#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i01 n ASN 2 N 0.00 0.30 -0.48 7.83 0.23 -1.17 -3.43 115.26 118.55 1i01 n ASN 2 Ca 0.00 -1.19 0.09 0.00 -0.53 0.00 0.00 54.58 52.95 1i01 n ASN 2 Cb 0.00 -0.01 0.01 0.00 -2.08 0.00 0.00 39.78 37.71 1i01 n ASN 2 CO 0.00 0.00 0.00 0.49 -0.93 0.00 0.00 177.26 176.82 1i01 n PHE 3 N -0.72 0.00 -1.50 -2.53 3.01 -0.54 -4.89 117.46 110.30 1i01 n PHE 3 Ca 0.21 0.00 -0.58 0.00 1.01 0.00 0.00 57.45 58.08 1i01 n PHE 3 Cb 0.15 0.00 -0.08 0.00 -0.01 0.00 0.00 39.48 39.53 1i01 n PHE 3 CO 0.00 0.00 0.00 -1.91 1.01 0.00 0.00 176.76 175.86 1i01 n GLU 4 N 0.15 0.00 -0.31 -1.08 2.13 -1.22 -0.35 120.64 119.96 1i01 n GLU 4 Ca 0.08 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.90 1i01 n GLU 4 Cb 0.40 -1.33 0.00 0.00 0.27 0.00 0.00 31.44 30.77 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 2.97 0.99 3.89 8.31 0.00 -1.25 -5.01 105.19 115.09 1i01 n GLY 5 Ca 0.25 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.94 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 -0.52 3.39 -0.16 1.61 -0.14 0.52 -5.01 119.74 119.43 1i01 s LYS 6 Ca 0.00 -0.38 -0.01 0.00 -1.36 0.00 0.00 55.97 54.22 1i01 s LYS 6 Cb 0.00 -3.05 -0.01 0.00 -1.68 0.00 0.00 37.83 33.09 1i01 s LYS 6 CO 0.00 0.65 -0.11 0.42 -0.76 0.00 0.00 175.35 175.55 1i01 s ILE 7 N -1.37 3.09 -0.07 2.17 1.01 -1.26 -1.16 121.20 123.60 1i01 s ILE 7 Ca 0.29 -0.63 0.05 0.00 0.00 0.00 0.00 60.65 60.36 1i01 s ILE 7 Cb -0.13 -2.33 -0.01 0.00 0.01 0.00 0.00 42.46 40.00 1i01 s ILE 7 CO 0.21 0.50 -0.23 0.00 0.00 0.00 0.00 174.94 175.42 1i01 s ALA 8 N 0.75 2.26 -0.28 9.38 0.00 0.26 -0.87 121.76 133.24 1i01 s ALA 8 Ca -0.05 -1.01 -0.07 0.00 0.00 0.00 0.00 51.96 50.84 1i01 s ALA 8 Cb -0.15 -0.79 0.00 0.00 0.00 0.00 0.00 23.12 22.18 1i01 s ALA 8 CO 0.02 0.38 0.07 -1.17 0.00 0.00 0.00 175.76 175.06 1i01 s LEU 9 N -0.05 3.71 -0.25 0.00 2.96 0.54 -0.76 118.68 124.84 1i01 s LEU 9 Ca -0.06 -0.61 -0.01 0.00 -0.22 0.00 0.00 54.13 53.23 1i01 s LEU 9 Cb -0.15 -1.88 0.03 0.00 0.50 0.00 0.00 46.19 44.70 1i01 s LEU 9 CO 0.05 -0.15 -0.08 -0.69 -1.32 0.00 0.00 176.35 174.16 1i01 s VAL 10 N 1.52 2.69 0.34 1.68 1.01 -0.07 -0.96 120.40 126.60 1i01 s VAL 10 Ca 0.03 -1.17 -0.19 0.00 0.00 0.00 0.00 61.98 60.65 1i01 s VAL 10 Cb -0.17 -2.40 -0.10 0.00 0.00 0.00 0.00 36.38 33.71 1i01 s VAL 10 CO 0.02 0.15 0.83 0.42 0.00 0.00 0.00 175.10 176.52 1i01 s THR 11 N 1.27 4.52 -1.13 3.92 -4.23 -0.81 -1.27 115.64 117.91 1i01 s THR 11 Ca -0.02 1.27 -0.02 0.00 -1.18 0.00 0.00 61.69 61.74 1i01 s THR 11 Cb -0.17 -3.69 0.00 0.00 1.34 0.00 0.00 72.50 69.98 1i01 s THR 11 CO -0.05 -0.13 0.96 0.61 -0.54 0.00 0.00 174.62 175.46 1i01 n GLY 12 N -0.19 -0.32 1.07 3.99 0.00 -0.95 -3.63 105.19 105.16 1i01 n GLY 12 Ca 0.04 0.08 0.05 0.00 0.00 0.00 0.00 46.02 46.19 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 -4.12 2.89 -0.03 4.61 0.00 -0.72 -4.10 120.51 119.04 1i01 n ALA 13 Ca -0.18 -0.95 -0.10 0.00 0.00 0.00 0.00 53.44 52.21 1i01 n ALA 13 Cb 0.62 -1.02 -0.04 0.00 0.00 0.00 0.00 19.45 19.01 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 2.43 0.16 -2.63 0.00 0.02 -1.89 -3.27 113.55 108.36 1i01 h SER 14 Ca 0.00 0.00 -0.09 0.00 -0.84 0.00 0.00 61.79 60.86 1i01 h SER 14 Cb 0.99 -0.03 -0.02 0.00 0.14 0.00 0.00 62.40 63.48 1i01 h SER 14 CO 0.15 0.12 0.06 -2.11 -1.14 0.00 0.00 176.83 173.91 1i01 n ARG 15 N -4.99 0.60 0.00 3.45 1.85 -1.26 -4.77 116.66 111.54 1i01 n ARG 15 Ca -0.04 -1.58 0.00 0.00 -1.00 0.00 0.00 57.85 55.24 1i01 n ARG 15 Cb 0.04 1.74 0.00 0.00 -1.05 0.00 0.00 32.46 33.19 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 -0.35 2.84 0.17 2.89 0.00 -1.26 -2.66 105.19 106.81 1i01 n GLY 16 Ca -0.03 -0.19 -0.05 0.00 0.00 0.00 0.00 46.02 45.75 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 0.79 -0.48 -0.61 2.04 -1.93 -1.00 117.51 116.31 1i01 h ILE 17 Ca 0.00 -0.07 0.06 0.00 1.00 0.00 0.00 64.86 65.85 1i01 h ILE 17 Cb 0.00 0.57 -0.05 0.00 -0.74 0.00 0.00 36.82 36.59 1i01 h ILE 17 CO 0.00 0.04 0.18 1.23 0.00 0.00 0.00 178.15 179.60 1i01 h GLY 18 N 0.20 0.65 1.25 5.37 0.00 -1.67 -0.14 103.07 108.73 1i01 h GLY 18 Ca 0.19 -0.10 -0.15 0.00 0.00 0.00 0.00 47.33 47.28 1i01 h GLY 18 CO -0.26 0.02 -0.36 -0.09 0.00 0.00 0.00 176.54 175.86 1i01 h ARG 19 N 0.36 0.83 -0.82 4.80 2.43 -1.24 -1.58 114.38 119.16 1i01 h ARG 19 Ca 0.23 -0.41 -0.01 0.00 -0.81 0.00 0.00 59.98 58.97 1i01 h ARG 19 Cb 0.23 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.74 1i01 h ARG 19 CO -0.23 1.05 0.47 0.00 -1.51 0.00 0.00 179.97 179.75 1i01 h ALA 20 N 0.90 1.05 -0.20 2.80 0.00 -0.74 0.12 119.26 123.20 1i01 h ALA 20 Ca 0.06 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1i01 h ALA 20 Cb 0.92 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 1i01 h ALA 20 CO 0.08 0.54 0.06 0.82 0.00 0.00 0.00 179.25 180.75 1i01 h ILE 21 N 1.13 1.20 -0.65 0.00 2.04 -0.88 -0.80 117.51 119.56 1i01 h ILE 21 Ca 0.29 -0.62 -0.02 0.00 1.00 0.00 0.00 64.86 65.51 1i01 h ILE 21 Cb 0.00 1.22 -0.03 0.00 -0.74 0.00 0.00 36.82 37.27 1i01 h ILE 21 CO -0.05 0.19 0.33 0.00 0.00 0.00 0.00 178.15 178.63 1i01 h ALA 22 N 0.88 0.84 -0.28 1.87 0.00 -0.85 -1.52 119.26 120.20 1i01 h ALA 22 Ca 0.06 -0.12 -0.13 0.00 0.00 0.00 0.00 54.91 54.72 1i01 h ALA 22 Cb 0.25 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 1i01 h ALA 22 CO -0.00 0.38 -0.36 0.93 0.00 0.00 0.00 179.25 180.19 1i01 h GLU 23 N 0.89 0.64 -0.24 0.00 5.08 -0.69 -2.04 114.58 118.22 1i01 h GLU 23 Ca 0.23 -0.31 -0.06 0.00 -1.00 0.00 0.00 59.36 58.22 1i01 h GLU 23 Cb 0.08 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 1i01 h GLU 23 CO -0.03 0.90 -0.07 1.15 -1.00 0.00 0.00 179.01 179.97 1i01 h THR 24 N 0.53 1.29 -0.61 1.13 2.02 -0.90 0.47 112.91 116.84 1i01 h THR 24 Ca 0.05 -1.08 -0.06 0.00 0.77 0.00 0.00 66.41 66.09 1i01 h THR 24 Cb 0.87 1.50 -0.03 0.00 -1.74 0.00 0.00 68.15 68.75 1i01 h THR 24 CO 0.08 0.33 0.14 -0.07 0.37 0.00 0.00 175.52 176.37 1i01 h LEU 25 N 0.20 0.91 -0.48 2.58 3.38 -1.28 -2.18 115.31 118.44 1i01 h LEU 25 Ca 0.06 -0.18 -0.12 0.00 0.09 0.00 0.00 57.88 57.73 1i01 h LEU 25 Cb 0.53 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 1i01 h LEU 25 CO 0.03 0.88 -0.16 0.00 0.09 0.00 0.00 178.44 179.27 1i01 h ALA 26 N 1.23 0.67 0.00 1.53 0.00 -1.26 -1.35 119.26 120.07 1i01 h ALA 26 Ca 0.20 -0.37 -0.01 0.00 0.00 0.00 0.00 54.91 54.73 1i01 h ALA 26 Cb 0.34 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.96 1i01 h ALA 26 CO 0.00 0.61 -0.04 0.00 0.00 0.00 0.00 179.25 179.82 1i01 h ALA 27 N 0.87 1.08 -0.63 0.00 0.00 -0.62 -2.02 119.26 117.94 1i01 h ALA 27 Ca 0.12 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.85 1i01 h ALA 27 Cb 0.73 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.43 1i01 h ALA 27 CO 0.06 0.05 0.16 0.54 0.00 0.00 0.00 179.25 180.06 1i01 n ARG 28 N -3.26 3.84 -0.38 0.00 1.74 -0.84 -4.72 116.66 113.04 1i01 n ARG 28 Ca -0.01 -3.09 0.00 0.00 -0.77 0.00 0.00 57.85 53.97 1i01 n ARG 28 Cb 0.22 -2.17 0.00 0.00 -1.02 0.00 0.00 32.46 29.48 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 -0.06 0.69 3.87 -0.13 0.00 -0.76 -1.47 105.19 107.34 1i01 n GLY 29 Ca 0.35 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.07 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 -2.74 3.27 -0.28 4.61 0.00 -0.54 -3.43 121.76 122.65 1i01 s ALA 30 Ca 0.00 -0.10 -0.22 0.00 0.00 0.00 0.00 51.96 51.65 1i01 s ALA 30 Cb 0.00 -2.82 -0.01 0.00 0.00 0.00 0.00 23.12 20.29 1i01 s ALA 30 CO 0.00 -0.08 0.69 0.15 0.00 0.00 0.00 175.76 176.52 1i01 s LYS 31 N -3.93 4.04 -0.12 0.00 -0.14 -0.31 -4.35 119.74 114.93 1i01 s LYS 31 Ca 0.53 0.55 -0.02 0.00 -1.36 0.00 0.00 55.97 55.67 1i01 s LYS 31 Cb -0.10 -3.68 -0.03 0.00 -1.68 0.00 0.00 37.83 32.34 1i01 s LYS 31 CO 0.32 -0.52 -0.07 0.08 -0.76 0.00 0.00 175.35 174.40 1i01 s VAL 32 N 2.67 3.64 -0.30 3.17 1.01 -0.30 -0.58 120.40 129.71 1i01 s VAL 32 Ca 0.28 -0.47 -0.00 0.00 0.00 0.00 0.00 61.98 61.80 1i01 s VAL 32 Cb -0.15 -2.55 0.06 0.00 0.00 0.00 0.00 36.38 33.74 1i01 s VAL 32 CO 0.10 0.53 -0.01 -0.63 0.00 0.00 0.00 175.10 175.09 1i01 s ILE 33 N 0.01 2.74 0.01 2.22 1.09 0.06 -1.23 121.20 126.10 1i01 s ILE 33 Ca -0.01 -1.56 -0.02 0.00 -1.10 0.00 0.00 60.65 57.96 1i01 s ILE 33 Cb -0.14 -2.64 -0.04 0.00 -1.06 0.00 0.00 42.46 38.59 1i01 s ILE 33 CO 0.03 -0.16 0.16 -0.83 -0.10 0.00 0.00 174.94 174.04 1i01 s GLY 34 N 1.23 2.14 0.29 6.18 0.00 -0.67 -0.89 107.32 115.59 1i01 s GLY 34 Ca -0.04 -0.81 0.11 0.00 0.00 0.00 0.00 44.72 43.98 1i01 s GLY 34 CO -0.03 -0.71 -0.16 -0.51 0.00 0.00 0.00 173.10 171.69 1i01 s THR 35 N -1.33 2.55 0.14 0.90 -4.23 -0.40 -1.27 115.64 112.00 1i01 s THR 35 Ca 0.28 -2.33 -0.06 0.00 -1.18 0.00 0.00 61.69 58.40 1i01 s THR 35 Cb -0.13 -2.40 -0.02 0.00 1.34 0.00 0.00 72.50 71.29 1i01 s THR 35 CO 0.19 -0.37 0.19 0.00 -0.54 0.00 0.00 174.62 174.09 1i01 s ALA 36 N -2.50 0.29 -1.55 3.99 0.00 -1.05 -1.76 121.76 119.18 1i01 s ALA 36 Ca 0.31 -1.07 0.04 0.00 0.00 0.00 0.00 51.96 51.23 1i01 s ALA 36 Cb -0.04 0.81 0.16 0.00 0.00 0.00 0.00 23.12 24.05 1i01 s ALA 36 CO 0.16 -0.57 0.99 0.25 0.00 0.00 0.00 175.76 176.58 1i01 n THR 37 N -0.15 0.37 -3.58 0.00 -2.24 -1.26 -1.30 114.28 106.12 1i01 n THR 37 Ca -0.08 -0.26 -0.11 0.00 -2.27 0.00 0.00 64.05 61.34 1i01 n THR 37 Cb 0.63 -0.11 -0.04 0.00 -2.10 0.00 0.00 70.33 68.72 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 -0.68 -0.34 0.34 3.42 1.04 -1.26 -4.86 113.70 111.36 1i01 s SER 38 Ca 0.11 -0.24 0.09 0.00 0.48 0.00 0.00 55.95 56.39 1i01 s SER 38 Cb 0.07 0.52 0.61 0.00 0.10 0.00 0.00 66.02 67.32 1i01 s SER 38 CO 0.06 -0.91 1.79 -0.33 0.98 0.00 0.00 173.24 174.83 1i01 h GLU 39 N 2.24 0.19 -0.32 4.02 3.07 -1.95 -1.73 114.58 120.09 1i01 h GLU 39 Ca -0.33 -0.07 -0.05 0.00 -0.50 0.00 0.00 59.36 58.41 1i01 h GLU 39 Cb 1.27 -0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 29.16 1i01 h GLU 39 CO 0.43 0.49 0.02 -0.97 -1.40 0.00 0.00 179.01 177.58 1i01 h ASN 40 N 0.17 0.54 -0.48 1.42 -0.73 -1.98 -1.29 115.58 113.24 1i01 h ASN 40 Ca 0.02 -0.29 -0.07 0.00 1.87 0.00 0.00 56.30 57.84 1i01 h ASN 40 Cb 0.64 -0.15 -0.02 0.00 0.27 0.00 0.00 38.32 39.06 1i01 h ASN 40 CO 0.05 0.70 0.07 1.23 -0.37 0.00 0.00 177.43 179.11 1i01 h GLY 41 N 0.37 0.93 1.00 1.57 0.00 -1.89 -2.90 103.07 102.14 1i01 h GLY 41 Ca 0.09 -0.59 -0.01 0.00 0.00 0.00 0.00 47.33 46.83 1i01 h GLY 41 CO 0.01 0.55 0.35 0.00 0.00 0.00 0.00 176.54 177.45 1i01 h ALA 42 N 1.26 0.77 -0.60 3.60 0.00 -1.07 -2.48 119.26 120.74 1i01 h ALA 42 Ca 0.17 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1i01 h ALA 42 Cb 0.39 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 1i01 h ALA 42 CO 0.01 0.27 0.31 0.37 0.00 0.00 0.00 179.25 180.21 1i01 h GLN 43 N 0.82 0.85 -0.98 0.00 5.75 -1.05 -1.13 115.11 119.37 1i01 h GLN 43 Ca 0.22 -0.11 0.07 0.00 -0.15 0.00 0.00 58.65 58.67 1i01 h GLN 43 Cb 0.01 -0.16 -0.07 0.00 1.07 0.00 0.00 27.48 28.33 1i01 h GLN 43 CO -0.04 0.66 0.63 0.00 -2.65 0.00 0.00 178.83 177.43 1i01 h ALA 44 N 1.14 1.37 -0.48 3.38 0.00 -1.32 0.27 119.26 123.62 1i01 h ALA 44 Ca 0.21 -0.02 -0.07 0.00 0.00 0.00 0.00 54.91 55.03 1i01 h ALA 44 Cb 0.07 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 1i01 h ALA 44 CO -0.03 0.41 0.04 0.82 0.00 0.00 0.00 179.25 180.49 1i01 h ILE 45 N 1.14 1.26 -0.72 0.00 2.04 -0.98 -2.69 117.51 117.56 1i01 h ILE 45 Ca 0.43 -0.99 0.02 0.00 1.00 0.00 0.00 64.86 65.31 1i01 h ILE 45 Cb 0.18 0.96 -0.04 0.00 -0.74 0.00 0.00 36.82 37.18 1i01 h ILE 45 CO -0.18 0.35 0.47 0.28 0.00 0.00 0.00 178.15 179.07 1i01 h SER 46 N 0.68 0.79 -0.97 1.72 0.02 0.08 -1.21 113.55 114.66 1i01 h SER 46 Ca 0.14 -0.01 0.00 0.00 -0.84 0.00 0.00 61.79 61.08 1i01 h SER 46 Cb 0.45 -0.19 -0.05 0.00 0.14 0.00 0.00 62.40 62.75 1i01 h SER 46 CO 0.02 0.56 0.62 0.44 -1.14 0.00 0.00 176.83 177.33 1i01 h ASP 47 N 0.93 1.13 1.49 3.07 3.32 -0.79 -0.47 116.42 125.11 1i01 h ASP 47 Ca 0.27 -0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.26 1i01 h ASP 47 Cb -0.06 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.21 1i01 h ASP 47 CO -0.08 0.84 -0.51 0.10 -1.72 0.00 0.00 179.24 177.86 1i01 h TYR 48 N 1.32 0.00 0.00 4.55 -0.00 -1.15 -3.31 116.97 118.38 1i01 h TYR 48 Ca 0.35 0.00 -0.21 0.00 0.00 0.00 0.00 58.73 58.87 1i01 h TYR 48 Cb -0.12 0.00 -0.03 0.00 0.00 0.00 0.00 36.73 36.58 1i01 h TYR 48 CO 0.00 0.10 -1.08 -0.07 -0.00 0.00 0.00 178.16 177.11 1i01 h LEU 49 N 0.00 0.00 0.00 0.10 3.38 -0.96 -3.49 115.31 114.34 1i01 h LEU 49 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1i01 h LEU 49 Cb 1.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.83 1i01 h LEU 49 CO 0.01 0.93 0.00 0.61 0.09 0.00 0.00 178.44 180.08 1i01 n GLY 50 N 1.37 2.87 0.00 0.83 0.00 -0.21 -1.31 105.19 108.75 1i01 n GLY 50 Ca -0.03 -0.17 0.05 0.00 0.00 0.00 0.00 46.02 45.87 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 9.09 2.04 0.40 4.61 0.00 -1.26 -2.74 120.51 132.66 1i01 n ALA 51 Ca 0.00 -0.07 0.09 0.00 0.00 0.00 0.00 53.44 53.46 1i01 n ALA 51 Cb 0.00 -1.18 0.13 0.00 0.00 0.00 0.00 19.45 18.40 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 -0.85 2.80 0.00 0.00 3.02 -0.43 -5.06 115.26 114.74 1i01 n ASN 52 Ca 0.08 -1.82 0.00 0.00 -0.03 0.00 0.00 54.58 52.81 1i01 n ASN 52 Cb 0.04 -0.12 0.00 0.00 -0.61 0.00 0.00 39.78 39.09 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 -0.63 3.49 7.41 0.00 -1.11 -1.15 105.19 114.24 1i01 n GLY 53 Ca 0.13 -0.59 -0.12 0.00 0.00 0.00 0.00 46.02 45.44 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 -0.75 1.00 -0.10 1.61 2.20 -0.37 -4.61 119.74 118.72 1i01 s LYS 54 Ca 0.00 -0.15 -0.02 0.00 -0.36 0.00 0.00 55.97 55.44 1i01 s LYS 54 Cb 0.00 0.47 -0.03 0.00 -1.51 0.00 0.00 37.83 36.75 1i01 s LYS 54 CO 0.00 -0.39 -0.02 0.20 -0.36 0.00 0.00 175.35 174.78 1i01 s GLY 55 N -2.04 1.79 0.10 5.54 0.00 -1.25 -1.68 107.32 109.78 1i01 s GLY 55 Ca -0.01 -0.82 0.05 0.00 0.00 0.00 0.00 44.72 43.93 1i01 s GLY 55 CO -0.04 -0.44 -0.13 1.08 0.00 0.00 0.00 173.10 173.57 1i01 s LEU 56 N -0.51 2.37 -0.16 0.66 1.43 -0.40 -4.69 118.68 117.38 1i01 s LEU 56 Ca 0.08 -0.76 -0.27 0.00 -1.03 0.00 0.00 54.13 52.16 1i01 s LEU 56 Cb -0.12 -0.46 -0.01 0.00 0.03 0.00 0.00 46.19 45.62 1i01 s LEU 56 CO 0.02 -0.16 0.89 -0.32 0.23 0.00 0.00 176.35 177.01 1i01 s MET 57 N -2.47 4.32 -0.07 1.70 -2.45 -1.26 -2.52 119.30 116.55 1i01 s MET 57 Ca 0.05 1.13 0.00 0.00 -1.25 0.00 0.00 55.69 55.63 1i01 s MET 57 Cb -0.06 -3.57 0.02 0.00 1.25 0.00 0.00 34.83 32.47 1i01 s MET 57 CO 0.02 -0.36 -0.05 -1.17 1.05 0.00 0.00 175.02 174.51 1i01 s LEU 58 N 2.23 1.17 -0.85 4.11 2.96 -0.42 -4.82 118.68 123.06 1i01 s LEU 58 Ca 0.41 -0.17 -0.08 0.00 -0.22 0.00 0.00 54.13 54.07 1i01 s LEU 58 Cb -0.17 -0.57 0.22 0.00 0.50 0.00 0.00 46.19 46.17 1i01 s LEU 58 CO 0.13 -0.09 0.77 0.21 -1.32 0.00 0.00 176.35 176.05 1i01 s ASN 59 N 1.27 6.37 0.00 3.68 3.84 -1.26 -4.31 114.94 124.53 1i01 s ASN 59 Ca -0.05 -3.13 0.00 0.00 0.21 0.00 0.00 52.86 49.89 1i01 s ASN 59 Cb -0.14 -2.07 0.00 0.00 -0.55 0.00 0.00 41.25 38.50 1i01 s ASN 59 CO -0.02 -0.39 0.41 1.33 -2.79 0.00 0.00 177.10 175.64 1i01 n VAL 60 N 3.25 0.23 0.55 -5.21 0.24 -1.26 -0.18 118.33 115.96 1i01 n VAL 60 Ca 0.16 0.09 0.11 0.00 -2.04 0.00 0.00 64.34 62.66 1i01 n VAL 60 Cb 0.41 -1.09 -0.12 0.00 -1.47 0.00 0.00 33.84 31.58 1i01 n VAL 60 CO 0.00 0.00 0.00 0.41 -2.14 0.00 0.00 176.83 175.10 1i01 n THR 61 N -0.91 0.03 -3.88 3.34 -1.04 -1.26 -4.60 114.28 105.95 1i01 n THR 61 Ca 0.00 -0.23 -0.35 0.00 -2.04 0.00 0.00 64.05 61.43 1i01 n THR 61 Cb 0.03 0.50 -0.13 0.00 -1.82 0.00 0.00 70.33 68.90 1i01 n THR 61 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1i01 s ASP 62 N -3.72 4.60 0.45 8.00 2.15 0.75 -4.98 116.67 123.93 1i01 s ASP 62 Ca 0.01 -0.32 0.15 0.00 0.43 0.00 0.00 52.55 52.83 1i01 s ASP 62 Cb 0.15 -1.80 1.09 0.00 -0.30 0.00 0.00 42.92 42.06 1i01 s ASP 62 CO 0.87 -0.02 2.00 -0.65 -0.17 0.00 0.00 175.17 177.21 1i01 h PRO 63 N 8.08 0.32 -0.08 4.34 0.11 -1.90 -0.77 132.00 142.10 1i01 h PRO 63 Ca -0.40 -0.02 -0.15 0.00 0.11 0.00 0.00 66.00 65.54 1i01 h PRO 63 Cb 1.17 -0.07 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 1i01 h PRO 63 CO 0.60 0.21 -0.62 0.00 -0.21 0.00 0.00 178.00 177.98 1i01 h ALA 64 N 1.73 0.80 -0.28 -0.75 0.00 -1.93 -1.76 119.26 117.08 1i01 h ALA 64 Ca 0.24 -0.55 -0.14 0.00 0.00 0.00 0.00 54.91 54.46 1i01 h ALA 64 Cb 0.50 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 1i01 h ALA 64 CO -0.06 0.73 -0.37 1.03 0.00 0.00 0.00 179.25 180.59 1i01 h SER 65 N 0.21 0.81 0.22 0.00 0.87 -1.45 -1.07 113.55 113.13 1i01 h SER 65 Ca -0.01 -0.50 -0.01 0.00 -1.23 0.00 0.00 61.79 60.04 1i01 h SER 65 Cb 1.13 -0.23 0.00 0.00 -0.44 0.00 0.00 62.40 62.86 1i01 h SER 65 CO 0.10 1.15 -0.12 0.40 -0.53 0.00 0.00 176.83 177.83 1i01 h ILE 66 N 0.49 0.76 -0.91 2.23 2.04 -1.22 -0.08 117.51 120.83 1i01 h ILE 66 Ca 0.03 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.90 1i01 h ILE 66 Cb 0.96 0.76 -0.05 0.00 -0.74 0.00 0.00 36.82 37.75 1i01 h ILE 66 CO 0.09 0.00 0.60 -0.33 0.00 0.00 0.00 178.15 178.51 1i01 h GLU 67 N -0.31 1.19 -0.10 2.37 4.39 -1.34 -1.09 114.58 119.70 1i01 h GLU 67 Ca -0.03 -0.07 -0.00 0.00 0.34 0.00 0.00 59.36 59.60 1i01 h GLU 67 Cb 0.25 -0.27 -0.00 0.00 -0.10 0.00 0.00 28.75 28.62 1i01 h GLU 67 CO 0.04 0.79 0.04 1.03 -1.16 0.00 0.00 179.01 179.76 1i01 h SER 68 N 1.23 0.13 -0.33 1.42 0.87 -0.84 -1.23 113.55 114.81 1i01 h SER 68 Ca 0.33 -0.14 -0.02 0.00 -1.23 0.00 0.00 61.79 60.74 1i01 h SER 68 Cb -0.14 -0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 61.78 1i01 h SER 68 CO -0.07 0.23 0.14 0.58 -0.53 0.00 0.00 176.83 177.18 1i01 h VAL 69 N 0.02 1.17 -0.11 2.23 2.07 -0.74 -1.90 116.25 118.99 1i01 h VAL 69 Ca 0.03 -0.51 -0.02 0.00 0.82 0.00 0.00 66.70 67.03 1i01 h VAL 69 Cb 0.14 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 30.80 1i01 h VAL 69 CO -0.00 0.18 -0.04 -0.07 0.02 0.00 0.00 177.57 177.66 1i01 h LEU 70 N 0.38 0.14 -0.27 2.57 3.38 -1.13 -1.22 115.31 119.16 1i01 h LEU 70 Ca 0.11 -0.01 -0.13 0.00 0.09 0.00 0.00 57.88 57.94 1i01 h LEU 70 Cb 0.15 -0.03 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 1i01 h LEU 70 CO -0.01 0.20 -0.33 -0.08 0.09 0.00 0.00 178.44 178.31 1i01 h GLU 71 N 0.15 0.71 -0.63 1.13 4.57 -0.86 -2.11 114.58 117.55 1i01 h GLU 71 Ca 0.04 -0.40 -0.02 0.00 -1.18 0.00 0.00 59.36 57.80 1i01 h GLU 71 Cb 0.17 0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 28.76 1i01 h GLU 71 CO 0.01 1.02 0.32 0.87 -1.18 0.00 0.00 179.01 180.05 1i01 h LYS 72 N 0.45 0.89 -0.63 1.92 1.57 -0.66 -1.87 116.57 118.24 1i01 h LYS 72 Ca 0.04 -0.12 -0.04 0.00 -1.87 0.00 0.00 60.65 58.66 1i01 h LYS 72 Cb 0.92 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 33.03 1i01 h LYS 72 CO 0.08 0.70 0.23 0.82 -0.57 0.00 0.00 179.45 180.71 1i01 h ILE 73 N 0.86 1.22 -0.33 1.86 2.04 -1.20 -1.99 117.51 119.97 1i01 h ILE 73 Ca 0.22 -0.72 -0.04 0.00 1.00 0.00 0.00 64.86 65.32 1i01 h ILE 73 Cb 0.08 0.49 -0.01 0.00 -0.74 0.00 0.00 36.82 36.64 1i01 h ILE 73 CO -0.03 0.29 0.06 0.03 0.00 0.00 0.00 178.15 178.49 1i01 h ARG 74 N 0.90 0.55 -0.30 2.37 3.08 -0.98 0.40 114.38 120.40 1i01 h ARG 74 Ca 0.21 -0.15 0.01 0.00 0.07 0.00 0.00 59.98 60.13 1i01 h ARG 74 Cb 0.20 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.16 1i01 h ARG 74 CO -0.02 0.63 0.17 0.00 -1.07 0.00 0.00 179.97 179.68 1i01 h ALA 75 N 0.90 0.37 0.01 0.04 0.00 -1.10 -3.18 119.26 116.31 1i01 h ALA 75 Ca 0.10 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1i01 h ALA 75 Cb 0.34 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1i01 h ALA 75 CO 0.01 -0.20 -0.01 0.93 0.00 0.00 0.00 179.25 179.97 1i01 h GLU 76 N 0.35 -0.02 0.00 0.00 5.08 -1.27 -3.45 114.58 115.28 1i01 h GLU 76 Ca 0.12 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.29 1i01 h GLU 76 Cb 0.01 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.23 1i01 h GLU 76 CO -0.07 0.52 -1.71 1.19 -1.00 0.00 0.00 179.01 177.95 1i01 n PHE 77 N -4.70 0.00 0.00 4.33 3.01 0.13 -5.10 117.46 115.12 1i01 n PHE 77 Ca -0.06 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.40 1i01 n PHE 77 Cb 0.26 -0.47 0.00 0.00 -0.01 0.00 0.00 39.48 39.26 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 2.70 0.82 3.82 1.37 0.00 -0.23 -4.98 105.19 108.69 1i01 n GLY 78 Ca -0.23 -1.73 -0.34 0.00 0.00 0.00 0.00 46.02 43.72 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 -1.94 4.21 -0.05 1.61 0.41 -1.26 -3.33 118.70 118.36 1i01 s GLU 79 Ca 0.00 0.93 -0.30 0.00 -0.41 0.00 0.00 54.97 55.19 1i01 s GLU 79 Cb 0.00 -2.55 -0.03 0.00 -1.78 0.00 0.00 34.13 29.77 1i01 s GLU 79 CO 0.00 0.19 1.15 0.08 -0.49 0.00 0.00 175.26 176.19 1i01 s VAL 80 N -1.85 4.38 -0.19 2.63 1.01 -1.26 -4.58 120.40 120.53 1i01 s VAL 80 Ca 0.52 1.69 0.18 0.00 0.00 0.00 0.00 61.98 64.37 1i01 s VAL 80 Cb -0.13 -4.09 -0.25 0.00 0.00 0.00 0.00 36.38 31.92 1i01 s VAL 80 CO 0.18 0.02 0.08 0.47 0.00 0.00 0.00 175.10 175.86 1i01 n ASP 81 N 4.92 0.16 -3.96 3.32 8.00 -0.05 -4.65 116.55 124.29 1i01 n ASP 81 Ca 0.10 0.00 -0.26 0.00 0.71 0.00 0.00 54.79 55.34 1i01 n ASP 81 Cb 0.47 1.02 -0.17 0.00 -0.02 0.00 0.00 41.12 42.42 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 -2.51 1.12 -0.17 0.53 1.01 -0.60 -1.70 121.20 118.88 1i01 s ILE 82 Ca -0.10 -0.39 -0.00 0.00 0.00 0.00 0.00 60.65 60.16 1i01 s ILE 82 Cb 0.06 -1.09 -0.00 0.00 0.01 0.00 0.00 42.46 41.44 1i01 s ILE 82 CO 0.81 0.37 -0.13 -0.22 0.00 0.00 0.00 174.94 175.77 1i01 s LEU 83 N 1.33 2.54 -0.23 2.97 2.96 0.02 -0.34 118.68 127.94 1i01 s LEU 83 Ca -0.02 -0.46 0.02 0.00 -0.22 0.00 0.00 54.13 53.45 1i01 s LEU 83 Cb -0.14 -1.59 0.05 0.00 0.50 0.00 0.00 46.19 45.01 1i01 s LEU 83 CO -0.04 0.07 -0.14 -0.69 -1.32 0.00 0.00 176.35 174.23 1i01 s VAL 84 N 0.94 2.05 -0.39 1.68 1.01 -0.14 -0.45 120.40 125.10 1i01 s VAL 84 Ca -0.03 -1.33 -0.19 0.00 0.00 0.00 0.00 61.98 60.44 1i01 s VAL 84 Cb -0.15 -2.06 0.01 0.00 0.00 0.00 0.00 36.38 34.18 1i01 s VAL 84 CO -0.02 0.17 0.54 0.20 0.00 0.00 0.00 175.10 176.00 1i01 s ASN 85 N 1.21 6.30 0.63 3.32 0.01 0.26 -1.92 114.94 124.75 1i01 s ASN 85 Ca -0.04 -0.23 -0.02 0.00 -0.71 0.00 0.00 52.86 51.87 1i01 s ASN 85 Cb -0.17 -2.28 0.07 0.00 0.41 0.00 0.00 41.25 39.28 1i01 s ASN 85 CO -0.08 -0.59 0.48 -3.20 -1.51 0.00 0.00 177.10 172.19 1i01 n ASN 86 N 5.89 0.50 -3.71 -1.22 5.15 -1.24 -0.39 115.26 120.24 1i01 n ASN 86 Ca -0.04 -1.45 -0.09 0.00 -0.60 0.00 0.00 54.58 52.40 1i01 n ASN 86 Cb 0.48 -0.32 -0.02 0.00 -0.53 0.00 0.00 39.78 39.39 1i01 n ASN 86 CO 0.00 0.00 0.00 1.51 1.40 0.00 0.00 177.26 180.17 1i01 s ASP 92 N -2.89 -0.37 -0.06 1.20 1.47 -1.26 -4.79 116.67 109.97 1i01 s ASP 92 Ca 0.30 -0.40 -0.32 0.00 1.18 0.00 0.00 52.55 53.32 1i01 s ASP 92 Cb -0.02 0.68 0.12 0.00 -0.34 0.00 0.00 42.92 43.37 1i01 s ASP 92 CO 0.20 -1.21 1.23 0.21 0.68 0.00 0.00 175.17 176.28 1i01 s ASN 93 N -2.86 -0.10 0.27 2.11 2.47 -1.26 -5.09 114.94 110.48 1i01 s ASN 93 Ca 0.08 -0.10 -0.29 0.00 0.42 0.00 0.00 52.86 52.96 1i01 s ASN 93 Cb -0.04 0.18 -0.09 0.00 -1.45 0.00 0.00 41.25 39.85 1i01 s ASN 93 CO 0.00 -0.33 1.21 -0.76 -3.72 0.00 0.00 177.10 173.50 1i01 s LEU 94 N -2.70 4.48 0.13 3.21 1.43 -1.26 -4.00 118.68 119.96 1i01 s LEU 94 Ca 0.12 2.40 -0.30 0.00 -1.03 0.00 0.00 54.13 55.32 1i01 s LEU 94 Cb 0.02 -3.63 -0.07 0.00 0.03 0.00 0.00 46.19 42.55 1i01 s LEU 94 CO -0.04 -0.35 1.58 -0.07 0.23 0.00 0.00 176.35 177.70 1i01 h LEU 95 N 4.17 -1.33 0.00 1.79 3.38 -1.98 -1.21 115.31 120.13 1i01 h LEU 95 Ca -0.47 0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.67 1i01 h LEU 95 Cb 1.22 0.53 0.00 0.00 0.09 0.00 0.00 40.66 42.50 1i01 h LEU 95 CO 0.69 -0.44 0.00 0.23 0.09 0.00 0.00 178.44 179.01 1i01 n MET 96 N -5.44 0.48 -0.00 1.13 2.81 -1.26 -1.40 117.12 113.44 1i01 n MET 96 Ca -0.05 0.00 0.04 0.00 -1.81 0.00 0.00 57.70 55.88 1i01 n MET 96 Cb 0.37 -1.16 0.03 0.00 -0.71 0.00 0.00 33.22 31.75 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 -0.66 0.07 -2.46 0.03 1.74 -0.47 -5.02 116.66 109.89 1i01 n ARG 97 Ca 0.04 -0.96 -0.32 0.00 -0.77 0.00 0.00 57.85 55.84 1i01 n ARG 97 Cb 0.02 -1.15 -0.04 0.00 -1.02 0.00 0.00 32.46 30.27 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 -0.64 3.96 0.14 5.56 -1.94 -0.49 -4.95 119.30 120.94 1i01 s MET 98 Ca 0.09 1.01 0.05 0.00 -1.71 0.00 0.00 55.69 55.13 1i01 s MET 98 Cb 0.06 -2.14 -0.04 0.00 2.01 0.00 0.00 34.83 34.73 1i01 s MET 98 CO 0.10 -0.26 0.07 0.15 -0.01 0.00 0.00 175.02 175.06 1i01 s LYS 99 N -3.88 2.71 0.30 2.03 1.02 -1.26 -4.98 119.74 115.67 1i01 s LYS 99 Ca 0.60 -0.89 0.02 0.00 0.02 0.00 0.00 55.97 55.72 1i01 s LYS 99 Cb -0.10 -2.57 0.74 0.00 -0.52 0.00 0.00 37.83 35.38 1i01 s LYS 99 CO 0.28 0.50 1.60 -0.44 -0.92 0.00 0.00 175.35 176.37 1i01 h ASP 100 N 2.83 -0.29 -0.61 2.83 3.32 -1.99 0.94 116.42 123.45 1i01 h ASP 100 Ca -0.47 0.25 0.07 0.00 0.02 0.00 0.00 57.03 56.90 1i01 h ASP 100 Cb 1.19 0.40 -0.06 0.00 0.22 0.00 0.00 39.33 41.08 1i01 h ASP 100 CO 0.62 -0.29 0.28 -0.08 -1.72 0.00 0.00 179.24 178.05 1i01 h GLU 101 N 0.07 0.50 0.00 3.56 4.22 -1.99 0.06 114.58 120.99 1i01 h GLU 101 Ca 0.58 -0.03 -0.11 0.00 0.08 0.00 0.00 59.36 59.88 1i01 h GLU 101 Cb 1.21 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 30.33 1i01 h GLU 101 CO -0.81 0.33 -0.55 1.49 -2.18 0.00 0.00 179.01 177.29 1i01 h GLU 102 N 0.51 0.00 -0.30 1.92 4.57 -1.23 -2.26 114.58 117.80 1i01 h GLU 102 Ca 0.29 0.00 -0.16 0.00 -1.18 0.00 0.00 59.36 58.31 1i01 h GLU 102 Cb 0.28 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 28.86 1i01 h GLU 102 CO -0.24 0.55 -0.44 2.35 -1.18 0.00 0.00 179.01 180.05 1i01 h TRP 103 N 0.00 0.93 -0.50 0.92 2.91 -0.71 -2.70 115.95 116.80 1i01 h TRP 103 Ca -0.01 -0.29 -0.12 0.00 1.13 0.00 0.00 58.89 59.61 1i01 h TRP 103 Cb 1.15 -0.19 -0.02 0.00 -0.51 0.00 0.00 29.16 29.60 1i01 h TRP 103 CO 0.00 1.07 -0.15 -0.91 -1.03 0.00 0.00 178.44 177.42 1i01 h ASN 104 N 0.61 0.96 -0.60 2.65 2.35 -0.88 -2.29 115.58 118.39 1i01 h ASN 104 Ca 0.04 -0.33 -0.03 0.00 -0.55 0.00 0.00 56.30 55.42 1i01 h ASN 104 Cb 1.01 -0.26 -0.03 0.00 0.05 0.00 0.00 38.32 39.08 1i01 h ASN 104 CO 0.10 1.10 0.26 0.44 -1.65 0.00 0.00 177.43 177.67 1i01 h ASP 105 N 0.84 0.85 -0.14 5.81 3.32 -1.33 -0.64 116.42 125.13 1i01 h ASP 105 Ca 0.13 -0.11 -0.11 0.00 0.02 0.00 0.00 57.03 56.95 1i01 h ASP 105 Cb 0.70 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 40.04 1i01 h ASP 105 CO 0.05 0.76 -0.35 0.40 -1.72 0.00 0.00 179.24 178.38 1i01 h ILE 106 N 0.91 1.36 0.05 0.35 2.04 -1.32 -0.71 117.51 120.20 1i01 h ILE 106 Ca 0.22 -1.64 -0.00 0.00 1.00 0.00 0.00 64.86 64.44 1i01 h ILE 106 Cb 0.17 2.04 0.00 0.00 -0.74 0.00 0.00 36.82 38.30 1i01 h ILE 106 CO -0.02 0.49 -0.02 0.40 0.00 0.00 0.00 178.15 179.00 1i01 h ILE 107 N 0.10 1.05 -0.03 -0.67 1.08 -1.30 -0.20 117.51 117.53 1i01 h ILE 107 Ca -0.00 -0.32 -0.03 0.00 -0.39 0.00 0.00 64.86 64.11 1i01 h ILE 107 Cb 0.96 1.27 -0.01 0.00 -3.07 0.00 0.00 36.82 35.97 1i01 h ILE 107 CO 0.08 0.08 -0.14 -0.08 -0.69 0.00 0.00 178.15 177.40 1i01 h GLU 108 N -0.20 0.05 0.02 2.37 4.22 -1.15 0.71 114.58 120.59 1i01 h GLU 108 Ca -0.01 -0.01 -0.32 0.00 0.08 0.00 0.00 59.36 59.11 1i01 h GLU 108 Cb 0.18 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.37 1i01 h GLU 108 CO 0.01 0.20 -1.89 2.41 -2.18 0.00 0.00 179.01 177.56 1i01 n THR 109 N -4.34 1.59 0.44 0.32 -1.04 -0.27 -3.06 114.28 107.91 1i01 n THR 109 Ca -0.02 -0.78 0.07 0.00 -2.04 0.00 0.00 64.05 61.28 1i01 n THR 109 Cb 0.23 -1.04 -0.09 0.00 -1.82 0.00 0.00 70.33 67.61 1i01 n THR 109 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1i01 n ASN 110 N -3.06 1.00 0.02 8.00 5.03 -0.10 -4.58 115.26 121.58 1i01 n ASN 110 Ca -0.23 -0.56 -0.00 0.00 0.87 0.00 0.00 54.58 54.66 1i01 n ASN 110 Cb 1.07 1.22 -0.00 0.00 -1.02 0.00 0.00 39.78 41.05 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 -1.55 0.70 -0.10 3.41 7.94 0.16 -4.68 117.00 122.87 1i01 n LEU 111 Ca 0.01 0.09 0.07 0.00 -1.11 0.00 0.00 56.01 55.07 1i01 n LEU 111 Cb 0.27 -0.23 0.42 0.00 0.53 0.00 0.00 43.42 44.40 1i01 n LEU 111 CO 0.29 -0.63 1.19 0.28 -1.11 0.00 0.00 177.39 177.41 1i01 h SER 112 N -0.04 0.52 -0.56 1.96 0.02 -1.49 -2.34 113.55 111.62 1i01 h SER 112 Ca 0.00 -0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.90 1i01 h SER 112 Cb 0.04 -0.11 -0.03 0.00 0.14 0.00 0.00 62.40 62.44 1i01 h SER 112 CO 0.00 0.34 0.17 0.77 -1.14 0.00 0.00 176.83 176.97 1i01 h SER 113 N 0.59 0.86 -0.28 3.07 4.64 -1.79 -0.73 113.55 119.92 1i01 h SER 113 Ca 0.25 -0.15 -0.07 0.00 -0.47 0.00 0.00 61.79 61.35 1i01 h SER 113 Cb 0.25 -0.23 -0.02 0.00 -0.31 0.00 0.00 62.40 62.09 1i01 h SER 113 CO -0.07 0.83 -0.05 0.58 -0.87 0.00 0.00 176.83 177.24 1i01 h VAL 114 N 0.89 1.23 -0.40 0.95 2.07 -1.70 -0.50 116.25 118.80 1i01 h VAL 114 Ca 0.20 -0.99 -0.06 0.00 0.82 0.00 0.00 66.70 66.67 1i01 h VAL 114 Cb 0.29 0.99 -0.01 0.00 -1.52 0.00 0.00 31.29 31.04 1i01 h VAL 114 CO -0.00 0.34 0.02 0.15 0.02 0.00 0.00 177.57 178.09 1i01 h PHE 115 N 0.61 0.75 -0.45 1.57 3.57 -1.23 -1.11 116.94 120.65 1i01 h PHE 115 Ca 0.12 -0.12 -0.14 0.00 3.53 0.00 0.00 57.97 61.35 1i01 h PHE 115 Cb 0.46 -0.20 -0.01 0.00 2.79 0.00 0.00 35.95 38.99 1i01 h PHE 115 CO 0.02 0.76 -0.27 0.00 -2.23 0.00 0.00 178.31 176.59 1i01 h ARG 116 N 0.52 0.96 -0.22 1.11 3.08 -0.78 -2.20 114.38 116.85 1i01 h ARG 116 Ca 0.11 -0.43 -0.12 0.00 0.07 0.00 0.00 59.98 59.61 1i01 h ARG 116 Cb 0.45 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.48 1i01 h ARG 116 CO 0.02 1.10 -0.31 -0.07 -1.07 0.00 0.00 179.97 179.63 1i01 h LEU 117 N 0.81 0.66 -1.03 3.04 3.38 -1.07 -2.09 115.31 119.02 1i01 h LEU 117 Ca 0.09 -0.51 -0.01 0.00 0.09 0.00 0.00 57.88 57.54 1i01 h LEU 117 Cb 0.85 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 41.37 1i01 h LEU 117 CO 0.07 1.04 0.47 0.28 0.09 0.00 0.00 178.44 180.40 1i01 h SER 118 N 0.30 1.02 -0.62 -0.43 0.02 -1.22 -2.23 113.55 110.40 1i01 h SER 118 Ca 0.02 -0.08 -0.10 0.00 -0.84 0.00 0.00 61.79 60.80 1i01 h SER 118 Cb 0.89 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 63.15 1i01 h SER 118 CO 0.07 0.81 0.01 0.50 -1.14 0.00 0.00 176.83 177.08 1i01 h LYS 119 N 1.16 1.08 0.00 3.45 3.64 -1.34 -2.11 116.57 122.46 1i01 h LYS 119 Ca 0.30 -0.34 -0.07 0.00 -1.27 0.00 0.00 60.65 59.27 1i01 h LYS 119 Cb 0.00 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 31.71 1i01 h LYS 119 CO -0.05 1.05 -0.31 0.00 -2.27 0.00 0.00 179.45 177.86 1i01 h ALA 120 N 1.00 1.31 0.00 5.00 0.00 -0.81 -3.27 119.26 122.50 1i01 h ALA 120 Ca 0.18 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1i01 h ALA 120 Cb 0.55 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1i01 h ALA 120 CO 0.03 0.39 -0.80 1.33 0.00 0.00 0.00 179.25 180.21 1i01 n VAL 121 N -3.91 0.00 0.01 0.00 0.24 -0.93 -4.69 118.33 109.05 1i01 n VAL 121 Ca -0.02 -0.11 -0.13 0.00 -2.04 0.00 0.00 64.34 62.05 1i01 n VAL 121 Cb 0.38 0.99 -0.09 0.00 -1.47 0.00 0.00 33.84 33.66 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 -0.00 -0.84 7.34 2.07 -1.43 -3.00 114.93 119.08 1i01 h MET 122 Ca 0.00 0.00 0.21 0.00 -2.07 0.00 0.00 59.70 57.84 1i01 h MET 122 Cb 0.40 0.00 -0.13 0.00 -1.87 0.00 0.00 31.60 30.00 1i01 h MET 122 CO 0.00 0.26 0.25 -0.09 1.07 0.00 0.00 176.91 178.39 1i01 h ARG 123 N -0.26 0.26 -0.10 1.72 2.43 -1.84 0.16 114.38 116.75 1i01 h ARG 123 Ca -0.00 -0.02 -0.03 0.00 -0.81 0.00 0.00 59.98 59.12 1i01 h ARG 123 Cb 0.26 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 29.75 1i01 h ARG 123 CO 0.00 0.17 -0.06 0.00 -1.51 0.00 0.00 179.97 178.57 1i01 h ALA 124 N 1.71 0.14 -0.46 2.80 0.00 -1.88 -2.11 119.26 119.47 1i01 h ALA 124 Ca 0.51 -0.26 0.08 0.00 0.00 0.00 0.00 54.91 55.24 1i01 h ALA 124 Cb 0.97 -0.03 -0.07 0.00 0.00 0.00 0.00 17.79 18.66 1i01 h ALA 124 CO -0.59 -0.07 0.04 0.52 0.00 0.00 0.00 179.25 179.16 1i01 h MET 125 N -0.16 0.16 -0.62 0.00 2.86 -1.10 -0.83 114.93 115.23 1i01 h MET 125 Ca 0.02 -0.01 -0.09 0.00 -2.06 0.00 0.00 59.70 57.56 1i01 h MET 125 Cb 0.54 -0.04 -0.02 0.00 0.06 0.00 0.00 31.60 32.14 1i01 h MET 125 CO 0.02 0.11 0.03 0.52 1.06 0.00 0.00 176.91 178.64 1i01 h MET 126 N 0.17 1.07 -0.80 1.72 2.07 -0.73 0.31 114.93 118.73 1i01 h MET 126 Ca 0.23 -0.32 -0.05 0.00 -2.07 0.00 0.00 59.70 57.49 1i01 h MET 126 Cb 0.32 -0.11 -0.04 0.00 -1.87 0.00 0.00 31.60 29.91 1i01 h MET 126 CO -0.34 1.03 0.32 -0.22 1.07 0.00 0.00 176.91 178.77 1i01 h LYS 127 N 0.98 1.20 0.00 1.72 3.64 -1.01 -1.55 116.57 121.56 1i01 h LYS 127 Ca 0.18 -0.22 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1i01 h LYS 127 Cb 0.53 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.15 1i01 h LYS 127 CO 0.03 0.97 0.00 0.87 -2.27 0.00 0.00 179.45 179.05 1i01 h LYS 128 N 1.17 0.00 -3.21 1.90 1.57 -0.62 -3.47 116.57 113.91 1i01 h LYS 128 Ca 0.27 0.00 -0.34 0.00 -1.87 0.00 0.00 60.65 58.70 1i01 h LYS 128 Cb 0.22 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.55 1i01 h LYS 128 CO -0.02 0.00 -0.48 -2.13 -0.57 0.00 0.00 179.45 176.25 1i01 n ARG 129 N -2.40 -2.89 -3.64 3.15 0.63 0.10 -4.99 116.66 106.63 1i01 n ARG 129 Ca 0.04 0.80 -0.09 0.00 -0.92 0.00 0.00 57.85 57.68 1i01 n ARG 129 Cb 0.34 -5.31 -0.07 0.00 0.45 0.00 0.00 32.46 27.87 1i01 n ARG 129 CO 0.00 0.00 0.00 -1.58 -2.51 0.00 0.00 177.63 173.54 1i01 s HIS 130 N -2.98 -0.79 -0.22 -0.14 2.46 -0.69 -4.32 115.29 108.61 1i01 s HIS 130 Ca 0.14 1.73 -0.35 0.00 0.47 0.00 0.00 55.06 57.05 1i01 s HIS 130 Cb -0.06 0.43 0.15 0.00 -0.13 0.00 0.00 32.58 32.96 1i01 s HIS 130 CO 0.17 -0.39 1.24 0.20 -2.47 0.00 0.00 174.74 173.50 1i01 s GLY 131 N 0.94 -0.22 -0.03 1.59 0.00 -0.79 -4.59 107.32 104.23 1i01 s GLY 131 Ca -0.04 1.84 0.00 0.00 0.00 0.00 0.00 44.72 46.53 1i01 s GLY 131 CO -0.10 0.66 -0.00 0.50 0.00 0.00 0.00 173.10 174.15 1i01 s ARG 132 N -2.09 0.29 -0.15 2.90 1.81 -0.69 -1.61 118.95 119.41 1i01 s ARG 132 Ca 0.09 0.05 -0.01 0.00 -1.72 0.00 0.00 55.73 54.14 1i01 s ARG 132 Cb -0.01 -0.45 0.04 0.00 -0.45 0.00 0.00 34.95 34.08 1i01 s ARG 132 CO -0.04 -0.11 -0.04 0.42 -0.68 0.00 0.00 175.30 174.85 1i01 s ILE 133 N 0.87 0.97 -0.09 1.52 1.01 -0.16 -0.80 121.20 124.53 1i01 s ILE 133 Ca -0.09 -0.52 0.03 0.00 0.00 0.00 0.00 60.65 60.07 1i01 s ILE 133 Cb -0.12 -1.16 0.01 0.00 0.01 0.00 0.00 42.46 41.19 1i01 s ILE 133 CO -0.01 0.13 -0.17 -0.63 0.00 0.00 0.00 174.94 174.26 1i01 s ILE 134 N 1.69 1.54 -0.11 2.92 1.01 0.40 -0.99 121.20 127.67 1i01 s ILE 134 Ca 0.01 -0.70 0.00 0.00 0.00 0.00 0.00 60.65 59.97 1i01 s ILE 134 Cb -0.15 -1.38 -0.02 0.00 0.01 0.00 0.00 42.46 40.92 1i01 s ILE 134 CO -0.08 0.45 -0.12 -0.89 0.00 0.00 0.00 174.94 174.31 1i01 s THR 135 N 0.68 3.23 -0.21 2.92 2.01 -0.61 -0.57 115.64 123.08 1i01 s THR 135 Ca -0.13 -0.62 -0.13 0.00 0.31 0.00 0.00 61.69 61.12 1i01 s THR 135 Cb -0.16 -2.34 -0.05 0.00 0.01 0.00 0.00 72.50 69.96 1i01 s THR 135 CO 0.03 0.54 0.25 -0.63 -0.69 0.00 0.00 174.62 174.13 1i01 s ILE 136 N -0.02 5.31 0.72 1.82 1.09 0.48 -1.10 121.20 129.50 1i01 s ILE 136 Ca -0.03 0.41 -0.12 0.00 -1.10 0.00 0.00 60.65 59.82 1i01 s ILE 136 Cb -0.14 -3.59 0.03 0.00 -1.06 0.00 0.00 42.46 37.70 1i01 s ILE 136 CO 0.04 0.34 1.08 -0.83 -0.10 0.00 0.00 174.94 175.47 1i01 s GLY 137 N 0.85 1.79 0.14 6.18 0.00 -0.04 -4.73 107.32 111.51 1i01 s GLY 137 Ca 0.13 0.28 -0.31 0.00 0.00 0.00 0.00 44.72 44.82 1i01 s GLY 137 CO 0.05 0.62 1.56 -1.35 0.00 0.00 0.00 173.10 173.97 1i01 s SER 138 N -3.30 6.62 -0.04 1.64 1.04 -1.26 -4.58 113.70 113.82 1i01 s SER 138 Ca 0.62 2.55 -0.30 0.00 0.48 0.00 0.00 55.95 59.29 1i01 s SER 138 Cb -0.17 -2.59 -0.05 0.00 0.10 0.00 0.00 66.02 63.32 1i01 s SER 138 CO 0.52 -0.81 1.46 -0.69 0.98 0.00 0.00 173.24 174.70 1i01 s VAL 139 N 1.45 3.74 0.11 5.02 1.01 -1.26 -4.86 120.40 125.61 1i01 s VAL 139 Ca 0.70 1.03 -0.36 0.00 0.00 0.00 0.00 61.98 63.35 1i01 s VAL 139 Cb -0.42 -3.66 -0.16 0.00 0.00 0.00 0.00 36.38 32.14 1i01 s VAL 139 CO 0.31 -0.04 1.33 0.52 0.00 0.00 0.00 175.10 177.22 1i01 n VAL 140 N 5.02 0.19 0.00 2.92 0.31 -1.25 -5.04 118.33 120.48 1i01 n VAL 140 Ca 0.15 -0.05 0.00 0.00 -0.01 0.00 0.00 64.34 64.43 1i01 n VAL 140 Cb 0.43 -0.91 0.00 0.00 -0.91 0.00 0.00 33.84 32.45 1i01 n VAL 140 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1i01 n ALA 149 N 2.40 1.95 1.64 3.52 0.00 -1.26 -5.07 120.51 123.69 1i01 n ALA 149 Ca 0.17 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.72 1i01 n ALA 149 Cb 0.21 0.14 0.51 0.00 0.00 0.00 0.00 19.45 20.31 1i01 n ALA 149 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1i01 n ASN 150 N -1.73 0.82 -0.08 0.00 6.94 -1.26 -3.35 115.26 116.61 1i01 n ASN 150 Ca 0.00 -1.51 0.02 0.00 -0.02 0.00 0.00 54.58 53.07 1i01 n ASN 150 Cb 0.27 -0.04 -0.01 0.00 -2.36 0.00 0.00 39.78 37.64 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 -0.27 0.00 -0.22 -2.53 4.02 -1.26 -4.74 117.16 112.16 1i01 n TYR 151 Ca 0.16 0.00 -0.03 0.00 -0.01 0.00 0.00 57.90 58.02 1i01 n TYR 151 Cb 0.20 0.00 0.08 0.00 -0.02 0.00 0.00 39.34 39.60 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 0.73 0.84 0.79 -0.72 0.00 -1.98 0.66 119.26 119.59 1i01 h ALA 152 Ca 0.00 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.87 1i01 h ALA 152 Cb 0.14 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 17.77 1i01 h ALA 152 CO 0.00 0.10 -0.38 0.00 0.00 0.00 0.00 179.25 178.96 1i01 h ALA 153 N 1.30 -1.07 -0.90 0.00 0.00 -1.85 0.21 119.26 116.95 1i01 h ALA 153 Ca 0.27 -0.24 0.09 0.00 0.00 0.00 0.00 54.91 55.03 1i01 h ALA 153 Cb 0.09 0.41 -0.07 0.00 0.00 0.00 0.00 17.79 18.22 1i01 h ALA 153 CO -0.14 -1.07 0.55 0.00 0.00 0.00 0.00 179.25 178.60 1i01 h ALA 154 N -0.97 1.29 -0.28 0.00 0.00 -1.86 0.18 119.26 117.62 1i01 h ALA 154 Ca -0.11 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 1i01 h ALA 154 Cb 0.83 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1i01 h ALA 154 CO 0.18 0.22 0.07 -0.22 0.00 0.00 0.00 179.25 179.51 1i01 h LYS 155 N 0.94 0.44 -0.28 0.00 3.64 -0.67 -0.24 116.57 120.40 1i01 h LYS 155 Ca 0.42 -0.10 -0.13 0.00 -1.27 0.00 0.00 60.65 59.57 1i01 h LYS 155 Cb 0.32 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.07 1i01 h LYS 155 CO -0.22 0.52 -0.36 0.00 -2.27 0.00 0.00 179.45 177.12 1i01 h ALA 156 N 0.90 0.86 -0.22 5.00 0.00 -0.14 -2.57 119.26 123.09 1i01 h ALA 156 Ca 0.09 -0.42 -0.09 0.00 0.00 0.00 0.00 54.91 54.49 1i01 h ALA 156 Cb 0.27 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 1i01 h ALA 156 CO -0.00 0.64 -0.26 0.78 0.00 0.00 0.00 179.25 180.40 1i01 h GLY 157 N 1.02 0.45 0.94 0.00 0.00 -0.47 -1.72 103.07 103.29 1i01 h GLY 157 Ca 0.05 -0.36 -0.02 0.00 0.00 0.00 0.00 47.33 47.00 1i01 h GLY 157 CO 0.07 0.33 0.16 -2.00 0.00 0.00 0.00 176.54 175.11 1i01 h LEU 158 N 0.37 0.50 -0.65 3.11 5.85 -0.78 0.88 115.31 124.59 1i01 h LEU 158 Ca 0.05 -0.15 -0.09 0.00 0.84 0.00 0.00 57.88 58.53 1i01 h LEU 158 Cb 0.66 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.54 1i01 h LEU 158 CO 0.05 0.52 0.01 0.40 -0.34 0.00 0.00 178.44 179.08 1i01 h ILE 159 N 0.46 1.26 -0.65 4.05 2.04 -1.24 -1.06 117.51 122.37 1i01 h ILE 159 Ca 0.13 -1.14 -0.08 0.00 1.00 0.00 0.00 64.86 64.77 1i01 h ILE 159 Cb 0.16 0.78 -0.03 0.00 -0.74 0.00 0.00 36.82 37.00 1i01 h ILE 159 CO -0.01 0.41 0.11 1.23 0.00 0.00 0.00 178.15 179.89 1i01 h GLY 160 N 1.00 1.17 0.95 5.37 0.00 -1.05 -1.59 103.07 108.91 1i01 h GLY 160 Ca 0.17 -0.77 -0.03 0.00 0.00 0.00 0.00 47.33 46.70 1i01 h GLY 160 CO 0.03 0.72 0.15 -2.75 0.00 0.00 0.00 176.54 174.68 1i01 h PHE 161 N 1.00 0.67 -0.59 5.60 3.57 -0.58 -2.34 116.94 124.26 1i01 h PHE 161 Ca 0.20 -0.06 -0.04 0.00 3.53 0.00 0.00 57.97 61.60 1i01 h PHE 161 Cb 0.44 -0.20 -0.03 0.00 2.79 0.00 0.00 35.95 38.95 1i01 h PHE 161 CO 0.03 0.60 0.21 0.77 -2.23 0.00 0.00 178.31 177.69 1i01 h SER 162 N 0.54 0.84 -0.66 0.41 0.02 -0.98 0.89 113.55 114.61 1i01 h SER 162 Ca 0.14 -0.19 -0.07 0.00 -0.84 0.00 0.00 61.79 60.83 1i01 h SER 162 Cb 0.24 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 62.53 1i01 h SER 162 CO -0.01 0.81 0.15 0.11 -1.14 0.00 0.00 176.83 176.74 1i01 h LYS 163 N 0.83 1.09 -0.18 3.45 1.57 -1.25 0.11 116.57 122.19 1i01 h LYS 163 Ca 0.19 -0.26 -0.05 0.00 -1.87 0.00 0.00 60.65 58.66 1i01 h LYS 163 Cb 0.25 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.41 1i01 h LYS 163 CO -0.01 0.97 -0.07 1.03 -0.57 0.00 0.00 179.45 180.79 1i01 h SER 164 N 1.03 0.38 -0.53 0.86 0.87 -1.14 -2.80 113.55 112.22 1i01 h SER 164 Ca 0.21 -0.40 -0.07 0.00 -1.23 0.00 0.00 61.79 60.30 1i01 h SER 164 Cb 0.39 -0.11 -0.02 0.00 -0.44 0.00 0.00 62.40 62.22 1i01 h SER 164 CO 0.01 0.70 0.06 0.25 -0.53 0.00 0.00 176.83 177.31 1i01 h LEU 165 N 0.07 0.91 -0.65 2.23 5.85 -0.71 -2.76 115.31 120.24 1i01 h LEU 165 Ca 0.04 -0.21 0.08 0.00 0.84 0.00 0.00 57.88 58.63 1i01 h LEU 165 Cb 0.54 -0.24 -0.06 0.00 0.37 0.00 0.00 40.66 41.27 1i01 h LEU 165 CO 0.02 0.93 0.32 0.00 -0.34 0.00 0.00 178.44 179.37 1i01 h ALA 166 N 1.17 0.87 -0.51 1.25 0.00 -0.69 -1.45 119.26 119.91 1i01 h ALA 166 Ca 0.18 0.05 -0.10 0.00 0.00 0.00 0.00 54.91 55.04 1i01 h ALA 166 Cb 0.43 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.16 1i01 h ALA 166 CO 0.01 -0.06 -0.06 0.00 0.00 0.00 0.00 179.25 179.14 1i01 h ARG 167 N 0.57 0.91 -0.70 0.00 3.08 -1.25 -1.91 114.38 115.08 1i01 h ARG 167 Ca 0.31 -0.30 -0.08 0.00 0.07 0.00 0.00 59.98 59.99 1i01 h ARG 167 Cb 0.29 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 30.24 1i01 h ARG 167 CO -0.24 0.94 0.14 1.49 -1.07 0.00 0.00 179.97 181.23 1i01 h GLU 168 N 0.83 1.13 -0.28 0.04 4.81 -1.03 -3.28 114.58 116.80 1i01 h GLU 168 Ca 0.14 -0.29 0.00 0.00 -0.13 0.00 0.00 59.36 59.08 1i01 h GLU 168 Cb 0.58 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.82 1i01 h GLU 168 CO 0.04 1.01 0.00 1.33 -0.73 0.00 0.00 179.01 180.66 1i01 n VAL 169 N -4.22 0.57 -0.28 0.32 0.24 -0.64 -4.63 118.33 109.69 1i01 n VAL 169 Ca 0.05 -0.79 0.01 0.00 -2.04 0.00 0.00 64.34 61.58 1i01 n VAL 169 Cb 0.28 0.85 0.22 0.00 -1.47 0.00 0.00 33.84 33.72 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 2.90 1.45 0.00 2.33 0.00 -1.40 -2.36 119.26 122.17 1i01 h ALA 170 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1i01 h ALA 170 Cb 0.74 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1i01 h ALA 170 CO 0.00 0.48 0.00 -1.13 0.00 0.00 0.00 179.25 178.60 1i01 n SER 171 N -4.44 0.58 -1.72 0.00 3.41 -1.26 -2.32 113.62 107.87 1i01 n SER 171 Ca 0.11 0.66 0.00 0.00 -0.26 0.00 0.00 58.87 59.38 1i01 n SER 171 Cb 0.09 -0.77 0.32 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 -2.15 3.78 -1.77 4.33 5.12 -0.89 -4.93 116.66 120.13 1i01 n ARG 172 Ca 0.02 -3.08 -0.07 0.00 -1.93 0.00 0.00 57.85 52.79 1i01 n ARG 172 Cb 0.20 -2.14 -0.01 0.00 -1.16 0.00 0.00 32.46 29.35 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 -0.08 0.39 3.39 -0.13 0.00 -0.98 -3.24 105.19 104.53 1i01 n GLY 173 Ca 0.34 -0.67 -0.33 0.00 0.00 0.00 0.00 46.02 45.36 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 -2.30 2.94 -0.00 -0.61 1.01 -1.21 -1.88 121.20 119.15 1i01 s ILE 174 Ca 0.00 -0.72 0.04 0.00 0.00 0.00 0.00 60.65 59.96 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 -0.09 0.42 0.00 0.00 0.00 174.94 175.81 1i01 s THR 175 N 0.02 3.46 -0.17 2.92 -4.23 -0.63 -3.97 115.64 113.04 1i01 s THR 175 Ca -0.05 -0.80 -0.00 0.00 -1.18 0.00 0.00 61.69 59.66 1i01 s THR 175 Cb -0.14 -2.47 0.04 0.00 1.34 0.00 0.00 72.50 71.26 1i01 s THR 175 CO 0.04 0.43 -0.08 -0.69 -0.54 0.00 0.00 174.62 173.78 1i01 s VAL 176 N -0.94 1.30 0.26 2.29 1.01 -1.26 -0.99 120.40 122.08 1i01 s VAL 176 Ca 0.16 -0.71 0.02 0.00 0.00 0.00 0.00 61.98 61.45 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 0.06 0.19 0.06 0.20 0.00 0.00 0.00 175.10 175.61 1i01 s ASN 177 N 1.56 1.55 -0.03 3.32 0.01 -0.16 -0.05 114.94 121.14 1i01 s ASN 177 Ca 0.01 -1.33 0.03 0.00 -0.71 0.00 0.00 52.86 50.86 1i01 s ASN 177 Cb -0.15 0.08 -0.00 0.00 0.41 0.00 0.00 41.25 41.59 1i01 s ASN 177 CO -0.08 -0.65 -0.12 -0.69 -1.51 0.00 0.00 177.10 174.05 1i01 s VAL 178 N -3.59 1.01 -0.19 1.60 1.01 -0.32 -1.58 120.40 118.35 1i01 s VAL 178 Ca 0.34 -0.50 -0.02 0.00 0.00 0.00 0.00 61.98 61.80 1i01 s VAL 178 Cb 0.07 -0.88 -0.00 0.00 0.00 0.00 0.00 36.38 35.57 1i01 s VAL 178 CO 0.12 0.30 -0.09 -0.69 0.00 0.00 0.00 175.10 174.74 1i01 s VAL 179 N 0.03 3.05 -0.48 2.92 1.01 -0.26 0.09 120.40 126.76 1i01 s VAL 179 Ca -0.01 -0.62 -0.06 0.00 0.00 0.00 0.00 61.98 61.29 1i01 s VAL 179 Cb -0.08 -2.35 0.13 0.00 0.00 0.00 0.00 36.38 34.07 1i01 s VAL 179 CO 0.01 0.47 0.32 0.00 0.00 0.00 0.00 175.10 175.90 1i01 s ALA 180 N 1.19 3.36 0.60 5.51 0.00 -0.19 -0.86 121.76 131.37 1i01 s ALA 180 Ca 0.02 -2.68 -0.15 0.00 0.00 0.00 0.00 51.96 49.15 1i01 s ALA 180 Cb -0.14 -2.68 -0.03 0.00 0.00 0.00 0.00 23.12 20.27 1i01 s ALA 180 CO -0.03 -1.91 1.05 -1.25 0.00 0.00 0.00 175.76 173.62 1i01 s PRO 181 N 1.02 3.32 0.00 0.00 0.04 -1.26 -1.58 135.00 136.54 1i01 s PRO 181 Ca 0.09 1.16 0.00 0.00 0.04 0.00 0.00 61.00 62.29 1i01 s PRO 181 Cb -0.23 -2.03 0.00 0.00 0.04 0.00 0.00 34.50 32.27 1i01 s PRO 181 CO -0.03 -0.81 0.00 0.41 0.04 0.00 0.00 177.00 176.62 1i01 n GLY 182 N -1.14 0.56 3.65 0.56 0.00 -0.64 -4.54 105.19 103.64 1i01 n GLY 182 Ca 0.08 0.00 -0.42 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 3.99 3.30 -0.11 1.61 0.40 -1.26 -3.76 117.98 122.15 1i01 s PHE 183 Ca 0.00 1.24 0.02 0.00 -0.60 0.00 0.00 56.93 57.59 1i01 s PHE 183 Cb 0.00 -3.21 -0.01 0.00 0.51 0.00 0.00 43.02 40.30 1i01 s PHE 183 CO 0.00 -0.48 -0.17 0.42 0.70 0.00 0.00 175.22 175.69 1i01 s ILE 184 N 3.07 2.73 0.05 0.64 1.09 -1.26 -1.37 121.20 126.15 1i01 s ILE 184 Ca 0.39 -0.79 -0.32 0.00 -1.10 0.00 0.00 60.65 58.83 1i01 s ILE 184 Cb -0.15 -2.11 -0.11 0.00 -1.06 0.00 0.00 42.46 39.04 1i01 s ILE 184 CO 0.08 0.54 1.85 1.21 -0.10 0.00 0.00 174.94 178.52 1i01 n GLU 185 N 3.35 2.56 0.00 2.79 4.07 -0.43 -4.89 120.64 128.08 1i01 n GLU 185 Ca -0.18 0.93 0.00 0.00 -0.06 0.00 0.00 57.16 57.85 1i01 n GLU 185 Cb 0.53 -2.81 0.00 0.00 -0.06 0.00 0.00 31.44 29.10 1i01 n GLU 185 CO 0.00 0.00 0.00 0.25 -0.06 0.00 0.00 177.13 177.32 1i01 n THR 186 N 4.85 0.00 0.00 6.31 -2.24 -1.26 -4.64 114.28 117.29 1i01 n THR 186 Ca 0.20 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.89 1i01 n THR 186 Cb 0.35 0.94 0.00 0.00 -2.10 0.00 0.00 70.33 69.52 1i01 n THR 186 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1i01 n ALA 191 N -0.19 0.00 -0.87 6.98 0.00 -1.26 -5.23 120.51 119.94 1i01 n ALA 191 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.09 1i01 n ALA 191 Cb 0.00 0.00 0.09 0.00 0.00 0.00 0.00 19.45 19.54 1i01 n ALA 191 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1i01 n LEU 192 N 0.00 -2.92 -4.87 0.00 4.32 -1.26 -4.99 117.00 107.28 1i01 n LEU 192 Ca 0.00 0.11 -0.31 0.00 -0.02 0.00 0.00 56.01 55.80 1i01 n LEU 192 Cb 0.00 -0.88 -0.01 0.00 -1.62 0.00 0.00 43.42 40.91 1i01 n LEU 192 CO 0.00 -3.96 0.62 -0.94 -1.22 0.00 0.00 177.39 171.90 1i01 s SER 193 N -1.48 6.37 0.42 -1.43 1.04 -1.26 -4.84 113.70 112.53 1i01 s SER 193 Ca 0.48 1.33 0.20 0.00 0.48 0.00 0.00 55.95 58.44 1i01 s SER 193 Cb -0.11 -2.42 1.14 0.00 0.10 0.00 0.00 66.02 64.73 1i01 s SER 193 CO 0.71 -0.68 1.81 0.44 0.98 0.00 0.00 173.24 176.50 1i01 h ASP 194 N 0.30 0.38 0.07 7.02 3.32 -1.99 -0.48 116.42 125.05 1i01 h ASP 194 Ca -0.46 0.06 -0.16 0.00 0.02 0.00 0.00 57.03 56.50 1i01 h ASP 194 Cb 1.19 -0.01 -0.01 0.00 0.22 0.00 0.00 39.33 40.73 1i01 h ASP 194 CO 0.62 0.11 -0.55 -0.78 -1.72 0.00 0.00 179.24 176.92 1i01 h ASP 195 N 0.36 0.57 -0.05 6.45 3.58 -1.99 -0.47 116.42 124.87 1i01 h ASP 195 Ca 0.54 -0.30 -0.05 0.00 0.42 0.00 0.00 57.03 57.64 1i01 h ASP 195 Cb 1.46 -0.16 0.00 0.00 1.72 0.00 0.00 39.33 42.34 1i01 h ASP 195 CO -0.22 1.00 -0.18 1.56 -2.88 0.00 0.00 179.24 178.52 1i01 h GLN 196 N 0.39 0.20 -1.00 0.28 4.20 -1.51 -2.49 115.11 115.19 1i01 h GLN 196 Ca 0.01 -0.16 0.03 0.00 0.06 0.00 0.00 58.65 58.59 1i01 h GLN 196 Cb 1.08 0.03 -0.06 0.00 0.30 0.00 0.00 27.48 28.84 1i01 h GLN 196 CO 0.10 0.79 0.66 -0.09 -0.67 0.00 0.00 178.83 179.62 1i01 h ARG 197 N -0.34 1.24 -0.71 1.46 2.43 -1.25 -1.48 114.38 115.74 1i01 h ARG 197 Ca -0.01 -0.07 -0.07 0.00 -0.81 0.00 0.00 59.98 59.02 1i01 h ARG 197 Cb 0.81 -0.28 -0.03 0.00 -0.42 0.00 0.00 29.97 30.05 1i01 h ARG 197 CO 0.04 0.82 0.18 0.00 -1.51 0.00 0.00 179.97 179.50 1i01 h ALA 198 N 1.41 0.93 -0.52 2.80 0.00 -1.11 -0.23 119.26 122.54 1i01 h ALA 198 Ca 0.39 -0.25 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 1i01 h ALA 198 Cb -0.02 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 17.47 1i01 h ALA 198 CO -0.12 0.65 0.29 0.78 0.00 0.00 0.00 179.25 180.86 1i01 h GLY 199 N 1.07 0.75 0.42 0.00 0.00 -0.82 -0.87 103.07 103.62 1i01 h GLY 199 Ca 0.22 -0.31 -0.01 0.00 0.00 0.00 0.00 47.33 47.23 1i01 h GLY 199 CO 0.00 0.30 -0.10 -2.22 0.00 0.00 0.00 176.54 174.52 1i01 h ILE 200 N 0.71 0.75 -0.64 2.60 2.04 -0.80 -3.24 117.51 118.92 1i01 h ILE 200 Ca 0.18 -0.99 0.19 0.00 1.00 0.00 0.00 64.86 65.24 1i01 h ILE 200 Cb 0.00 1.23 -0.03 0.00 -0.74 0.00 0.00 36.82 37.28 1i01 h ILE 200 CO -0.03 0.18 0.46 -0.07 0.00 0.00 0.00 178.15 178.69 1i01 h LEU 201 N -0.86 0.00 -1.66 1.44 3.38 -0.81 0.26 115.31 117.06 1i01 h LEU 201 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1i01 h LEU 201 Cb 0.51 -0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.26 1i01 h LEU 201 CO 0.05 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.58 1i01 h ALA 202 N 1.68 1.00 -0.00 1.53 0.00 -1.18 -2.48 119.26 119.81 1i01 h ALA 202 Ca 0.31 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.22 1i01 h ALA 202 Cb 1.22 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1i01 h ALA 202 CO -0.00 0.00 -0.50 1.04 0.00 0.00 0.00 179.25 179.79 1i01 n GLN 203 N -2.88 0.24 -3.91 0.00 6.02 0.92 -4.84 117.38 112.94 1i01 n GLN 203 Ca -0.00 -0.15 -0.35 0.00 -0.01 0.00 0.00 57.00 56.49 1i01 n GLN 203 Cb 0.22 -1.50 -0.14 0.00 1.02 0.00 0.00 30.24 29.85 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 -2.86 3.08 0.37 5.09 1.01 -0.93 -4.60 120.40 121.56 1i01 s VAL 204 Ca 0.14 -1.10 0.11 0.00 0.00 0.00 0.00 61.98 61.13 1i01 s VAL 204 Cb 0.18 -2.64 0.33 0.00 0.00 0.00 0.00 36.38 34.25 1i01 s VAL 204 CO 0.67 0.07 1.88 -0.65 0.00 0.00 0.00 175.10 177.07 1i01 h PRO 205 N 8.04 0.60 -0.29 2.72 0.11 -1.75 -0.90 132.00 140.52 1i01 h PRO 205 Ca -0.29 -0.04 0.01 0.00 0.11 0.00 0.00 66.00 65.80 1i01 h PRO 205 Cb 1.09 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.06 1i01 h PRO 205 CO 0.57 0.39 0.19 0.00 -0.21 0.00 0.00 178.00 178.94 1i01 h ALA 206 N 1.61 1.81 0.00 -0.75 0.00 -1.74 -3.47 119.26 116.72 1i01 h ALA 206 Ca 0.43 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.33 1i01 h ALA 206 Cb 0.78 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1i01 h ALA 206 CO -0.19 0.17 0.00 0.41 0.00 0.00 0.00 179.25 179.64 1i01 n GLY 207 N -1.50 0.68 3.50 0.00 0.00 -0.35 -5.05 105.19 102.48 1i01 n GLY 207 Ca 0.01 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.34 1.48 0.30 1.61 1.70 -1.26 -5.01 118.95 117.43 1i01 s ARG 208 Ca 0.00 -1.36 -0.04 0.00 -0.47 0.00 0.00 55.73 53.86 1i01 s ARG 208 Cb 0.00 0.42 -0.05 0.00 -0.57 0.00 0.00 34.95 34.75 1i01 s ARG 208 CO 0.00 -0.59 0.55 -0.51 -1.08 0.00 0.00 175.30 173.67 1i01 s LEU 209 N -3.06 4.05 0.50 -1.89 1.43 -1.26 -5.00 118.68 113.44 1i01 s LEU 209 Ca 0.27 0.68 -0.06 0.00 -1.03 0.00 0.00 54.13 53.99 1i01 s LEU 209 Cb 0.01 -3.51 -0.04 0.00 0.03 0.00 0.00 46.19 42.69 1i01 s LEU 209 CO 0.10 -0.21 0.82 -0.83 0.23 0.00 0.00 176.35 176.47 1i01 s GLY 210 N -3.26 1.53 0.22 -3.19 0.00 -0.47 -4.76 107.32 97.38 1i01 s GLY 210 Ca 0.43 -0.43 -0.01 0.00 0.00 0.00 0.00 44.72 44.71 1i01 s GLY 210 CO 0.31 -0.25 0.42 -0.32 0.00 0.00 0.00 173.10 173.25 1i01 s GLY 211 N -4.09 1.80 0.37 0.20 0.00 -1.26 -1.32 107.32 103.02 1i01 s GLY 211 Ca 0.49 -0.79 0.08 0.00 0.00 0.00 0.00 44.72 44.50 1i01 s GLY 211 CO 0.46 -0.73 1.95 0.00 0.00 0.00 0.00 173.10 174.78 1i01 h ALA 212 N 1.93 1.78 0.00 3.20 0.00 -1.93 -0.81 119.26 123.44 1i01 h ALA 212 Ca -0.48 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.39 1i01 h ALA 212 Cb 1.19 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.81 1i01 h ALA 212 CO 0.68 0.09 -0.13 0.37 0.00 0.00 0.00 179.25 180.25 1i01 h GLN 213 N 0.68 0.00 -0.10 0.00 5.75 -1.93 -2.22 115.11 117.29 1i01 h GLN 213 Ca 0.32 0.00 -0.11 0.00 -0.15 0.00 0.00 58.65 58.72 1i01 h GLN 213 Cb 0.37 0.00 -0.01 0.00 1.07 0.00 0.00 27.48 28.91 1i01 h GLN 213 CO -0.11 0.13 -0.41 0.93 -2.65 0.00 0.00 178.83 176.71 1i01 h GLU 214 N 0.00 0.21 -0.10 1.69 5.08 -1.53 -0.00 114.58 119.92 1i01 h GLU 214 Ca -0.00 -0.10 -0.22 0.00 -1.00 0.00 0.00 59.36 58.04 1i01 h GLU 214 Cb 0.25 -0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.51 1i01 h GLU 214 CO 0.02 0.60 -0.82 0.82 -1.00 0.00 0.00 179.01 178.62 1i01 h ILE 215 N 0.18 1.31 -0.48 3.13 5.03 -1.44 -3.07 117.51 122.18 1i01 h ILE 215 Ca 0.02 -2.09 -0.04 0.00 -0.12 0.00 0.00 64.86 62.63 1i01 h ILE 215 Cb 0.81 2.10 -0.02 0.00 -3.03 0.00 0.00 36.82 36.68 1i01 h ILE 215 CO 0.06 0.65 0.12 0.00 -0.68 0.00 0.00 178.15 178.30 1i01 h ALA 216 N 0.64 1.31 -0.65 1.87 0.00 -1.03 -1.38 119.26 120.02 1i01 h ALA 216 Ca -0.06 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.59 1i01 h ALA 216 Cb 1.44 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 19.01 1i01 h ALA 216 CO 0.16 0.49 0.10 -0.91 0.00 0.00 0.00 179.25 179.09 1i01 h ASN 217 N 0.70 1.04 -0.46 0.00 2.35 -0.98 0.53 115.58 118.75 1i01 h ASN 217 Ca 0.16 -0.26 -0.08 0.00 -0.55 0.00 0.00 56.30 55.56 1i01 h ASN 217 Cb 0.26 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.34 1i01 h ASN 217 CO -0.00 1.04 -0.04 0.00 -1.65 0.00 0.00 177.43 176.77 1i01 h ALA 218 N 1.04 0.62 -0.26 -0.83 0.00 -1.36 -1.52 119.26 116.95 1i01 h ALA 218 Ca 0.20 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1i01 h ALA 218 Cb 0.44 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1i01 h ALA 218 CO 0.01 0.46 0.09 0.28 0.00 0.00 0.00 179.25 180.10 1i01 h VAL 219 N 0.68 1.19 -1.00 0.00 2.07 -1.06 -1.82 116.25 116.30 1i01 h VAL 219 Ca 0.12 -0.59 0.08 0.00 0.82 0.00 0.00 66.70 67.14 1i01 h VAL 219 Cb 0.56 1.08 -0.07 0.00 -1.52 0.00 0.00 31.29 31.35 1i01 h VAL 219 CO 0.03 0.19 0.64 0.00 0.02 0.00 0.00 177.57 178.46 1i01 h ALA 220 N 0.93 1.44 0.04 1.67 0.00 -0.75 -0.52 119.26 122.06 1i01 h ALA 220 Ca 0.09 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1i01 h ALA 220 Cb 0.21 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1i01 h ALA 220 CO -0.00 0.38 -0.02 0.35 0.00 0.00 0.00 179.25 179.96 1i01 h PHE 221 N 1.13 -0.04 0.00 0.00 3.57 -0.97 -2.59 116.94 118.03 1i01 h PHE 221 Ca 0.45 -0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.91 1i01 h PHE 221 Cb 0.26 0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.01 1i01 h PHE 221 CO -0.00 0.15 -0.18 -0.07 -2.23 0.00 0.00 178.31 175.98 1i01 h LEU 222 N -0.23 0.00 -0.14 0.59 3.38 -0.81 -2.38 115.31 115.71 1i01 h LEU 222 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 1i01 h LEU 222 Cb 0.22 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.96 1i01 h LEU 222 CO 0.01 0.18 -0.04 0.00 0.09 0.00 0.00 178.44 178.67 1i01 h ALA 223 N 1.82 0.97 -2.52 1.53 0.00 -0.99 -3.44 119.26 116.64 1i01 h ALA 223 Ca -0.00 -0.04 -0.47 0.00 0.00 0.00 0.00 54.91 54.40 1i01 h ALA 223 Cb 0.37 -0.01 0.12 0.00 0.00 0.00 0.00 17.79 18.27 1i01 h ALA 223 CO 0.02 0.05 0.34 -1.54 0.00 0.00 0.00 179.25 178.12 1i01 s SER 224 N -6.18 3.93 0.51 0.00 1.04 -0.90 -4.94 113.70 107.16 1i01 s SER 224 Ca 0.06 0.96 0.33 0.00 0.48 0.00 0.00 55.95 57.77 1i01 s SER 224 Cb 0.06 -1.53 1.35 0.00 0.10 0.00 0.00 66.02 65.99 1i01 s SER 224 CO 0.66 -2.29 1.96 0.44 0.98 0.00 0.00 173.24 174.99 1i01 h ASP 225 N -1.32 0.00 0.26 7.02 3.32 -1.90 -2.82 116.42 120.98 1i01 h ASP 225 Ca -0.49 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.56 1i01 h ASP 225 Cb 1.32 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.87 1i01 h ASP 225 CO 0.63 0.00 0.00 -0.62 -1.72 0.00 0.00 179.24 177.53 1i01 n GLU 226 N -2.96 0.19 -1.16 3.56 1.02 -1.26 -2.60 120.64 117.44 1i01 n GLU 226 Ca 0.01 0.16 0.02 0.00 -0.02 0.00 0.00 57.16 57.33 1i01 n GLU 226 Cb 0.28 -1.50 0.12 0.00 -0.02 0.00 0.00 31.44 30.32 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 -1.29 3.28 0.27 0.62 0.00 -1.06 -4.84 120.51 117.50 1i01 n ALA 227 Ca 0.06 -3.00 0.15 0.00 0.00 0.00 0.00 53.44 50.66 1i01 n ALA 227 Cb 0.11 -0.51 0.78 0.00 0.00 0.00 0.00 19.45 19.83 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 1.20 1.19 -0.59 0.00 0.00 -1.65 -2.54 119.26 116.87 1i01 h ALA 228 Ca -0.05 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1i01 h ALA 228 Cb 1.37 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.14 1i01 h ALA 228 CO 0.11 0.11 0.00 0.98 0.00 0.00 0.00 179.25 180.45 1i01 n TYR 229 N -3.47 0.78 -3.68 0.00 9.36 -1.26 -4.85 117.16 114.04 1i01 n TYR 229 Ca -0.02 -0.39 -0.38 0.00 3.32 0.00 0.00 57.90 60.43 1i01 n TYR 229 Cb 0.23 0.00 -0.12 0.00 -0.63 0.00 0.00 39.34 38.82 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 -1.22 4.47 -0.08 2.97 1.01 -0.96 -5.07 121.20 122.32 1i01 s ILE 230 Ca 0.45 -0.43 -0.19 0.00 0.00 0.00 0.00 60.65 60.47 1i01 s ILE 230 Cb 0.25 -3.26 0.04 0.00 0.01 0.00 0.00 42.46 39.50 1i01 s ILE 230 CO 0.33 0.10 0.46 0.28 0.00 0.00 0.00 174.94 176.11 1i01 s THR 231 N 1.60 0.02 -0.51 2.92 -1.32 -1.26 -4.69 115.64 112.40 1i01 s THR 231 Ca 0.04 -0.20 0.00 0.00 -1.21 0.00 0.00 61.69 60.32 1i01 s THR 231 Cb -0.17 -0.73 0.00 0.00 -1.51 0.00 0.00 72.50 70.09 1i01 s THR 231 CO 0.05 -0.11 0.00 0.61 -2.21 0.00 0.00 174.62 172.96 1i01 n GLY 232 N 1.69 0.75 3.86 6.08 0.00 0.92 -4.95 105.19 113.54 1i01 n GLY 232 Ca -0.18 -0.65 -0.32 0.00 0.00 0.00 0.00 46.02 44.87 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 -2.14 3.25 -0.35 1.61 2.56 -1.26 -4.75 118.70 117.63 1i01 s GLU 233 Ca 0.00 -0.48 -0.03 0.00 0.00 0.00 0.00 54.97 54.46 1i01 s GLU 233 Cb 0.00 -2.95 0.07 0.00 2.00 0.00 0.00 34.13 33.25 1i01 s GLU 233 CO 0.00 0.62 0.09 0.99 -0.56 0.00 0.00 175.26 176.40 1i01 s THR 234 N -1.39 3.21 -0.43 -1.70 2.01 -1.26 -1.17 115.64 114.91 1i01 s THR 234 Ca 0.30 -1.59 -0.21 0.00 0.31 0.00 0.00 61.69 60.50 1i01 s THR 234 Cb -0.13 -2.98 0.02 0.00 0.01 0.00 0.00 72.50 69.43 1i01 s THR 234 CO 0.22 -0.33 0.66 -0.22 -0.69 0.00 0.00 174.62 174.26 1i01 s LEU 235 N 1.23 4.44 -0.03 4.42 2.96 0.11 -4.91 118.68 126.91 1i01 s LEU 235 Ca 0.00 -0.25 -0.24 0.00 -0.22 0.00 0.00 54.13 53.42 1i01 s LEU 235 Cb -0.21 -2.76 -0.04 0.00 0.50 0.00 0.00 46.19 43.68 1i01 s LEU 235 CO -0.02 -0.77 0.72 -1.00 -1.32 0.00 0.00 176.35 173.97 1i01 s HIS 236 N 2.85 3.63 -0.58 5.38 3.76 -1.26 -1.02 115.29 128.04 1i01 s HIS 236 Ca 0.24 1.32 0.04 0.00 -0.15 0.00 0.00 55.06 56.51 1i01 s HIS 236 Cb -0.14 -2.81 0.16 0.00 1.11 0.00 0.00 32.58 30.90 1i01 s HIS 236 CO 0.19 0.15 0.40 0.08 -0.85 0.00 0.00 174.74 174.71 1i01 s VAL 237 N 0.54 2.08 0.00 -0.90 1.01 -0.62 -4.90 120.40 117.61 1i01 s VAL 237 Ca 0.38 -3.58 0.00 0.00 0.00 0.00 0.00 61.98 58.78 1i01 s VAL 237 Cb -0.19 -2.39 0.00 0.00 0.00 0.00 0.00 36.38 33.80 1i01 s VAL 237 CO 0.20 -1.02 0.74 -0.46 0.00 0.00 0.00 175.10 174.55 1i01 n ASN 238 N 2.49 0.00 -1.94 3.32 2.04 -1.26 -1.61 115.26 118.30 1i01 n ASN 238 Ca 0.19 -1.48 -0.16 0.00 -0.44 0.00 0.00 54.58 52.69 1i01 n ASN 238 Cb 0.37 -0.10 0.00 0.00 -2.53 0.00 0.00 39.78 37.53 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 0.00 -0.28 2.12 4.83 0.00 -1.26 -3.03 105.19 107.56 1i01 n GLY 239 Ca 0.00 -0.19 -0.05 0.00 0.00 0.00 0.00 46.02 45.79 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 -1.09 0.49 0.00 -0.02 0.00 -1.26 -2.03 105.19 101.29 1i01 n GLY 240 Ca -0.17 -0.78 0.06 0.00 0.00 0.00 0.00 46.02 45.13 1i01 n GLY 240 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19