179.47 1i01 h SER 46 N 0.51 1.14 -0.97 1.72 0.02 -0.81 -1.06 113.55 114.11 1i01 h SER 46 Ca 0.08 -0.05 0.04 0.00 -0.84 0.00 0.00 61.79 61.02 1i01 h SER 46 Cb 0.70 -0.29 -0.06 0.00 0.14 0.00 0.00 62.40 62.90 1i01 h SER 46 CO 0.05 0.86 0.63 0.44 -1.14 0.00 0.00 176.83 177.67 1i01 h ASP 47 N 1.32 1.04 1.21 3.07 3.45 -0.92 0.77 116.42 126.36 1i01 h ASP 47 Ca 0.35 -0.00 -0.04 0.00 0.43 0.00 0.00 57.03 57.77 1i01 h ASP 47 Cb -0.09 -0.23 -0.01 0.00 -0.56 0.00 0.00 39.33 38.44 1i01 h ASP 47 CO -0.07 0.70 -0.81 0.10 -1.57 0.00 0.00 179.24 177.59 1i01 h TYR 48 N 1.20 0.00 0.00 4.55 -0.00 -1.21 -3.32 116.97 118.20 1i01 h TYR 48 Ca 0.39 0.00 -0.22 0.00 0.00 0.00 0.00 58.73 58.90 1i01 h TYR 48 Cb 0.04 0.00 -0.03 0.00 0.00 0.00 0.00 36.73 36.74 1i01 h TYR 48 CO -0.01 0.14 -1.09 -0.07 -0.00 0.00 0.00 178.16 177.13 1i01 h LEU 49 N 0.00 0.00 0.00 0.10 3.38 -0.76 -3.49 115.31 114.54 1i01 h LEU 49 Ca -0.03 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1i01 h LEU 49 Cb 1.13 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.88 1i01 h LEU 49 CO 0.01 1.00 0.00 0.61 0.09 0.00 0.00 178.44 180.16 1i01 n GLY 50 N 1.38 3.58 0.00 0.83 0.00 0.22 -1.63 105.19 109.57 1i01 n GLY 50 Ca -0.02 -0.08 0.14 0.00 0.00 0.00 0.00 46.02 46.05 1i01 n GLY 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i01 n ALA 51 N 11.74 2.45 1.85 4.61 0.00 -1.26 -3.23 120.51 136.68 1i01 n ALA 51 Ca 0.00 -0.13 0.15 0.00 0.00 0.00 0.00 53.44 53.46 1i01 n ALA 51 Cb 0.00 -1.45 0.80 0.00 0.00 0.00 0.00 19.45 18.80 1i01 n ALA 51 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1i01 n ASN 52 N -1.43 0.43 0.00 0.00 3.02 -0.65 -4.98 115.26 111.65 1i01 n ASN 52 Ca 0.09 -1.18 0.00 0.00 -0.03 0.00 0.00 54.58 53.46 1i01 n ASN 52 Cb 0.31 -0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.48 1i01 n ASN 52 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1i01 n GLY 53 N 1.03 -0.68 3.51 7.41 0.00 -1.20 -1.13 105.19 114.13 1i01 n GLY 53 Ca 0.22 -0.48 -0.13 0.00 0.00 0.00 0.00 46.02 45.64 1i01 n GLY 53 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1i01 s LYS 54 N -0.52 0.93 0.04 1.61 2.20 -0.34 -4.63 119.74 119.03 1i01 s LYS 54 Ca 0.00 -0.05 0.03 0.00 -0.36 0.00 0.00 55.97 55.59 1i01 s LYS 54 Cb 0.00 0.43 -0.04 0.00 -1.51 0.00 0.00 37.83 36.72 1i01 s LYS 54 CO 0.00 -0.35 -0.01 0.20 -0.36 0.00 0.00 175.35 174.83 1i01 s GLY 55 N -1.80 1.87 0.02 5.54 0.00 -1.25 -1.74 107.32 109.96 1i01 s GLY 55 Ca -0.02 -1.03 0.00 0.00 0.00 0.00 0.00 44.72 43.67 1i01 s GLY 55 CO -0.01 -0.94 -0.03 1.08 0.00 0.00 0.00 173.10 173.20 1i01 s LEU 56 N -1.82 2.21 -0.03 0.66 1.43 -0.54 -4.70 118.68 115.89 1i01 s LEU 56 Ca 0.21 -0.44 -0.30 0.00 -1.03 0.00 0.00 54.13 52.57 1i01 s LEU 56 Cb -0.11 0.08 -0.03 0.00 0.03 0.00 0.00 46.19 46.16 1i01 s LEU 56 CO 0.13 -0.26 0.99 -0.32 0.23 0.00 0.00 176.35 177.12 1i01 s MET 57 N -1.29 4.52 -0.01 1.70 -2.45 -1.26 -1.29 119.30 119.22 1i01 s MET 57 Ca -0.14 1.42 0.00 0.00 -1.25 0.00 0.00 55.69 55.73 1i01 s MET 57 Cb -0.09 -3.48 0.02 0.00 1.25 0.00 0.00 34.83 32.53 1i01 s MET 57 CO -0.01 -0.13 0.01 -1.17 1.05 0.00 0.00 175.02 174.78 1i01 s LEU 58 N 1.29 1.42 -0.63 4.11 2.96 0.35 -4.87 118.68 123.31 1i01 s LEU 58 Ca 0.51 0.01 0.03 0.00 -0.22 0.00 0.00 54.13 54.46 1i01 s LEU 58 Cb -0.20 -0.09 0.15 0.00 0.50 0.00 0.00 46.19 46.55 1i01 s LEU 58 CO 0.25 -0.07 0.40 0.21 -1.32 0.00 0.00 176.35 175.82 1i01 s ASN 59 N 0.68 4.73 0.56 3.68 2.47 -1.26 -4.18 114.94 121.63 1i01 s ASN 59 Ca -0.06 -3.34 0.37 0.00 0.42 0.00 0.00 52.86 50.25 1i01 s ASN 59 Cb -0.09 -1.69 1.49 0.00 -1.45 0.00 0.00 41.25 39.52 1i01 s ASN 59 CO -0.02 -0.19 1.69 -0.37 -3.72 0.00 0.00 177.10 174.49 1i01 h VAL 60 N 4.98 0.25 0.00 -5.21 -1.51 -1.96 0.29 116.25 113.10 1i01 h VAL 60 Ca 0.02 0.00 -0.08 0.00 -1.23 0.00 0.00 66.70 65.41 1i01 h VAL 60 Cb 0.85 0.29 -0.01 0.00 -2.13 0.00 0.00 31.29 30.29 1i01 h VAL 60 CO 0.72 0.00 -0.39 0.00 -1.23 0.00 0.00 177.57 176.67 1i01 h THR 61 N 0.00 0.82 -3.79 7.19 1.03 -1.93 -3.44 112.91 112.80 1i01 h THR 61 Ca 0.58 -1.67 -0.63 0.00 -0.01 0.00 0.00 66.41 64.68 1i01 h THR 61 Cb 2.53 2.05 -0.17 0.00 -1.07 0.00 0.00 68.15 71.50 1i01 h THR 61 CO -0.01 0.38 -0.52 -0.62 -0.01 0.00 0.00 175.52 174.74 1i01 s ASP 62 N -6.40 5.97 0.25 0.00 2.15 0.10 -5.00 116.67 113.76 1i01 s ASP 62 Ca 0.01 0.01 -0.05 0.00 0.43 0.00 0.00 52.55 52.96 1i01 s ASP 62 Cb 0.10 -2.10 0.32 0.00 -0.30 0.00 0.00 42.92 40.94 1i01 s ASP 62 CO 0.70 -0.01 1.90 -0.65 -0.17 0.00 0.00 175.17 176.94 1i01 h PRO 63 N 8.10 1.22 0.00 4.34 0.11 -1.84 -1.32 132.00 142.61 1i01 h PRO 63 Ca -0.36 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1i01 h PRO 63 Cb 1.18 -0.28 0.00 0.00 0.11 0.00 0.00 31.00 32.02 1i01 h PRO 63 CO 0.58 0.81 0.00 0.00 -0.21 0.00 0.00 178.00 179.18 1i01 h ALA 64 N 1.40 1.00 0.09 -0.75 0.00 -1.94 -2.66 119.26 116.40 1i01 h ALA 64 Ca 0.39 0.00 -0.36 0.00 0.00 0.00 0.00 54.91 54.94 1i01 h ALA 64 Cb -0.00 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 1i01 h ALA 64 CO -0.12 0.00 -2.04 0.45 0.00 0.00 0.00 179.25 177.54 1i01 n SER 65 N -2.29 2.07 0.06 0.00 2.88 -0.52 -3.33 113.62 112.49 1i01 n SER 65 Ca -0.00 0.17 -0.12 0.00 -1.33 0.00 0.00 58.87 57.58 1i01 n SER 65 Cb 0.11 -0.79 -0.07 0.00 -0.75 0.00 0.00 64.21 62.70 1i01 n SER 65 CO 0.00 0.00 0.00 0.40 -1.23 0.00 0.00 175.04 174.21 1i01 h ILE 66 N -0.07 0.97 -0.49 2.46 2.04 -1.24 -0.46 117.51 120.72 1i01 h ILE 66 Ca -0.45 -0.05 -0.03 0.00 1.00 0.00 0.00 64.86 65.33 1i01 h ILE 66 Cb 1.93 1.01 -0.02 0.00 -0.74 0.00 0.00 36.82 39.00 1i01 h ILE 66 CO 0.01 0.01 0.20 1.05 0.00 0.00 0.00 178.15 179.43 1i01 h GLU 67 N -0.08 0.70 -0.13 2.37 4.11 -1.70 -0.88 114.58 118.97 1i01 h GLU 67 Ca -0.01 -0.10 -0.03 0.00 0.07 0.00 0.00 59.36 59.30 1i01 h GLU 67 Cb 0.07 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.18 1i01 h GLU 67 CO 0.01 0.58 -0.02 1.03 0.07 0.00 0.00 179.01 180.68 1i01 h SER 68 N 0.70 0.24 -0.37 3.06 0.87 -1.48 -1.98 113.55 114.60 1i01 h SER 68 Ca 0.17 -0.35 -0.03 0.00 -1.23 0.00 0.00 61.79 60.35 1i01 h SER 68 Cb 0.13 -0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 62.01 1i01 h SER 68 CO -0.02 0.53 0.09 0.58 -0.53 0.00 0.00 176.83 177.49 1i01 h VAL 69 N -0.05 1.22 -0.07 2.23 2.07 -0.79 -1.98 116.25 118.88 1i01 h VAL 69 Ca 0.03 -0.75 -0.03 0.00 0.82 0.00 0.00 66.70 66.77 1i01 h VAL 69 Cb 0.42 1.02 -0.01 0.00 -1.52 0.00 0.00 31.29 31.20 1i01 h VAL 69 CO 0.01 0.26 -0.08 -0.07 0.02 0.00 0.00 177.57 177.71 1i01 h LEU 70 N 0.45 0.09 -0.24 2.57 3.38 -1.17 -1.26 115.31 119.12 1i01 h LEU 70 Ca 0.12 -0.01 -0.13 0.00 0.09 0.00 0.00 57.88 57.95 1i01 h LEU 70 Cb 0.30 -0.02 -0.00 0.00 0.09 0.00 0.00 40.66 41.02 1i01 h LEU 70 CO 0.00 0.19 -0.35 -0.08 0.09 0.00 0.00 178.44 178.29 1i01 h GLU 71 N 0.10 0.65 -0.60 1.13 4.57 -1.02 -1.52 114.58 117.89 1i01 h GLU 71 Ca 0.02 -0.39 -0.01 0.00 -1.18 0.00 0.00 59.36 57.80 1i01 h GLU 71 Cb 0.20 0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 28.80 1i01 h GLU 71 CO 0.01 1.00 0.34 0.87 -1.18 0.00 0.00 179.01 180.05 1i01 h LYS 72 N 0.36 0.83 -0.70 1.92 1.57 -0.75 -0.39 116.57 119.42 1i01 h LYS 72 Ca 0.02 -0.09 -0.05 0.00 -1.87 0.00 0.00 60.65 58.66 1i01 h LYS 72 Cb 0.94 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 33.05 1i01 h LYS 72 CO 0.08 0.63 0.25 0.82 -0.57 0.00 0.00 179.45 180.66 1i01 h ILE 73 N 0.81 1.25 -0.47 1.86 2.04 -1.20 -1.49 117.51 120.31 1i01 h ILE 73 Ca 0.21 -0.81 -0.10 0.00 1.00 0.00 0.00 64.86 65.17 1i01 h ILE 73 Cb 0.03 0.44 -0.02 0.00 -0.74 0.00 0.00 36.82 36.54 1i01 h ILE 73 CO -0.04 0.32 -0.10 0.03 0.00 0.00 0.00 178.15 178.37 1i01 h ARG 74 N 1.02 0.84 0.00 2.37 3.08 -0.83 0.44 114.38 121.30 1i01 h ARG 74 Ca 0.23 -0.28 0.00 0.00 0.07 0.00 0.00 59.98 60.00 1i01 h ARG 74 Cb 0.24 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.22 1i01 h ARG 74 CO -0.01 0.90 0.00 0.00 -1.07 0.00 0.00 179.97 179.79 1i01 n ALA 75 N -2.49 2.10 -0.02 0.04 0.00 -0.19 -3.52 120.51 116.43 1i01 n ALA 75 Ca 0.02 0.01 -0.03 0.00 0.00 0.00 0.00 53.44 53.44 1i01 n ALA 75 Cb 0.37 -1.45 -0.03 0.00 0.00 0.00 0.00 19.45 18.34 1i01 n ALA 75 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1i01 n GLU 76 N -2.25 2.61 0.00 0.00 2.13 -0.60 -4.94 120.64 117.59 1i01 n GLU 76 Ca 0.05 0.01 0.00 0.00 0.66 0.00 0.00 57.16 57.87 1i01 n GLU 76 Cb 0.37 -1.11 0.00 0.00 0.27 0.00 0.00 31.44 30.97 1i01 n GLU 76 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 1i01 n PHE 77 N -2.27 0.00 0.00 4.31 3.01 0.14 -5.08 117.46 117.57 1i01 n PHE 77 Ca -0.08 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.38 1i01 n PHE 77 Cb 0.63 0.05 0.00 0.00 -0.01 0.00 0.00 39.48 40.15 1i01 n PHE 77 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1i01 n GLY 78 N 2.59 0.84 3.84 1.37 0.00 -0.30 -4.99 105.19 108.54 1i01 n GLY 78 Ca 0.00 -1.82 -0.33 0.00 0.00 0.00 0.00 46.02 43.88 1i01 n GLY 78 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1i01 s GLU 79 N -1.79 4.07 -0.04 1.61 0.41 -1.26 -3.40 118.70 118.30 1i01 s GLU 79 Ca 0.00 0.81 -0.30 0.00 -0.41 0.00 0.00 54.97 55.07 1i01 s GLU 79 Cb 0.00 -2.34 -0.03 0.00 -1.78 0.00 0.00 34.13 29.97 1i01 s GLU 79 CO 0.00 0.08 1.13 0.08 -0.49 0.00 0.00 175.26 176.07 1i01 s VAL 80 N -2.07 4.40 -0.22 2.63 1.01 -1.26 -4.58 120.40 120.31 1i01 s VAL 80 Ca 0.57 1.71 0.11 0.00 0.00 0.00 0.00 61.98 64.37 1i01 s VAL 80 Cb -0.10 -4.10 -0.22 0.00 0.00 0.00 0.00 36.38 31.96 1i01 s VAL 80 CO 0.17 0.04 -0.04 0.47 0.00 0.00 0.00 175.10 175.74 1i01 n ASP 81 N 4.77 0.83 -4.04 3.32 8.00 0.11 -4.61 116.55 124.93 1i01 n ASP 81 Ca 0.09 -0.05 -0.29 0.00 0.71 0.00 0.00 54.79 55.26 1i01 n ASP 81 Cb 0.47 0.40 -0.17 0.00 -0.02 0.00 0.00 41.12 41.81 1i01 n ASP 81 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1i01 s ILE 82 N -2.50 1.50 -0.17 0.53 1.01 -0.69 -1.67 121.20 119.22 1i01 s ILE 82 Ca -0.20 -0.63 0.00 0.00 0.00 0.00 0.00 60.65 59.82 1i01 s ILE 82 Cb 0.07 -1.39 0.00 0.00 0.01 0.00 0.00 42.46 41.16 1i01 s ILE 82 CO 0.74 0.44 -0.15 -0.22 0.00 0.00 0.00 174.94 175.75 1i01 s LEU 83 N 1.14 2.44 -0.23 2.97 2.96 0.23 -0.22 118.68 127.97 1i01 s LEU 83 Ca -0.03 -0.50 0.02 0.00 -0.22 0.00 0.00 54.13 53.40 1i01 s LEU 83 Cb -0.14 -1.56 0.05 0.00 0.50 0.00 0.00 46.19 45.04 1i01 s LEU 83 CO -0.04 0.06 -0.13 -0.69 -1.32 0.00 0.00 176.35 174.23 1i01 s VAL 84 N 0.97 2.05 -0.37 1.68 1.01 -0.09 -0.53 120.40 125.13 1i01 s VAL 84 Ca -0.02 -1.37 -0.20 0.00 0.00 0.00 0.00 61.98 60.39 1i01 s VAL 84 Cb -0.15 -2.08 0.00 0.00 0.00 0.00 0.00 36.38 34.15 1i01 s VAL 84 CO -0.03 0.14 0.61 0.20 0.00 0.00 0.00 175.10 176.02 1i01 s ASN 85 N 1.20 6.39 -0.15 3.32 0.01 0.16 -1.91 114.94 123.96 1i01 s ASN 85 Ca -0.04 0.04 -0.02 0.00 -0.71 0.00 0.00 52.86 52.12 1i01 s ASN 85 Cb -0.18 -2.31 -0.02 0.00 0.41 0.00 0.00 41.25 39.15 1i01 s ASN 85 CO -0.07 -0.60 -0.07 0.21 -1.51 0.00 0.00 177.10 175.05 1i01 s ASN 86 N 1.82 4.48 0.00 -1.22 2.47 -1.24 -0.38 114.94 120.86 1i01 s ASN 86 Ca 0.23 -0.21 0.00 0.00 0.42 0.00 0.00 52.86 53.30 1i01 s ASN 86 Cb -0.15 -1.71 0.00 0.00 -1.45 0.00 0.00 41.25 37.94 1i01 s ASN 86 CO 0.15 0.17 0.00 0.00 -3.72 0.00 0.00 177.10 173.70 1i01 n ALA 87 N 3.54 0.00 -3.84 1.71 0.00 -1.25 -4.59 120.51 116.07 1i01 n ALA 87 Ca -0.18 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.11 1i01 n ALA 87 Cb 0.53 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.93 1i01 n ALA 87 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1i01 n ASP 92 N 0.00 -0.16 -3.60 0.00 5.75 -1.26 -5.10 116.55 112.19 1i01 n ASP 92 Ca 0.00 -2.37 -0.07 0.00 -0.01 0.00 0.00 54.79 52.34 1i01 n ASP 92 Cb 0.00 0.97 -0.05 0.00 -1.03 0.00 0.00 41.12 41.02 1i01 n ASP 92 CO 0.00 0.00 0.00 0.21 -0.11 0.00 0.00 177.20 177.30 1i01 s ASN 93 N -2.48 -0.25 0.16 -1.12 2.47 -1.26 -5.05 114.94 107.41 1i01 s ASN 93 Ca 0.23 0.26 -0.30 0.00 0.42 0.00 0.00 52.86 53.46 1i01 s ASN 93 Cb 0.01 0.21 -0.08 0.00 -1.45 0.00 0.00 41.25 39.94 1i01 s ASN 93 CO 0.16 -0.24 1.19 -0.76 -3.72 0.00 0.00 177.10 173.73 1i01 s LEU 94 N -1.16 4.44 0.28 3.21 1.43 -1.26 -3.86 118.68 121.76 1i01 s LEU 94 Ca 0.02 2.18 -0.01 0.00 -1.03 0.00 0.00 54.13 55.30 1i01 s LEU 94 Cb -0.01 -3.60 0.46 0.00 0.03 0.00 0.00 46.19 43.08 1i01 s LEU 94 CO -0.02 -0.38 1.88 -0.07 0.23 0.00 0.00 176.35 178.00 1i01 h LEU 95 N 5.52 0.99 0.00 1.79 3.38 -1.97 -1.22 115.31 123.80 1i01 h LEU 95 Ca -0.44 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.54 1i01 h LEU 95 Cb 1.21 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.77 1i01 h LEU 95 CO 0.76 0.62 0.00 0.23 0.09 0.00 0.00 178.44 180.13 1i01 n MET 96 N -4.51 0.84 0.00 1.13 2.81 -1.26 -2.59 117.12 113.54 1i01 n MET 96 Ca 0.16 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.05 1i01 n MET 96 Cb 0.21 -1.01 0.00 0.00 -0.71 0.00 0.00 33.22 31.72 1i01 n MET 96 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 1i01 n ARG 97 N -0.51 3.56 -2.28 0.03 1.74 -0.48 -5.05 116.66 113.67 1i01 n ARG 97 Ca 0.00 -0.12 -0.40 0.00 -0.77 0.00 0.00 57.85 56.56 1i01 n ARG 97 Cb 0.00 -0.54 -0.03 0.00 -1.02 0.00 0.00 32.46 30.87 1i01 n ARG 97 CO 0.00 0.00 0.00 -1.64 -1.52 0.00 0.00 177.63 174.47 1i01 s MET 98 N -0.54 4.46 0.39 5.56 -1.94 -1.07 -4.99 119.30 121.18 1i01 s MET 98 Ca 0.00 2.01 -0.01 0.00 -1.71 0.00 0.00 55.69 55.98 1i01 s MET 98 Cb 0.00 -3.09 -0.03 0.00 2.01 0.00 0.00 34.83 33.72 1i01 s MET 98 CO 0.00 -0.02 0.62 0.15 -0.01 0.00 0.00 175.02 175.75 1i01 s LYS 99 N -1.68 3.41 0.63 2.03 3.01 -1.26 -4.94 119.74 120.93 1i01 s LYS 99 Ca 0.48 -0.27 0.35 0.00 -1.01 0.00 0.00 55.97 55.51 1i01 s LYS 99 Cb -0.36 -2.59 1.98 0.00 -1.01 0.00 0.00 37.83 35.86 1i01 s LYS 99 CO 0.47 -0.00 2.22 -0.44 0.51 0.00 0.00 175.35 178.11 1i01 h ASP 100 N 0.58 0.00 0.17 2.83 3.32 -1.99 -2.36 116.42 118.97 1i01 h ASP 100 Ca -0.48 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 56.56 1i01 h ASP 100 Cb 1.22 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.77 1i01 h ASP 100 CO 0.61 0.00 -0.12 -0.08 -1.72 0.00 0.00 179.24 177.92 1i01 h GLU 101 N 0.00 -0.27 -0.83 3.56 4.57 -2.00 -1.71 114.58 117.91 1i01 h GLU 101 Ca 0.02 0.02 0.03 0.00 -1.18 0.00 0.00 59.36 58.25 1i01 h GLU 101 Cb 0.20 0.06 -0.04 0.00 -0.16 0.00 0.00 28.75 28.81 1i01 h GLU 101 CO -0.00 -0.18 0.54 1.49 -1.18 0.00 0.00 179.01 179.68 1i01 h GLU 102 N -0.28 1.03 -0.16 1.92 4.81 -1.86 -1.64 114.58 118.38 1i01 h GLU 102 Ca -0.02 -0.06 -0.00 0.00 -0.13 0.00 0.00 59.36 59.14 1i01 h GLU 102 Cb 0.23 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.37 1i01 h GLU 102 CO 0.01 0.68 0.10 2.35 -0.73 0.00 0.00 179.01 181.42 1i01 h TRP 103 N 1.06 0.21 -0.54 0.92 2.91 -1.43 -1.58 115.95 117.50 1i01 h TRP 103 Ca 0.32 -0.00 -0.11 0.00 1.13 0.00 0.00 58.89 60.23 1i01 h TRP 103 Cb -0.02 -0.07 -0.02 0.00 -0.51 0.00 0.00 29.16 28.54 1i01 h TRP 103 CO -0.00 0.17 -0.08 -0.91 -1.03 0.00 0.00 178.44 176.59 1i01 h ASN 104 N 0.19 1.01 -0.82 2.65 2.35 -1.04 -2.59 115.58 117.33 1i01 h ASN 104 Ca 0.06 -0.34 0.06 0.00 -0.55 0.00 0.00 56.30 55.52 1i01 h ASN 104 Cb 0.02 -0.27 -0.06 0.00 0.05 0.00 0.00 38.32 38.06 1i01 h ASN 104 CO -0.01 1.12 0.50 0.44 -1.65 0.00 0.00 177.43 177.82 1i01 h ASP 105 N 0.89 0.78 -0.29 5.81 5.19 -1.09 0.06 116.42 127.77 1i01 h ASP 105 Ca 0.14 0.02 -0.18 0.00 -0.62 0.00 0.00 57.03 56.39 1i01 h ASP 105 Cb 0.65 -0.14 0.00 0.00 0.18 0.00 0.00 39.33 40.01 1i01 h ASP 105 CO 0.04 0.50 -0.53 0.40 -3.12 0.00 0.00 179.24 176.54 1i01 h ILE 106 N 0.92 1.28 -0.70 0.35 2.04 -1.20 -0.66 117.51 119.53 1i01 h ILE 106 Ca 0.36 -1.71 -0.01 0.00 1.00 0.00 0.00 64.86 64.49 1i01 h ILE 106 Cb 0.16 1.63 -0.03 0.00 -0.74 0.00 0.00 36.82 37.84 1i01 h ILE 106 CO -0.17 0.56 0.40 0.40 0.00 0.00 0.00 178.15 179.33 1i01 h ILE 107 N 0.65 1.20 0.12 -0.67 1.08 -1.04 -0.80 117.51 118.05 1i01 h ILE 107 Ca 0.02 -0.49 -0.29 0.00 -0.39 0.00 0.00 64.86 63.70 1i01 h ILE 107 Cb 1.14 0.25 0.03 0.00 -3.07 0.00 0.00 36.82 35.16 1i01 h ILE 107 CO 0.12 0.22 -1.23 -0.08 -0.69 0.00 0.00 178.15 176.49 1i01 h GLU 108 N 0.97 0.58 0.04 2.37 4.81 -0.88 0.15 114.58 122.62 1i01 h GLU 108 Ca 0.25 -0.79 -0.00 0.00 -0.13 0.00 0.00 59.36 58.69 1i01 h GLU 108 Cb 0.00 0.26 0.00 0.00 0.63 0.00 0.00 28.75 29.64 1i01 h GLU 108 CO -0.04 1.35 -0.02 1.15 -0.73 0.00 0.00 179.01 180.72 1i01 h THR 109 N 0.26 1.34 0.00 0.32 2.02 -0.88 -1.96 112.91 114.01 1i01 h THR 109 Ca -0.18 -1.54 0.00 0.00 0.77 0.00 0.00 66.41 65.46 1i01 h THR 109 Cb 1.91 2.31 0.00 0.00 -1.74 0.00 0.00 68.15 70.63 1i01 h THR 109 CO 0.23 0.37 -0.71 0.59 0.37 0.00 0.00 175.52 176.37 1i01 n ASN 110 N -4.79 0.61 0.03 4.18 5.03 -0.33 -4.24 115.26 115.76 1i01 n ASN 110 Ca -0.08 -0.16 -0.00 0.00 0.87 0.00 0.00 54.58 55.20 1i01 n ASN 110 Cb 0.32 0.41 -0.00 0.00 -1.02 0.00 0.00 39.78 39.50 1i01 n ASN 110 CO 0.00 0.00 0.00 -0.11 -1.83 0.00 0.00 177.26 175.32 1i01 n LEU 111 N -1.81 0.72 -0.01 3.41 7.94 -1.07 -4.69 117.00 121.49 1i01 n LEU 111 Ca 0.04 0.09 0.08 0.00 -1.11 0.00 0.00 56.01 55.11 1i01 n LEU 111 Cb 0.39 -0.23 0.48 0.00 0.53 0.00 0.00 43.42 44.60 1i01 n LEU 111 CO 0.37 -0.65 1.16 0.28 -1.11 0.00 0.00 177.39 177.44 1i01 h SER 112 N -0.02 0.38 -0.53 1.96 0.02 -0.76 -2.29 113.55 112.31 1i01 h SER 112 Ca 0.00 -0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 60.89 1i01 h SER 112 Cb 0.02 -0.09 -0.03 0.00 0.14 0.00 0.00 62.40 62.45 1i01 h SER 112 CO 0.00 0.26 0.11 0.77 -1.14 0.00 0.00 176.83 176.83 1i01 h SER 113 N 0.44 0.86 -0.37 3.07 4.64 -1.52 -0.62 113.55 120.04 1i01 h SER 113 Ca 0.19 -0.17 -0.08 0.00 -0.47 0.00 0.00 61.79 61.25 1i01 h SER 113 Cb 0.19 -0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 62.04 1i01 h SER 113 CO -0.05 0.85 -0.04 0.58 -0.87 0.00 0.00 176.83 177.30 1i01 h VAL 114 N 0.87 1.25 -0.36 0.95 2.07 -1.68 -0.42 116.25 118.92 1i01 h VAL 114 Ca 0.18 -1.06 -0.04 0.00 0.82 0.00 0.00 66.70 66.61 1i01 h VAL 114 Cb 0.35 0.94 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 1i01 h VAL 114 CO 0.00 0.37 0.08 0.15 0.02 0.00 0.00 177.57 178.19 1i01 h PHE 115 N 0.72 0.61 -0.53 1.57 3.57 -1.25 -0.90 116.94 120.72 1i01 h PHE 115 Ca 0.13 -0.08 -0.12 0.00 3.53 0.00 0.00 57.97 61.44 1i01 h PHE 115 Cb 0.50 -0.17 -0.02 0.00 2.79 0.00 0.00 35.95 39.05 1i01 h PHE 115 CO 0.03 0.62 -0.12 0.00 -2.23 0.00 0.00 178.31 176.60 1i01 h ARG 116 N 0.43 1.02 -0.22 1.11 3.08 -0.80 -2.08 114.38 116.93 1i01 h ARG 116 Ca 0.11 -0.38 -0.10 0.00 0.07 0.00 0.00 59.98 59.68 1i01 h ARG 116 Cb 0.32 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.31 1i01 h ARG 116 CO 0.00 1.07 -0.26 -0.07 -1.07 0.00 0.00 179.97 179.64 1i01 h LEU 117 N 0.90 0.60 -0.93 3.04 3.38 -1.02 -2.03 115.31 119.25 1i01 h LEU 117 Ca 0.14 -0.50 -0.00 0.00 0.09 0.00 0.00 57.88 57.61 1i01 h LEU 117 Cb 0.69 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 41.22 1i01 h LEU 117 CO 0.05 0.98 0.57 0.28 0.09 0.00 0.00 178.44 180.41 1i01 h SER 118 N 0.24 1.11 -0.69 -0.43 0.02 -1.17 -2.08 113.55 110.55 1i01 h SER 118 Ca 0.03 -0.06 -0.05 0.00 -0.84 0.00 0.00 61.79 60.87 1i01 h SER 118 Cb 0.83 -0.28 -0.03 0.00 0.14 0.00 0.00 62.40 63.06 1i01 h SER 118 CO 0.06 0.84 0.23 0.50 -1.14 0.00 0.00 176.83 177.32 1i01 h LYS 119 N 1.28 1.06 0.00 3.45 3.64 -1.31 -1.98 116.57 122.70 1i01 h LYS 119 Ca 0.34 -0.22 -0.05 0.00 -1.27 0.00 0.00 60.65 59.45 1i01 h LYS 119 Cb -0.07 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.58 1i01 h LYS 119 CO -0.06 0.91 -0.23 0.00 -2.27 0.00 0.00 179.45 177.79 1i01 h ALA 120 N 1.10 1.16 0.00 5.00 0.00 -0.69 -3.26 119.26 122.57 1i01 h ALA 120 Ca 0.22 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1i01 h ALA 120 Cb 0.28 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.03 1i01 h ALA 120 CO -0.01 0.28 -0.82 1.33 0.00 0.00 0.00 179.25 180.03 1i01 n VAL 121 N -3.59 0.00 -0.13 0.00 0.24 -0.95 -4.66 118.33 109.24 1i01 n VAL 121 Ca -0.01 -0.17 -0.09 0.00 -2.04 0.00 0.00 64.34 62.03 1i01 n VAL 121 Cb 0.36 0.91 -0.01 0.00 -1.47 0.00 0.00 33.84 33.63 1i01 n VAL 121 CO 0.00 0.00 0.00 0.24 -2.14 0.00 0.00 176.83 174.93 1i01 h MET 122 N 0.00 0.57 -0.53 7.34 2.07 -1.40 -2.94 114.93 120.04 1i01 h MET 122 Ca 0.00 -0.10 0.10 0.00 -2.07 0.00 0.00 59.70 57.63 1i01 h MET 122 Cb 0.40 -0.09 -0.11 0.00 -1.87 0.00 0.00 31.60 29.92 1i01 h MET 122 CO 0.00 0.54 -0.30 -0.09 1.07 0.00 0.00 176.91 178.13 1i01 h ARG 123 N 0.48 -0.16 0.17 1.72 2.43 -1.83 0.27 114.38 117.46 1i01 h ARG 123 Ca 0.13 0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.30 1i01 h ARG 123 Cb 0.18 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.76 1i01 h ARG 123 CO -0.01 -0.11 -0.08 0.00 -1.51 0.00 0.00 179.97 178.26 1i01 h ALA 124 N 1.03 -0.23 -0.71 2.80 0.00 -1.87 -1.75 119.26 118.53 1i01 h ALA 124 Ca 0.22 -0.05 0.13 0.00 0.00 0.00 0.00 54.91 55.22 1i01 h ALA 124 Cb 0.53 0.09 -0.09 0.00 0.00 0.00 0.00 17.79 18.32 1i01 h ALA 124 CO -0.63 -0.63 0.26 0.52 0.00 0.00 0.00 179.25 178.78 1i01 h MET 125 N -0.23 0.40 -0.73 0.00 2.86 -1.10 -1.37 114.93 114.76 1i01 h MET 125 Ca -0.02 -0.02 -0.02 0.00 -2.06 0.00 0.00 59.70 57.57 1i01 h MET 125 Cb 0.18 -0.09 -0.03 0.00 0.06 0.00 0.00 31.60 31.71 1i01 h MET 125 CO 0.04 0.27 0.37 0.52 1.06 0.00 0.00 176.91 179.16 1i01 h MET 126 N 0.41 1.04 -0.26 1.72 2.07 -0.21 0.16 114.93 119.87 1i01 h MET 126 Ca 0.38 -0.14 -0.10 0.00 -2.07 0.00 0.00 59.70 57.77 1i01 h MET 126 Cb 0.56 -0.19 -0.01 0.00 -1.87 0.00 0.00 31.60 30.09 1i01 h MET 126 CO -0.39 0.80 -0.27 0.87 1.07 0.00 0.00 176.91 178.99 1i01 h LYS 127 N 1.02 0.52 -0.00 1.72 1.57 -0.63 -2.54 116.57 118.23 1i01 h LYS 127 Ca 0.25 -0.21 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 1i01 h LYS 127 Cb 0.09 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.38 1i01 h LYS 127 CO -0.03 0.74 -0.17 1.63 -0.57 0.00 0.00 179.45 181.05 1i01 n LYS 128 N -4.11 0.30 -2.32 3.15 5.02 -0.58 -4.92 118.16 114.71 1i01 n LYS 128 Ca -0.00 -0.10 -0.20 0.00 -2.02 0.00 0.00 58.31 55.98 1i01 n LYS 128 Cb 0.42 -1.50 -0.02 0.00 -0.02 0.00 0.00 35.03 33.92 1i01 n LYS 128 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1i01 n ARG 129 N -1.26 -1.70 -3.68 1.97 5.12 0.51 -4.97 116.66 112.65 1i01 n ARG 129 Ca 0.10 1.00 -0.12 0.00 -1.93 0.00 0.00 57.85 56.91 1i01 n ARG 129 Cb 0.31 -5.64 -0.09 0.00 -1.16 0.00 0.00 32.46 25.88 1i01 n ARG 129 CO 0.00 0.00 0.00 -1.58 -1.93 0.00 0.00 177.63 174.12 1i01 s HIS 130 N -2.98 -0.68 -0.22 -1.55 2.46 -0.81 -4.14 115.29 107.36 1i01 s HIS 130 Ca 0.00 1.54 -0.35 0.00 0.47 0.00 0.00 55.06 56.72 1i01 s HIS 130 Cb 0.00 0.29 0.15 0.00 -0.13 0.00 0.00 32.58 32.89 1i01 s HIS 130 CO 0.00 -0.34 1.26 0.20 -2.47 0.00 0.00 174.74 173.39 1i01 s GLY 131 N 0.78 -0.22 -0.02 1.59 0.00 -0.75 -4.57 107.32 104.13 1i01 s GLY 131 Ca -0.04 1.84 -0.00 0.00 0.00 0.00 0.00 44.72 46.52 1i01 s GLY 131 CO -0.06 0.65 0.03 0.50 0.00 0.00 0.00 173.10 174.21 1i01 s ARG 132 N -2.11 -0.00 -0.17 2.90 1.81 -0.67 -1.67 118.95 119.03 1i01 s ARG 132 Ca 0.09 0.19 -0.00 0.00 -1.72 0.00 0.00 55.73 54.29 1i01 s ARG 132 Cb -0.01 -0.29 0.04 0.00 -0.45 0.00 0.00 34.95 34.24 1i01 s ARG 132 CO -0.04 -0.18 -0.05 0.42 -0.68 0.00 0.00 175.30 174.77 1i01 s ILE 133 N 1.15 1.11 -0.09 1.52 1.01 -0.24 -0.60 121.20 125.07 1i01 s ILE 133 Ca -0.08 -0.65 0.03 0.00 0.00 0.00 0.00 60.65 59.95 1i01 s ILE 133 Cb -0.13 -1.30 0.01 0.00 0.01 0.00 0.00 42.46 41.04 1i01 s ILE 133 CO -0.03 0.11 -0.19 -0.63 0.00 0.00 0.00 174.94 174.20 1i01 s ILE 134 N 1.63 1.71 -0.10 2.92 1.01 0.31 -0.96 121.20 127.70 1i01 s ILE 134 Ca 0.00 -0.81 0.01 0.00 0.00 0.00 0.00 60.65 59.85 1i01 s ILE 134 Cb -0.15 -1.50 -0.02 0.00 0.01 0.00 0.00 42.46 40.79 1i01 s ILE 134 CO -0.08 0.48 -0.13 -0.89 0.00 0.00 0.00 174.94 174.33 1i01 s THR 135 N 0.53 3.12 -0.21 2.92 2.01 -0.58 -0.67 115.64 122.76 1i01 s THR 135 Ca -0.16 -0.66 -0.13 0.00 0.31 0.00 0.00 61.69 61.05 1i01 s THR 135 Cb -0.17 -2.28 -0.05 0.00 0.01 0.00 0.00 72.50 70.01 1i01 s THR 135 CO 0.06 0.55 0.26 -0.63 -0.69 0.00 0.00 174.62 174.16 1i01 s ILE 136 N -0.03 5.30 0.86 1.82 1.09 0.48 -1.14 121.20 129.58 1i01 s ILE 136 Ca -0.03 0.43 -0.15 0.00 -1.10 0.00 0.00 60.65 59.80 1i01 s ILE 136 Cb -0.14 -3.60 0.20 0.00 -1.06 0.00 0.00 42.46 37.86 1i01 s ILE 136 CO 0.04 0.33 1.17 0.61 -0.10 0.00 0.00 174.94 176.99 1i01 n GLY 137 N 3.90 -1.46 0.16 6.18 0.00 -0.13 -3.79 105.19 110.06 1i01 n GLY 137 Ca -0.12 -1.71 -0.19 0.00 0.00 0.00 0.00 46.02 44.00 1i01 n GLY 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i01 h ALA 149 N -1.81 0.09 0.00 4.61 0.00 -1.99 -3.46 119.26 116.68 1i01 h ALA 149 Ca -0.38 -0.63 0.00 0.00 0.00 0.00 0.00 54.91 53.91 1i01 h ALA 149 Cb 1.04 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.88 1i01 h ALA 149 CO 0.27 0.48 0.00 0.27 0.00 0.00 0.00 179.25 180.27 1i01 n ASN 150 N -4.07 0.00 -0.00 0.00 6.94 -1.25 -1.85 115.26 115.02 1i01 n ASN 150 Ca -0.11 -0.07 0.05 0.00 -0.02 0.00 0.00 54.58 54.44 1i01 n ASN 150 Cb 0.76 -0.25 -0.07 0.00 -2.36 0.00 0.00 39.78 37.86 1i01 n ASN 150 CO 0.00 0.00 0.00 -1.22 -1.03 0.00 0.00 177.26 175.01 1i01 n TYR 151 N -1.25 0.00 -0.33 -2.53 4.02 -1.26 -4.67 117.16 111.14 1i01 n TYR 151 Ca 0.10 0.00 0.18 0.00 -0.01 0.00 0.00 57.90 58.17 1i01 n TYR 151 Cb 0.14 -0.11 0.39 0.00 -0.02 0.00 0.00 39.34 39.73 1i01 n TYR 151 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1i01 h ALA 152 N 1.33 1.75 -0.32 -0.72 0.00 -1.80 0.16 119.26 119.66 1i01 h ALA 152 Ca 0.00 0.15 -0.07 0.00 0.00 0.00 0.00 54.91 54.99 1i01 h ALA 152 Cb 0.37 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1i01 h ALA 152 CO 0.00 -0.35 -0.08 0.00 0.00 0.00 0.00 179.25 178.82 1i01 h ALA 153 N 1.75 0.44 -0.40 0.00 0.00 -1.83 -1.42 119.26 117.80 1i01 h ALA 153 Ca 0.65 -0.29 -0.06 0.00 0.00 0.00 0.00 54.91 55.20 1i01 h ALA 153 Cb 1.28 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 1i01 h ALA 153 CO -0.52 0.27 0.01 0.00 0.00 0.00 0.00 179.25 179.01 1i01 h ALA 154 N 0.80 0.53 -0.22 0.00 0.00 -1.27 0.96 119.26 120.06 1i01 h ALA 154 Ca 0.08 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 1i01 h ALA 154 Cb 0.57 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 1i01 h ALA 154 CO 0.03 0.30 0.08 -0.22 0.00 0.00 0.00 179.25 179.44 1i01 h LYS 155 N 0.52 0.33 -0.32 0.00 3.64 -0.78 -0.52 116.57 119.45 1i01 h LYS 155 Ca 0.11 -0.07 -0.11 0.00 -1.27 0.00 0.00 60.65 59.31 1i01 h LYS 155 Cb 0.46 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 32.22 1i01 h LYS 155 CO 0.02 0.41 -0.26 0.00 -2.27 0.00 0.00 179.45 177.34 1i01 h ALA 156 N 0.91 0.94 -0.23 5.00 0.00 -1.23 -2.48 119.26 122.16 1i01 h ALA 156 Ca 0.07 -0.38 -0.09 0.00 0.00 0.00 0.00 54.91 54.52 1i01 h ALA 156 Cb 0.21 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.85 1i01 h ALA 156 CO -0.00 0.61 -0.24 0.78 0.00 0.00 0.00 179.25 180.40 1i01 h GLY 157 N 1.00 0.47 0.96 0.00 0.00 -0.64 -1.87 103.07 102.99 1i01 h GLY 157 Ca 0.08 -0.37 -0.03 0.00 0.00 0.00 0.00 47.33 47.00 1i01 h GLY 157 CO 0.06 0.34 0.15 -2.00 0.00 0.00 0.00 176.54 175.09 1i01 h LEU 158 N 0.39 0.66 -0.58 3.11 5.85 -0.78 0.79 115.31 124.75 1i01 h LEU 158 Ca 0.06 -0.20 -0.12 0.00 0.84 0.00 0.00 57.88 58.46 1i01 h LEU 158 Cb 0.63 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.48 1i01 h LEU 158 CO 0.05 0.68 -0.18 0.40 -0.34 0.00 0.00 178.44 179.05 1i01 h ILE 159 N 0.60 1.27 -0.61 4.05 2.04 -1.28 -1.05 117.51 122.53 1i01 h ILE 159 Ca 0.15 -1.33 -0.08 0.00 1.00 0.00 0.00 64.86 64.61 1i01 h ILE 159 Cb 0.25 1.08 -0.02 0.00 -0.74 0.00 0.00 36.82 37.39 1i01 h ILE 159 CO -0.01 0.46 0.09 1.23 0.00 0.00 0.00 178.15 179.92 1i01 h GLY 160 N 0.92 1.11 0.97 5.37 0.00 -1.08 -1.69 103.07 108.67 1i01 h GLY 160 Ca 0.12 -0.75 -0.04 0.00 0.00 0.00 0.00 47.33 46.66 1i01 h GLY 160 CO 0.06 0.69 0.16 -2.75 0.00 0.00 0.00 176.54 174.70 1i01 h PHE 161 N 0.93 0.79 -0.56 5.60 3.57 -0.63 -2.30 116.94 124.34 1i01 h PHE 161 Ca 0.19 -0.08 -0.04 0.00 3.53 0.00 0.00 57.97 61.57 1i01 h PHE 161 Cb 0.45 -0.23 -0.02 0.00 2.79 0.00 0.00 35.95 38.93 1i01 h PHE 161 CO 0.03 0.68 0.20 0.77 -2.23 0.00 0.00 178.31 177.76 1i01 h SER 162 N 0.66 0.80 -0.68 0.41 0.02 -0.99 0.53 113.55 114.30 1i01 h SER 162 Ca 0.16 -0.19 -0.07 0.00 -0.84 0.00 0.00 61.79 60.85 1i01 h SER 162 Cb 0.26 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.56 1i01 h SER 162 CO -0.01 0.77 0.16 0.11 -1.14 0.00 0.00 176.83 176.73 1i01 h LYS 163 N 0.78 1.11 -0.21 3.45 1.57 -1.26 0.12 116.57 122.12 1i01 h LYS 163 Ca 0.18 -0.26 -0.07 0.00 -1.87 0.00 0.00 60.65 58.63 1i01 h LYS 163 Cb 0.24 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.40 1i01 h LYS 163 CO -0.01 0.98 -0.12 1.03 -0.57 0.00 0.00 179.45 180.75 1i01 h SER 164 N 1.05 0.48 -0.37 0.86 0.87 -1.17 -2.75 113.55 112.52 1i01 h SER 164 Ca 0.22 -0.42 -0.09 0.00 -1.23 0.00 0.00 61.79 60.27 1i01 h SER 164 Cb 0.37 -0.13 -0.02 0.00 -0.44 0.00 0.00 62.40 62.18 1i01 h SER 164 CO 0.00 0.80 -0.07 0.25 -0.53 0.00 0.00 176.83 177.28 1i01 h LEU 165 N 0.16 0.78 -0.38 2.23 5.85 -0.79 -2.77 115.31 120.39 1i01 h LEU 165 Ca 0.05 -0.22 0.05 0.00 0.84 0.00 0.00 57.88 58.60 1i01 h LEU 165 Cb 0.63 -0.21 -0.05 0.00 0.37 0.00 0.00 40.66 41.40 1i01 h LEU 165 CO 0.04 0.89 0.11 0.00 -0.34 0.00 0.00 178.44 179.14 1i01 h ALA 166 N 1.19 0.44 0.00 1.25 0.00 -0.64 -1.28 119.26 120.20 1i01 h ALA 166 Ca 0.13 0.06 -0.06 0.00 0.00 0.00 0.00 54.91 55.03 1i01 h ALA 166 Cb 0.55 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1i01 h ALA 166 CO 0.03 -0.29 -0.31 0.00 0.00 0.00 0.00 179.25 178.69 1i01 h ARG 167 N 0.25 0.00 -0.14 0.00 3.08 -1.34 -1.86 114.38 114.38 1i01 h ARG 167 Ca 0.18 0.00 -0.22 0.00 0.07 0.00 0.00 59.98 60.01 1i01 h ARG 167 Cb 0.18 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.24 1i01 h ARG 167 CO -0.21 0.31 -0.79 1.49 -1.07 0.00 0.00 179.97 179.71 1i01 h GLU 168 N 0.00 0.74 -0.24 0.04 4.81 -0.99 -3.35 114.58 115.59 1i01 h GLU 168 Ca -0.00 -0.61 0.00 0.00 -0.13 0.00 0.00 59.36 58.61 1i01 h GLU 168 Cb 0.67 0.13 0.00 0.00 0.63 0.00 0.00 28.75 30.18 1i01 h GLU 168 CO 0.04 1.22 0.00 1.33 -0.73 0.00 0.00 179.01 180.87 1i01 n VAL 169 N -3.92 0.46 -0.30 0.32 0.24 -0.62 -4.63 118.33 109.88 1i01 n VAL 169 Ca -0.07 -0.73 0.02 0.00 -2.04 0.00 0.00 64.34 61.52 1i01 n VAL 169 Cb 0.75 0.94 0.22 0.00 -1.47 0.00 0.00 33.84 34.28 1i01 n VAL 169 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1i01 h ALA 170 N 2.98 1.46 0.00 2.33 0.00 -1.46 -2.25 119.26 122.32 1i01 h ALA 170 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1i01 h ALA 170 Cb 0.73 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1i01 h ALA 170 CO 0.00 0.44 0.00 -1.13 0.00 0.00 0.00 179.25 178.56 1i01 n SER 171 N -4.46 0.51 -1.00 0.00 3.41 -1.26 -2.28 113.62 108.54 1i01 n SER 171 Ca 0.12 0.64 0.12 0.00 -0.26 0.00 0.00 58.87 59.49 1i01 n SER 171 Cb 0.13 -0.74 0.25 0.00 -0.26 0.00 0.00 64.21 63.58 1i01 n SER 171 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1i01 n ARG 172 N -2.08 2.31 -0.91 4.33 5.12 -0.85 -4.93 116.66 119.65 1i01 n ARG 172 Ca 0.02 -1.98 0.00 0.00 -1.93 0.00 0.00 57.85 53.96 1i01 n ARG 172 Cb 0.18 -1.48 0.00 0.00 -1.16 0.00 0.00 32.46 30.00 1i01 n ARG 172 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1i01 n GLY 173 N 1.41 0.78 3.38 -0.13 0.00 -0.96 -3.37 105.19 106.30 1i01 n GLY 173 Ca 0.18 -0.63 -0.33 0.00 0.00 0.00 0.00 46.02 45.24 1i01 n GLY 173 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1i01 s ILE 174 N -2.00 2.94 -0.01 -0.61 1.01 -1.21 -1.80 121.20 119.52 1i01 s ILE 174 Ca 0.00 -0.72 0.04 0.00 0.00 0.00 0.00 60.65 59.97 1i01 s ILE 174 Cb 0.00 -2.20 -0.03 0.00 0.01 0.00 0.00 42.46 40.24 1i01 s ILE 174 CO 0.00 0.55 -0.11 0.42 0.00 0.00 0.00 174.94 175.80 1i01 s THR 175 N 0.03 3.34 -0.16 2.92 -4.23 -0.67 -3.94 115.64 112.93 1i01 s THR 175 Ca -0.05 -0.83 0.00 0.00 -1.18 0.00 0.00 61.69 59.63 1i01 s THR 175 Cb -0.15 -2.41 0.04 0.00 1.34 0.00 0.00 72.50 71.32 1i01 s THR 175 CO 0.04 0.44 -0.09 -0.69 -0.54 0.00 0.00 174.62 173.79 1i01 s VAL 176 N -0.91 1.34 0.24 2.29 1.01 -1.26 -1.08 120.40 122.03 1i01 s VAL 176 Ca 0.15 -0.68 0.02 0.00 0.00 0.00 0.00 61.98 61.47 1i01 s VAL 176 Cb -0.11 -1.41 -0.05 0.00 0.00 0.00 0.00 36.38 34.81 1i01 s VAL 176 CO 0.05 0.25 0.06 0.20 0.00 0.00 0.00 175.10 175.65 1i01 s ASN 177 N 1.55 1.35 -0.03 3.32 0.01 -0.14 -0.05 114.94 120.95 1i01 s ASN 177 Ca 0.02 -1.31 0.04 0.00 -0.71 0.00 0.00 52.86 50.90 1i01 s ASN 177 Cb -0.15 0.12 -0.00 0.00 0.41 0.00 0.00 41.25 41.62 1i01 s ASN 177 CO -0.09 -0.65 -0.15 -0.69 -1.51 0.00 0.00 177.10 174.02 1i01 s VAL 178 N -3.66 1.19 -0.19 1.60 1.01 -0.31 -1.53 120.40 118.52 1i01 s VAL 178 Ca 0.33 -0.61 -0.02 0.00 0.00 0.00 0.00 61.98 61.68 1i01 s VAL 178 Cb 0.07 -1.02 -0.00 0.00 0.00 0.00 0.00 36.38 35.43 1i01 s VAL 178 CO 0.11 0.35 -0.09 -0.69 0.00 0.00 0.00 175.10 174.77 1i01 s VAL 179 N -0.08 3.06 -0.52 2.92 1.01 -0.29 0.10 120.40 126.60 1i01 s VAL 179 Ca 0.00 -0.61 -0.06 0.00 0.00 0.00 0.00 61.98 61.31 1i01 s VAL 179 Cb -0.09 -2.35 0.14 0.00 0.00 0.00 0.00 36.38 34.08 1i01 s VAL 179 CO 0.01 0.47 0.37 0.00 0.00 0.00 0.00 175.10 175.94 1i01 s ALA 180 N 1.17 3.44 0.61 5.51 0.00 -0.07 -0.95 121.76 131.45 1i01 s ALA 180 Ca 0.02 -2.78 -0.15 0.00 0.00 0.00 0.00 51.96 49.04 1i01 s ALA 180 Cb -0.14 -2.74 -0.03 0.00 0.00 0.00 0.00 23.12 20.21 1i01 s ALA 180 CO -0.03 -1.96 1.06 -1.25 0.00 0.00 0.00 175.76 173.59 1i01 s PRO 181 N 0.86 3.23 0.00 0.00 0.04 -1.26 -1.68 135.00 136.19 1i01 s PRO 181 Ca 0.10 1.20 0.00 0.00 0.04 0.00 0.00 61.00 62.34 1i01 s PRO 181 Cb -0.23 -2.02 0.00 0.00 0.04 0.00 0.00 34.50 32.29 1i01 s PRO 181 CO -0.03 -0.88 0.00 0.41 0.04 0.00 0.00 177.00 176.54 1i01 n GLY 182 N -1.02 0.51 3.59 0.56 0.00 -0.52 -4.87 105.19 103.44 1i01 n GLY 182 Ca 0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 1i01 n GLY 182 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1i01 s PHE 183 N 3.74 3.03 -0.01 1.61 0.08 -1.26 -5.02 117.98 120.15 1i01 s PHE 183 Ca 0.00 0.66 0.01 0.00 0.12 0.00 0.00 56.93 57.72 1i01 s PHE 183 Cb 0.00 -3.74 -0.04 0.00 -0.57 0.00 0.00 43.02 38.67 1i01 s PHE 183 CO 0.00 -0.91 0.02 0.42 -0.10 0.00 0.00 175.22 174.66 1i01 s ILE 184 N 3.56 4.34 -0.06 0.64 -1.09 -1.26 -1.32 121.20 126.01 1i01 s ILE 184 Ca 0.38 -0.51 -0.30 0.00 -2.23 0.00 0.00 60.65 57.99 1i01 s ILE 184 Cb -0.11 -2.94 -0.03 0.00 -1.58 0.00 0.00 42.46 37.80 1i01 s ILE 184 CO 0.21 0.39 1.19 -0.70 -1.23 0.00 0.00 174.94 174.80 1i01 s GLU 185 N -1.54 4.36 0.02 2.79 2.56 -0.33 -4.81 118.70 121.75 1i01 s GLU 185 Ca 0.20 1.66 -0.00 0.00 0.00 0.00 0.00 54.97 56.82 1i01 s GLU 185 Cb -0.12 -3.55 0.00 0.00 2.00 0.00 0.00 34.13 32.46 1i01 s GLU 185 CO 0.10 -0.43 0.03 0.25 -0.56 0.00 0.00 175.26 174.66 1i01 n THR 186 N 4.59 0.00 -0.15 -1.70 -2.24 -1.26 -4.53 114.28 108.99 1i01 n THR 186 Ca 0.11 -0.11 -0.10 0.00 -2.27 0.00 0.00 64.05 61.68 1i01 n THR 186 Cb 0.46 0.07 -0.01 0.00 -2.10 0.00 0.00 70.33 68.75 1i01 n THR 186 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1i01 h ASP 187 N 0.12 0.72 0.03 3.42 5.19 -1.98 -1.68 116.42 122.24 1i01 h ASP 187 Ca -0.02 -0.29 0.01 0.00 -0.62 0.00 0.00 57.03 56.12 1i01 h ASP 187 Cb 0.07 -0.19 -0.02 0.00 0.18 0.00 0.00 39.33 39.37 1i01 h ASP 187 CO 0.02 0.83 -0.11 -0.03 -3.12 0.00 0.00 179.24 176.84 1i01 h MET 188 N 0.58 -0.20 0.00 3.56 4.05 -1.96 -2.48 114.93 118.48 1i01 h MET 188 Ca 0.12 0.01 -0.05 0.00 -0.28 0.00 0.00 59.70 59.50 1i01 h MET 188 Cb 0.45 0.04 -0.01 0.00 -0.80 0.00 0.00 31.60 31.29 1i01 h MET 188 CO 0.02 -0.13 -0.25 1.79 0.23 0.00 0.00 176.91 178.56 1i01 h THR 189 N -0.20 0.73 0.00 -0.77 1.35 -1.86 -2.77 112.91 109.38 1i01 h THR 189 Ca 0.03 -1.08 0.00 0.00 -0.55 0.00 0.00 66.41 64.81 1i01 h THR 189 Cb 0.24 1.68 0.00 0.00 -1.73 0.00 0.00 68.15 68.34 1i01 h THR 189 CO -0.09 0.25 0.00 0.03 -0.25 0.00 0.00 175.52 175.46 1i01 h ARG 190 N 0.00 0.00 0.13 4.72 3.08 -0.87 -3.27 114.38 118.16 1i01 h ARG 190 Ca -0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 1i01 h ARG 190 Cb 0.66 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.71 1i01 h ARG 190 CO 0.03 0.00 -0.06 0.00 -1.07 0.00 0.00 179.97 178.87 1i01 h ALA 191 N 2.31 -0.17 -1.99 0.04 0.00 -1.16 -3.51 119.26 114.79 1i01 h ALA 191 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1i01 h ALA 191 Cb 0.70 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.55 1i01 h ALA 191 CO 0.00 -0.29 0.00 1.28 0.00 0.00 0.00 179.25 180.24 1i01 n LEU 192 N -4.91 0.00 -4.77 0.00 4.77 -1.24 -5.12 117.00 105.73 1i01 n LEU 192 Ca -0.08 0.00 -0.36 0.00 -0.03 0.00 0.00 56.01 55.54 1i01 n LEU 192 Cb 0.27 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.29 1i01 n LEU 192 CO 0.28 -0.61 -0.16 -1.58 -1.33 0.00 0.00 177.39 173.99 1i01 s GLN 196 N 0.00 3.99 0.05 3.23 -0.44 -1.26 -5.10 119.66 120.13 1i01 s GLN 196 Ca 0.00 -0.16 -0.20 0.00 -2.50 0.00 0.00 55.36 52.50 1i01 s GLN 196 Cb 0.00 -3.35 -0.12 0.00 -1.64 0.00 0.00 33.01 27.89 1i01 s GLN 196 CO 0.00 0.43 1.41 0.00 0.50 0.00 0.00 175.29 177.63 1i01 h ARG 197 N 6.18 0.36 -0.76 1.67 3.08 -2.00 -3.02 114.38 119.89 1i01 h ARG 197 Ca -0.45 -0.16 0.16 0.00 0.07 0.00 0.00 59.98 59.61 1i01 h ARG 197 Cb 1.17 -0.01 -0.05 0.00 0.08 0.00 0.00 29.97 31.16 1i01 h ARG 197 CO 0.71 0.67 0.51 0.00 -1.07 0.00 0.00 179.97 180.79 1i01 h ALA 198 N 0.68 2.20 0.00 0.04 0.00 -2.00 0.30 119.26 120.49 1i01 h ALA 198 Ca 0.04 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.89 1i01 h ALA 198 Cb 0.56 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.30 1i01 h ALA 198 CO 0.03 -0.42 -0.29 0.78 0.00 0.00 0.00 179.25 179.35 1i01 h GLY 199 N 0.35 0.00 0.05 0.00 0.00 -1.97 -1.02 103.07 100.48 1i01 h GLY 199 Ca 0.38 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.70 1i01 h GLY 199 CO -0.11 0.00 -0.02 -2.22 0.00 0.00 0.00 176.54 174.19 1i01 h ILE 200 N 0.00 0.00 -1.05 2.60 1.08 -0.43 -3.35 117.51 116.36 1i01 h ILE 200 Ca -0.00 -0.64 0.28 0.00 -0.39 0.00 0.00 64.86 64.10 1i01 h ILE 200 Cb 0.66 0.00 -0.08 0.00 -3.07 0.00 0.00 36.82 34.33 1i01 h ILE 200 CO 0.04 0.00 0.70 -0.07 -0.69 0.00 0.00 178.15 178.13 1i01 h LEU 201 N -0.70 0.32 -2.35 1.44 -0.00 -1.13 0.59 115.31 113.46 1i01 h LEU 201 Ca -0.01 0.06 0.00 0.00 -0.00 0.00 0.00 57.88 57.93 1i01 h LEU 201 Cb 0.05 0.01 0.00 0.00 -0.00 0.00 0.00 40.66 40.71 1i01 h LEU 201 CO 0.01 0.06 0.00 0.00 -0.00 0.00 0.00 178.44 178.51 1i01 h ALA 202 N 1.57 1.00 -0.01 1.53 0.00 -1.31 0.10 119.26 122.15 1i01 h ALA 202 Ca 0.57 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.48 1i01 h ALA 202 Cb 1.67 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.46 1i01 h ALA 202 CO -0.21 0.00 -0.37 1.04 0.00 0.00 0.00 179.25 179.71 1i01 n GLN 203 N -2.94 0.59 -3.84 0.00 6.02 0.21 -4.81 117.38 112.61 1i01 n GLN 203 Ca -0.02 -0.37 -0.36 0.00 -0.01 0.00 0.00 57.00 56.24 1i01 n GLN 203 Cb 0.13 -1.49 -0.13 0.00 1.02 0.00 0.00 30.24 29.76 1i01 n GLN 203 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1i01 s VAL 204 N -2.66 3.28 0.22 5.09 1.01 0.36 -4.54 120.40 123.16 1i01 s VAL 204 Ca 0.20 -1.39 -0.10 0.00 0.00 0.00 0.00 61.98 60.69 1i01 s VAL 204 Cb 0.19 -2.92 0.22 0.00 0.00 0.00 0.00 36.38 33.86 1i01 s VAL 204 CO 0.59 -0.20 1.65 -0.65 0.00 0.00 0.00 175.10 176.49 1i01 h PRO 205 N 8.08 0.10 0.00 2.72 0.11 -1.80 0.68 132.00 141.89 1i01 h PRO 205 Ca -0.21 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.90 1i01 h PRO 205 Cb 1.07 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.15 1i01 h PRO 205 CO 0.58 0.07 0.20 0.00 -0.21 0.00 0.00 178.00 178.64 1i01 n ALA 206 N -2.85 0.74 -0.84 -0.75 0.00 -0.55 -4.77 120.51 111.48 1i01 n ALA 206 Ca 0.10 0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.67 1i01 n ALA 206 Cb 0.38 -0.91 0.00 0.00 0.00 0.00 0.00 19.45 18.91 1i01 n ALA 206 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1i01 n GLY 207 N -1.29 0.27 3.18 0.00 0.00 0.24 -4.94 105.19 102.65 1i01 n GLY 207 Ca -0.01 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.90 1i01 n GLY 207 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1i01 s ARG 208 N -0.97 1.07 0.29 1.61 1.70 -1.26 -4.97 118.95 116.41 1i01 s ARG 208 Ca 0.00 -1.54 -0.07 0.00 -0.47 0.00 0.00 55.73 53.66 1i01 s ARG 208 Cb 0.00 0.21 -0.06 0.00 -0.57 0.00 0.00 34.95 34.53 1i01 s ARG 208 CO 0.00 -0.31 0.57 -0.51 -1.08 0.00 0.00 175.30 173.97 1i01 s LEU 209 N -3.11 4.06 0.51 -1.89 1.43 -1.26 -4.95 118.68 113.47 1i01 s LEU 209 Ca 0.31 0.80 -0.08 0.00 -1.03 0.00 0.00 54.13 54.13 1i01 s LEU 209 Cb 0.07 -3.61 -0.04 0.00 0.03 0.00 0.00 46.19 42.64 1i01 s LEU 209 CO 0.07 -0.19 0.86 -0.83 0.23 0.00 0.00 176.35 176.49 1i01 s GLY 210 N -2.97 1.61 0.23 -3.19 0.00 -0.44 -4.82 107.32 97.73 1i01 s GLY 210 Ca 0.45 -0.33 -0.03 0.00 0.00 0.00 0.00 44.72 44.81 1i01 s GLY 210 CO 0.28 -0.13 0.45 -0.32 0.00 0.00 0.00 173.10 173.38 1i01 s GLY 211 N -3.98 1.90 0.41 0.20 0.00 -1.26 -1.19 107.32 103.40 1i01 s GLY 211 Ca 0.50 -0.67 0.09 0.00 0.00 0.00 0.00 44.72 44.64 1i01 s GLY 211 CO 0.45 -0.60 2.02 0.00 0.00 0.00 0.00 173.10 174.98 1i01 h ALA 212 N 2.02 1.81 0.00 3.20 0.00 -1.92 -0.64 119.26 123.73 1i01 h ALA 212 Ca -0.48 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.38 1i01 h ALA 212 Cb 1.19 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.83 1i01 h ALA 212 CO 0.68 0.12 -0.14 0.37 0.00 0.00 0.00 179.25 180.28 1i01 h GLN 213 N 0.52 0.00 -0.13 0.00 5.75 -1.93 -2.29 115.11 117.04 1i01 h GLN 213 Ca 0.21 0.00 -0.10 0.00 -0.15 0.00 0.00 58.65 58.61 1i01 h GLN 213 Cb 0.18 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.72 1i01 h GLN 213 CO -0.06 0.14 -0.37 0.93 -2.65 0.00 0.00 178.83 176.83 1i01 h GLU 214 N 0.00 0.27 -0.08 1.69 5.08 -1.50 0.17 114.58 120.21 1i01 h GLU 214 Ca -0.00 -0.12 -0.22 0.00 -1.00 0.00 0.00 59.36 58.02 1i01 h GLU 214 Cb 0.26 -0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.51 1i01 h GLU 214 CO 0.02 0.61 -0.85 0.82 -1.00 0.00 0.00 179.01 178.61 1i01 h ILE 215 N 0.23 1.32 -0.46 3.13 5.03 -1.45 -3.06 117.51 122.25 1i01 h ILE 215 Ca 0.03 -2.15 -0.04 0.00 -0.12 0.00 0.00 64.86 62.58 1i01 h ILE 215 Cb 0.76 2.16 -0.02 0.00 -3.03 0.00 0.00 36.82 36.69 1i01 h ILE 215 CO 0.06 0.66 0.12 0.00 -0.68 0.00 0.00 178.15 178.31 1i01 h ALA 216 N 0.65 1.34 -0.66 1.87 0.00 -0.95 -1.42 119.26 120.08 1i01 h ALA 216 Ca -0.07 -0.17 -0.08 0.00 0.00 0.00 0.00 54.91 54.59 1i01 h ALA 216 Cb 1.47 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 19.04 1i01 h ALA 216 CO 0.16 0.47 0.12 -0.91 0.00 0.00 0.00 179.25 179.09 1i01 h ASN 217 N 0.67 1.05 -0.37 0.00 2.35 -0.95 0.12 115.58 118.45 1i01 h ASN 217 Ca 0.15 -0.25 -0.08 0.00 -0.55 0.00 0.00 56.30 55.57 1i01 h ASN 217 Cb 0.24 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.33 1i01 h ASN 217 CO -0.00 1.03 -0.07 0.00 -1.65 0.00 0.00 177.43 176.74 1i01 h ALA 218 N 1.05 0.51 -0.31 -0.83 0.00 -1.35 -1.52 119.26 116.81 1i01 h ALA 218 Ca 0.20 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 1i01 h ALA 218 Cb 0.42 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1i01 h ALA 218 CO 0.01 0.34 0.15 0.28 0.00 0.00 0.00 179.25 180.03 1i01 h VAL 219 N 0.50 1.16 -0.97 0.00 2.07 -1.11 -1.63 116.25 116.27 1i01 h VAL 219 Ca 0.10 -0.46 0.06 0.00 0.82 0.00 0.00 66.70 67.22 1i01 h VAL 219 Cb 0.57 0.89 -0.07 0.00 -1.52 0.00 0.00 31.29 31.16 1i01 h VAL 219 CO 0.03 0.16 0.62 0.00 0.02 0.00 0.00 177.57 178.41 1i01 h ALA 220 N 1.00 1.35 -0.04 1.67 0.00 -0.84 -0.66 119.26 121.74 1i01 h ALA 220 Ca 0.11 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1i01 h ALA 220 Cb 0.13 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 1i01 h ALA 220 CO -0.01 0.41 0.01 0.35 0.00 0.00 0.00 179.25 180.01 1i01 h PHE 221 N 1.13 0.06 0.00 0.00 3.57 -0.91 -2.56 116.94 118.24 1i01 h PHE 221 Ca 0.42 -0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.88 1i01 h PHE 221 Cb 0.17 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 38.88 1i01 h PHE 221 CO -0.01 0.21 -0.18 -0.07 -2.23 0.00 0.00 178.31 176.03 1i01 h LEU 222 N -0.11 0.00 0.00 0.59 3.38 -0.77 -2.45 115.31 115.95 1i01 h LEU 222 Ca 0.01 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 1i01 h LEU 222 Cb 0.18 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.92 1i01 h LEU 222 CO -0.00 0.18 -0.11 0.00 0.09 0.00 0.00 178.44 178.60 1i01 h ALA 223 N 1.82 0.94 -2.26 1.53 0.00 -0.99 -3.44 119.26 116.86 1i01 h ALA 223 Ca -0.00 -0.06 -0.45 0.00 0.00 0.00 0.00 54.91 54.40 1i01 h ALA 223 Cb 0.41 -0.01 0.15 0.00 0.00 0.00 0.00 17.79 18.34 1i01 h ALA 223 CO 0.02 0.08 0.34 -1.54 0.00 0.00 0.00 179.25 178.16 1i01 s SER 224 N -6.21 3.12 0.47 0.00 1.04 -0.92 -4.94 113.70 106.27 1i01 s SER 224 Ca 0.06 0.61 0.29 0.00 0.48 0.00 0.00 55.95 57.39 1i01 s SER 224 Cb 0.06 -0.91 0.95 0.00 0.10 0.00 0.00 66.02 66.21 1i01 s SER 224 CO 0.69 -2.76 1.82 0.44 0.98 0.00 0.00 173.24 174.41 1i01 h ASP 225 N -1.65 0.00 0.49 7.02 3.32 -1.90 -3.05 116.42 120.65 1i01 h ASP 225 Ca -0.46 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.59 1i01 h ASP 225 Cb 1.29 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.84 1i01 h ASP 225 CO 0.49 0.00 0.00 -0.62 -1.72 0.00 0.00 179.24 177.39 1i01 n GLU 226 N -2.99 0.04 -0.39 3.56 1.02 -1.26 -2.26 120.64 118.35 1i01 n GLU 226 Ca 0.02 0.30 0.06 0.00 -0.02 0.00 0.00 57.16 57.53 1i01 n GLU 226 Cb 0.39 -1.57 0.19 0.00 -0.02 0.00 0.00 31.44 30.42 1i01 n GLU 226 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1i01 n ALA 227 N -1.55 3.09 0.30 0.62 0.00 -1.15 -4.76 120.51 117.05 1i01 n ALA 227 Ca 0.03 -2.84 0.18 0.00 0.00 0.00 0.00 53.44 50.80 1i01 n ALA 227 Cb 0.16 -0.48 0.99 0.00 0.00 0.00 0.00 19.45 20.12 1i01 n ALA 227 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1i01 h ALA 228 N 0.72 1.41 -0.69 0.00 0.00 -1.61 -1.29 119.26 117.81 1i01 h ALA 228 Ca 0.03 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1i01 h ALA 228 Cb 1.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1i01 h ALA 228 CO 0.10 -0.06 0.00 0.98 0.00 0.00 0.00 179.25 180.27 1i01 n TYR 229 N -3.58 0.92 -3.76 0.00 9.36 -1.26 -4.86 117.16 113.98 1i01 n TYR 229 Ca -0.02 -0.49 -0.37 0.00 3.32 0.00 0.00 57.90 60.34 1i01 n TYR 229 Cb 0.13 -0.00 -0.13 0.00 -0.63 0.00 0.00 39.34 38.71 1i01 n TYR 229 CO 0.00 0.00 0.00 0.42 0.22 0.00 0.00 176.86 177.50 1i01 s ILE 230 N -1.02 4.11 -0.07 2.97 1.01 -0.49 -5.08 121.20 122.63 1i01 s ILE 230 Ca 0.46 -0.44 -0.22 0.00 0.00 0.00 0.00 60.65 60.46 1i01 s ILE 230 Cb 0.24 -3.02 0.05 0.00 0.01 0.00 0.00 42.46 39.74 1i01 s ILE 230 CO 0.32 0.21 0.50 0.28 0.00 0.00 0.00 174.94 176.25 1i01 s THR 231 N 1.56 0.02 -0.78 2.92 -1.32 -1.26 -4.69 115.64 112.08 1i01 s THR 231 Ca 0.05 -0.18 0.00 0.00 -1.21 0.00 0.00 61.69 60.34 1i01 s THR 231 Cb -0.16 -0.78 0.00 0.00 -1.51 0.00 0.00 72.50 70.05 1i01 s THR 231 CO 0.03 -0.10 0.00 0.61 -2.21 0.00 0.00 174.62 172.95 1i01 n GLY 232 N 1.53 0.95 3.82 6.08 0.00 0.92 -4.95 105.19 113.54 1i01 n GLY 232 Ca -0.19 -0.68 -0.32 0.00 0.00 0.00 0.00 46.02 44.84 1i01 n GLY 232 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1i01 s GLU 233 N -2.58 3.11 -0.36 1.61 2.56 -1.26 -4.75 118.70 117.04 1i01 s GLU 233 Ca 0.00 -0.52 -0.04 0.00 0.00 0.00 0.00 54.97 54.41 1i01 s GLU 233 Cb 0.00 -2.88 0.07 0.00 2.00 0.00 0.00 34.13 33.33 1i01 s GLU 233 CO 0.00 0.62 0.12 0.99 -0.56 0.00 0.00 175.26 176.43 1i01 s THR 234 N -1.33 3.39 -0.42 -1.70 2.01 -1.26 -1.16 115.64 115.17 1i01 s THR 234 Ca 0.28 -1.57 -0.21 0.00 0.31 0.00 0.00 61.69 60.50 1i01 s THR 234 Cb -0.12 -3.09 0.02 0.00 0.01 0.00 0.00 72.50 69.32 1i01 s THR 234 CO 0.20 -0.37 0.65 -0.22 -0.69 0.00 0.00 174.62 174.19 1i01 s LEU 235 N 1.26 4.41 -0.04 4.42 2.96 0.12 -4.91 118.68 126.90 1i01 s LEU 235 Ca 0.01 -0.20 -0.24 0.00 -0.22 0.00 0.00 54.13 53.49 1i01 s LEU 235 Cb -0.21 -2.77 -0.04 0.00 0.50 0.00 0.00 46.19 43.67 1i01 s LEU 235 CO -0.01 -0.75 0.72 -1.00 -1.32 0.00 0.00 176.35 174.00 1i01 s HIS 236 N 2.84 3.61 -0.50 5.38 3.76 -1.26 -0.90 115.29 128.23 1i01 s HIS 236 Ca 0.24 1.31 0.03 0.00 -0.15 0.00 0.00 55.06 56.49 1i01 s HIS 236 Cb -0.14 -2.82 0.14 0.00 1.11 0.00 0.00 32.58 30.87 1i01 s HIS 236 CO 0.18 0.12 0.29 0.08 -0.85 0.00 0.00 174.74 174.56 1i01 s VAL 237 N 0.64 1.89 0.00 -0.90 1.01 -0.67 -4.94 120.40 117.43 1i01 s VAL 237 Ca 0.38 -3.02 0.05 0.00 0.00 0.00 0.00 61.98 59.39 1i01 s VAL 237 Cb -0.18 -2.30 0.08 0.00 0.00 0.00 0.00 36.38 33.98 1i01 s VAL 237 CO 0.19 -0.90 0.98 -0.46 0.00 0.00 0.00 175.10 174.91 1i01 n ASN 238 N 3.16 0.16 -2.22 3.32 2.04 -1.26 -1.43 115.26 119.02 1i01 n ASN 238 Ca 0.10 -1.89 -0.21 0.00 -0.44 0.00 0.00 54.58 52.15 1i01 n ASN 238 Cb 0.35 -0.18 -0.03 0.00 -2.53 0.00 0.00 39.78 37.39 1i01 n ASN 238 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1i01 n GLY 239 N 0.10 0.06 1.30 4.83 0.00 -1.26 -2.21 105.19 108.00 1i01 n GLY 239 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1i01 n GLY 239 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1i01 n GLY 240 N -0.87 0.86 0.00 -0.02 0.00 -1.26 -1.49 105.19 102.41 1i01 n GLY 240 Ca -0.24 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.78 1i01 n GLY 240 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19